!Detailed chemical kinetic mechanism for the oxidation of biodiesel fuels blend surrogate !Olivier Herbinet, William J. Pitz and Charles K. Westbrook !Lawrence Livermore National Laboratory !Combustion and Flame, submitted !July 2009 !Methyl Decanoate & n-Heptane !version 2 !LLNL-MI-415050 elements h c o n ar end ! ! ! ! species ar n2 !radicals without o h c ch ch2 ch2(s) ch3 c2h5 nc3h7 pc4h9 sc4h9 c3h5-a c2h3 ic3h7 ic4h9 c2h c3h5-s c3h5-t c3h3 c3h2 c5h11-1 c6h13-1 c7h15-1 c8h17-1 c9h19-1 c5h11-2 c6h13-2 c7h15-2 c8h17-2 c9h19-2 c5h11-3 c6h13-3 c7h15-3 c8h17-3 c9h19-3 c7h15-4 c8h17-4 c9h19-4 c10h21-3 c9h19-5 c9h17-13 c8h15-13 c7h13-13 c6h11-13 c5h9-13 c4h7-13 c9h17-14 c9h17-15 c9h17-16 c9h17-17 c9h17-18 c9h17-19 c8h15-14 c8h15-15 c8h15-16 c8h15-17 c8h15-18 c7h13-14 c7h13-15 c7h13-16 c7h13-17 c6h11-14 c6h11-15 c6h11-16 c5h9-14 c5h9-15 c4h7-14 c9h17-11 c9h17-12 c8h15-11 c8h15-12 c7h13-11 c7h13-12 c6h11-11 c6h11-12 c5h9-11 c5h9-12 c4h7-11 c4h7-12 c4h81ch32 c9h181ch32 c8h161ch32 c7h141ch32 c6h121ch32 c5h101ch32 c8h15-31 c8h15-41 c8h15-38 c8h15-28 c5h9-25 c7h13-31 c7h13-37 c7h13-27 c6h11-31 c6h11-26 !radicals with o o oh ho2 ch2oh ch3o hco ocho o2cho hoch2o hoch2o2 ch3oco c9h19co ch3o2 ch3co ch2co c2h5co c3h7co c4h9co c5h11co c6h13co c7h15co c8h17co c8h17chco c7h15chco c6h13chco c5h11chco c4h9chco c3h7chco c2h5o2 c2h5o ch2cho c2h4o2h c2h4o1-2 c2h3o1-2 ch3co3 ch3co2 hcco pc2h4oh sc2h4oh o2c2h4oh ch3coch2 ch3coch2o2 c2h3co ch2ocho ch3coch2o ch3och2 ch3och2o2 hoch2oco ch2och2o2h ch3och2o o2ch2och2o2h och2ocho nc3h7o2 ic3h7o2 c3h6o1-2 hoc3h6o2 c3h5o c2h3ooh c3h6ooh2-1 c3h6ooh2-2 c3h6o1-3 c3h6ooh1-2 c3h6ooh1-3 c3h6ooh1-2o2 c3h6ooh1-3o2 c3h6ooh2-1o2 c3ket12 c3ket13 c3ket21 c8h17coco c7h15coch2co c4h9coc2h4 c4h9coch2 c3h7coc2h4 c3h7coch2 c2h5coch2 c2h4coch3 c2h4cho c5h11coch2 c2h5coc2h4 choco2j daoj2oxo daoj3oxo c6h13coch2 c5h11coc2h4 c4h9coc3h6 c3h7coc3h6 c2h5coc3h6 ch3coc3h6 da3doj da2doj choch2co ch3coch2co c2h5coch2co c3h7coch2co c4h9coch2co c5h11coch2co c6h13coch2co md2j md3j md4j md5j md6j md7j md8j md9j md10j mdmj mn9j mo8j ms7j mh6j mf5j mb4j mp3j me2j md9d md8d md7d md6d md5d md4d md3d md2d mn8d mn7d mn6d mn5d mn4d mn3d mn2d mo7d mo6d mo5d mo4d mo3d mo2d ms6d ms5d ms4d ms3d ms2d mh5d mh4d mh3d mh2d mf4d mf3d mf2d mb3d mb2d mp2d mn8j mn7j mn6j mn5j mn4j mn3j mn2j mo7j mo6j mo5j mo4j mo3j mo2j ms6j ms5j ms4j ms3j ms2j mh5j mh4j mh3j mh2j mf4j mf3j mf2j mb3j mb2j mp2j mnmj mojm msmj mhmj mfmj mbmj mpmj memj peaoj mp2dmj mb3dmj mb3d2j mf4dmj mf4d2j mf4d3j mh5dmj mh5d2j mh5d3j mh5d4j ms6dmj ms6d2j ms6d3j ms6d4j ms6d5j mo7dmj mo7d2j mo7d3j mo7d4j mo7d5j mo7d6j mn8dmj mn8d2j mn8d3j mn8d4j mn8d5j mn8d6j mn8d7j md9dmj md9d2j md9d3j md9d4j md9d5j md9d6j md9d7j md9d8j mp2d2j mp2d3j mb3d3j mb3d4j mf4d4j mf4d5j mh5d5j mh5d6j ms6d6j ms6d7j mo7d7j mo7d8j mn8d8j mn8d9j md9d9j md9d10j mf2d5j mh3d6j ms4d7j mo5d8j mn6d9j mh2d6j ms3d7j mo4d8j mn5d9j mo3d8j ms2d7j mo2d8j md8dmj md8d2j md8d3j md8d4j md8d5j md8d6j md8d7j md8d8j md8d9j md7dmj md7d2j md7d3j md7d4j md7d5j md7d6j md7d7j md7d8j md7d10j md6dmj md6d2j md6d3j md6d4j md6d5j md6d6j md6d7j md6d9j md6d10j md5dmj md5d2j md5d3j md5d4j md5d5j md5d6j md5d8j md5d9j md5d10j md4dmj md4d2j md4d3j md4d4j md4d5j md4d7j md4d8j md4d9j md4d10j md3dmj md3d2j md3d3j md3d4j md3d6j md3d7j md3d8j md3d9j md3d10j md2dmj md2d2j md2d3j md2d5j md2d6j md2d7j md2d8j md2d9j md2d10j c3h5co c4h7co c5h9co c6h11co c7h13co c8h15co c9h17co c9h17co-2 c9h17co-3 c9h17co-4 c9h17co-5 c9h17co-6 c9h17co-7 c9h17co-8 !RO2 radicals c9h19o2-1 c8h17o2-1 c7h15o2-1 c6h13o2-1 c5h11o2-1 c9h19o2-2 c8h17o2-2 c7h15o2-2 c6h13o2-2 c5h11o2-2 c9h19o2-3 c8h17o2-3 c7h15o2-3 c6h13o2-3 c5h11o2-3 c9h19o2-4 c8h17o2-4 c7h15o2-4 pc4h9o2 sc4h9o2 c9h19o2-5 me2o2 memo2 mpmo2 mp2o2 mp3o2 mbmo2 mb2o2 mb3o2 mb4o2 mfmo2 mf2o2 mf3o2 mf4o2 mf5o2 mhmo2 mh2o2 mh3o2 mh4o2 mh5o2 mh6o2 msmo2 ms2o2 ms3o2 ms4o2 ms5o2 ms6o2 ms7o2 mamo2 mo2o2 mo3o2 mo4o2 mo5o2 mo6o2 mo7o2 mo8o2 mnmo2 mn2o2 mn3o2 mn4o2 mn5o2 mn6o2 mn7o2 mn8o2 mn9o2 mdmo2 md2o2 md3o2 md4o2 md5o2 md6o2 md7o2 md8o2 md9o2 md10o2 !QOOH radicals c4h8ooh1-2 c4h8ooh1-3 c4h8ooh1-4 c4h8ooh2-1 c4h8ooh2-3 c4h8ooh2-4 c5h10ooh1-2 c5h10ooh1-3 c5h10ooh1-4 c5h10ooh1-5 c5h10ooh2-1 c5h10ooh2-3 c5h10ooh2-4 c5h10ooh2-5 c5h10ooh3-1 c5h10ooh3-2 c6h12ooh1-2 c6h12ooh1-3 c6h12ooh1-4 c6h12ooh1-5 c6h12ooh2-1 c6h12ooh2-3 c6h12ooh2-4 c6h12ooh2-5 c6h12ooh2-6 c6h12ooh3-1 c6h12ooh3-2 c6h12ooh3-4 c6h12ooh3-5 c6h12ooh3-6 c7h14ooh1-2 c7h14ooh1-3 c7h14ooh1-4 c7h14ooh1-5 c7h14ooh2-1 c7h14ooh2-3 c7h14ooh2-4 c7h14ooh2-5 c7h14ooh2-6 c7h14ooh3-1 c7h14ooh3-2 c7h14ooh3-4 c7h14ooh3-5 c7h14ooh3-6 c7h14ooh3-7 c7h14ooh4-1 c7h14ooh4-2 c7h14ooh4-3 c8h16ooh1-2 c8h16ooh1-3 c8h16ooh1-4 c8h16ooh1-5 c8h16ooh2-1 c8h16ooh2-3 c8h16ooh2-4 c8h16ooh2-5 c8h16ooh2-6 c8h16ooh3-1 c8h16ooh3-2 c8h16ooh3-4 c8h16ooh3-5 c8h16ooh3-6 c8h16ooh3-7 c8h16ooh4-1 c8h16ooh4-2 c8h16ooh4-3 c8h16ooh4-5 c8h16ooh4-6 c8h16ooh4-7 c8h16ooh4-8 c9h18ooh1-2 c9h18ooh1-3 c9h18ooh1-4 c9h18ooh1-5 c9h18ooh2-1 c9h18ooh2-3 c9h18ooh2-4 c9h18ooh2-5 c9h18ooh2-6 c9h18ooh3-1 c9h18ooh3-2 c9h18ooh3-4 c9h18ooh3-5 c9h18ooh3-6 c9h18ooh3-7 c9h18ooh4-1 c9h18ooh4-2 c9h18ooh4-3 c9h18ooh4-5 c9h18ooh4-6 c9h18ooh4-7 c9h18ooh4-8 c9h18ooh5-1 c9h18ooh5-2 c9h18ooh5-3 c9h18ooh5-4 memooh2j me2oohmj mpmooh2j mpmooh3j mp2oohmj mp2ooh3j mp3oohmj mp3ooh2j mbmooh2j mbmooh3j mb2oohmj mb2ooh3j mb2ooh4j mb3oohmj mb3ooh2j mb3ooh4j mb4ooh3j mb4ooh2j mfmooh2j mfmooh3j mf2oohmj mf2ooh3j mf2ooh4j mf2ooh5j mf3oohmj mf3ooh2j mf3ooh4j mf3ooh5j mf4ooh3j mf4ooh2j mf4ooh5j mf5ooh4j mf5ooh3j mf5ooh2j mhmooh2j mhmooh3j mh2oohmj mh2ooh3j mh2ooh4j mh2ooh5j mh2ooh6j mh3oohmj mh3ooh2j mh3ooh4j mh3ooh5j mh3ooh6j mh4ooh3j mh4ooh2j mh4ooh5j mh4ooh6j mh5ooh4j mh5ooh3j mh5ooh2j mh5ooh6j mh6ooh5j mh6ooh4j mh6ooh3j mh6ooh2j msmooh2j msmooh3j ms2oohmj ms2ooh3j ms2ooh4j ms2ooh5j ms2ooh6j ms3oohmj ms3ooh2j ms3ooh4j ms3ooh5j ms3ooh6j ms3ooh7j ms4ooh3j ms4ooh2j ms4ooh5j ms4ooh6j ms4ooh7j ms5ooh4j ms5ooh3j ms5ooh2j ms5ooh6j ms5ooh7j ms6ooh5j ms6ooh4j ms6ooh3j ms6ooh2j ms6ooh7j ms7ooh6j ms7ooh5j ms7ooh4j ms7ooh3j mamooh2j mamooh3j mo2oohmj mo2ooh3j mo2ooh4j mo2ooh5j mo2ooh6j mo3oohmj mo3ooh2j mo3ooh4j mo3ooh5j mo3ooh6j mo3ooh7j mo4ooh3j mo4ooh2j mo4ooh5j mo4ooh6j mo4ooh7j mo4ooh8j mo5ooh4j mo5ooh3j mo5ooh2j mo5ooh6j mo5ooh7j mo5ooh8j mo6ooh5j mo6ooh4j mo6ooh3j mo6ooh2j mo6ooh7j mo6ooh8j mo7ooh6j mo7ooh5j mo7ooh4j mo7ooh3j mo7ooh8j mo8ooh7j mo8ooh6j mo8ooh5j mo8ooh4j mnmooh2j mnmooh3j mn2oohmj mn2ooh3j mn2ooh4j mn2ooh5j mn2ooh6j mn3oohmj mn3ooh2j mn3ooh4j mn3ooh5j mn3ooh6j mn3ooh7j mn4ooh3j mn4ooh2j mn4ooh5j mn4ooh6j mn4ooh7j mn4ooh8j mn5ooh4j mn5ooh3j mn5ooh2j mn5ooh6j mn5ooh7j mn5ooh8j mn5ooh9j mn6ooh5j mn6ooh4j mn6ooh3j mn6ooh2j mn6ooh7j mn6ooh8j mn6ooh9j mn7ooh6j mn7ooh5j mn7ooh4j mn7ooh3j mn7ooh8j mn7ooh9j mn8ooh7j mn8ooh6j mn8ooh5j mn8ooh4j mn8ooh9j mn9ooh8j mn9ooh7j mn9ooh6j mn9ooh5j mdmooh2j mdmooh3j md2oohmj md2ooh3j md2ooh4j md2ooh5j md2ooh6j md3oohmj md3ooh2j md3ooh4j md3ooh5j md3ooh6j md3ooh7j md4ooh3j md4ooh2j md4ooh5j md4ooh6j md4ooh7j md4ooh8j md5ooh4j md5ooh3j md5ooh2j md5ooh6j md5ooh7j md5ooh8j md5ooh9j md6ooh5j md6ooh4j md6ooh3j md6ooh2j md6ooh7j md6ooh8j md6ooh9j md6ooh10j md7ooh6j md7ooh5j md7ooh4j md7ooh3j md7ooh8j md7ooh9j md7ooh10j md8ooh7j md8ooh6j md8ooh5j md8ooh4j md8ooh9j md8ooh10j md9ooh8j md9ooh7j md9ooh6j md9ooh5j md9ooh10j md10ooh9j md10ooh8j md10ooh7j md10ooh6j !ro and roh radicals c3h6oh1j2 c4h8oh1j2 c5h10oh1j2 c6h12oh1j2 c7h14oh1j2 c8h16oh1j2 c9h18oh1j2 c3h6oh2j1 c4h8oh2j1 c5h10oh2j1 c6h12oh2j1 c7h14oh2j1 c8h16oh2j1 c9h18oh2j1 c5h11o-3 nc3h7o ic3h7o pc4h9o sc4h9o c5h11o-1 c5h11o-2 c6h13o-1 c6h13o-2 c7h15o-1 c7h15o-2 c8h17o-1 c8h17o-2 c9h19o-1 c9h19o-2 c6h13o-3 c7h15o-3 c7h15o-4 c8h17o-3 c8h17o-4 c9h19o-3 c9h19o-4 c9h19o-5 mp2joh3 mp3joh2 mb3joh4 mb4joh3 mf4joh5 mf5joh4 mh5joh6 mh6joh5 ms6joh7 ms7joh6 mo7joh8 mo8joh7 mn8joh9 mn9joh8 md9joh10 md10joh9 mp3o mp2o mb4o mb3o mf5o mf4o mh6o mh5o ms7o ms6o mo8o mo7o mn9o mn8o md10o md9o md8o md7o md6o md5o md4o md3o md2o mdmo memo me2o mpmo mbmo mb2o mfmo mf2o mf3o mhmo mh2o mh3o mh4o msmo ms2o ms3o ms4o ms5o mamo mo2o mo3o mo4o mo5o mo6o mnmo mn2o mn3o mn4o mn5o mn6o mn7o !OOQOOH mdmooh2o2 mdmooh3o2 md2oohmo2 md2ooh3o2 md2ooh4o2 md2ooh5o2 md2ooh6o2 md3oohmo2 md3ooh2o2 md3ooh4o2 md3ooh5o2 md3ooh6o2 md3ooh7o2 md4ooh3o2 md4ooh2o2 md4ooh5o2 md4ooh6o2 md4ooh7o2 md4ooh8o2 md5ooh4o2 md5ooh3o2 md5ooh2o2 md5ooh6o2 md5ooh7o2 md5ooh8o2 md5ooh9o2 md6ooh5o2 md6ooh4o2 md6ooh3o2 md6ooh2o2 md6ooh7o2 md6ooh8o2 md6ooh9o2 md6ooh10o2 md7ooh6o2 md7ooh5o2 md7ooh4o2 md7ooh3o2 md7ooh8o2 md7ooh9o2 md7ooh10o2 md8ooh7o2 md8ooh6o2 md8ooh5o2 md8ooh4o2 md8ooh9o2 md8ooh10o2 md9ooh8o2 md9ooh7o2 md9ooh6o2 md9ooh5o2 md9ooh10o2 md10ooh9o2 md10ooh8o2 md10ooh7o2 md10ooh6o2 !HOOQOOH radicals mddipxm2j3 mddipx23jm mddipx25j3 mddipx34j2 mddipx36j2 mddipxm2j4 mddipx23j4 mddipx25j4 mddipx34j5 mddipx36j4 mddipxm2j5 mddipx23j5 mddipx25j6 mddipx34j6 mddipx36j5 mddipxm2j6 mddipx23j6 mddipx25j7 mddipx34j7 mddipx36j7 mddipxm3j2 mddipx23j7 mddipx25j8 mddipx34j8 mddipx36j8 mddipxm3j4 mddipx24j3 mddipx25j9 mddipx35j2 mddipx36j9 mddipxm3j5 mddipx24j5 mddipx26j3 mddipx35j4 mddipx36j10 mddipxm3j6 mddipx24j6 mddipx26j4 mddipx35j6 mddipx37j4 mddipxm3j7 mddipx24j7 mddipx26j5 mddipx35j7 mddipx37j5 mddipx24jm mddipx24j8 mddipx26j7 mddipx35j8 mddipx37j6 mddipx25jm mddipx36jm mddipx26j8 mddipx35j9 mddipx37j8 mddipx26jm mddipx37jm mddipx26j9 mddipx46j2 mddipx37j9 mddipx45j2 mddipx37j2 mddipx26j10 mddipx46j3 mddipx37j10 mddipx45j3 mddipx47j3 mddipx48j5 mddipx46j5 mddipx34jm mddipx45j6 mddipx47j5 mddipx48j6 mddipx46j7 mddipx35jm mddipx45j7 mddipx47j6 mddipx48j7 mddipx46j8 mddipx47j2 mddipx45j8 mddipx47j8 mddipx48j9 mddipx46j9 mddipx48j2 mddipx45j9 mddipx47j9 mddipx48j10 mddipx46j10 mddipx48j3 mddipx56j2 mddipx47j10 mddipx59j6 mddipx68j2 mddipx90j6 mddipx56j3 mddipx57j3 mddipx59j7 mddipx68j3 mddipx90j7 mddipx56j4 mddipx57j4 mddipx59j8 mddipx69j2 mddipx90j9 mddipx56j7 mddipx57j6 mddipx59j10 mddipx69j3 mddipx90j4 mddipx56j8 mddipx57j8 mddipx57j2 mddipx69j4 mddipx90j5 mddipx56j9 mddipx57j9 mddipx58j2 mddipx70j2 mddipx100j5 mddipx56j10 mddipx57j10 mddipx58j3 mddipx70j3 mddipx100j6 mddipx58j4 mddipx67j2 mddipx59j2 mddipx70j4 mddipx100j7 mddipx58j6 mddipx67j3 mddipx59j3 mddipx70j5 mddipx100j8 mddipx58j7 mddipx67j4 mddipx59j4 mddipx80j3 mddipx69j5 mddipx58j9 mddipx67j5 mddipx80j6 mddipx80j4 mddipx69j7 mddipx58j10 mddipx67j8 mddipx80j8 mddipx80j5 mddipx69j8 mddipx68j4 mddipx67j9 mddipx80j9 mddipx79j3 mddipx69j10 mddipx68j5 mddipx67j10 mddipx78j3 mddipx79j4 mddipx78j6 mddipx68j7 mddipx70j7 mddipx89j4 mddipx78j4 mddipx78j9 mddipx68j9 mddipx70j8 mddipx89j5 mddipx78j5 mddipx78j10 mddipx68j10 mddipx70j9 mddipx89j6 mddipx89j10 mddipx79j10 mddipx79j6 mddipx79j5 mddipx89j7 mddipx79j8 !carboxylates eaoj paoj baoj faoj haoj saoj oaoj naoj daoj !mdxdyo md2dmo md2d2o md2d3o md2d4o md2d5o md2d6o md2d7o md3dmo md3d2o md3d3o md3d4o md3d5o md3d6o md3d7o md3d8o md4d2o md4d3o md4d4o md4d5o md4d6o md4d7o md4d8o md4d9o md5d2o md5d3o md5d4o md5d5o md5d6o md5d7o md5d8o md5d9o md5d10o md6d2o md6d3o md6d4o md6d5o md6d6o md6d7o md6d8o md6d9o md6d10o md7d2o md7d3o md7d4o md7d5o md7d6o md7d7o md7d8o md7d9o md7d10o md8d2o md8d3o md8d4o md8d5o md8d6o md8d7o md8d8o md8d9o md8d10o md9d2o md9d3o md9d4o md9d5o md9d6o md9d7o md9d8o md9d9o md9d10o !Radicals from the decomposition of hydroperoxyketones mdketm2o mdket37o mdket58o mdket74o mdket97o mdketm3o mdket43o mdket59o mdket73o mdket96o mdket2mo mdket42o mdket65o mdket78o mdket95o mdket23o mdket45o mdket64o mdket79o mdket100o mdket24o mdket46o mdket63o mdket80o mdket109o mdket25o mdket47o mdket62o mdket87o mdket108o mdket26o mdket48o mdket67o mdket86o mdket107o mdket3mo mdket54o mdket68o mdket85o mdket106o mdket32o mdket53o mdket69o mdket84o mdket34o mdket52o mdket70o mdket89o mdket35o mdket56o mdket76o mdket90o mdket36o mdket57o mdket75o mdket98o !Radicals from the decomposition of hydroperoxy cyclic ethers mdcym23o mdcy342o mdcy465o mdcy586o mdcy707o mdcym24o mdcy345o mdcy467o mdcy587o mdcy708o mdcym25o mdcy346o mdcy468o mdcy589o mdcy709o mdcym26o mdcy347o mdcy469o mdcy58xo mdcy783o mdcym32o mdcy348o mdcy46xo mdcy592o mdcy784o mdcym34o mdcy35mo mdcy472o mdcy593o mdcy785o mdcym35o mdcy352o mdcy473o mdcy594o mdcy786o mdcym36o mdcy354o mdcy475o mdcy596o mdcy789o mdcym37o mdcy356o mdcy476o mdcy597o mdcy78xo mdcy23mo mdcy357o mdcy478o mdcy598o mdcy793o mdcy234o mdcy358o mdcy479o mdcy59xo mdcy794o mdcy235o mdcy359o mdcy47xo mdcy672o mdcy795o mdcy236o mdcy36mo mdcy482o mdcy673o mdcy796o mdcy237o mdcy362o mdcy483o mdcy674o mdcy798o mdcy24mo mdcy364o mdcy485o mdcy675o mdcy79xo mdcy243o mdcy365o mdcy486o mdcy678o mdcy803o mdcy245o mdcy367o mdcy487o mdcy679o mdcy804o mdcy246o mdcy368o mdcy489o mdcy67xo mdcy805o mdcy247o mdcy369o mdcy48xo mdcy682o mdcy806o mdcy248o mdcy36xo mdcy562o mdcy683o mdcy808o mdcy25mo mdcy37mo mdcy563o mdcy684o mdcy809o mdcy253o mdcy372o mdcy564o mdcy685o mdcy894o mdcy254o mdcy374o mdcy567o mdcy687o mdcy895o mdcy256o mdcy375o mdcy568o mdcy689o mdcy896o mdcy257o mdcy376o mdcy569o mdcy68xo mdcy897o mdcy258o mdcy378o mdcy56xo mdcy692o mdcy89xo mdcy259o mdcy379o mdcy572o mdcy693o mdcy904o mdcy26mo mdcy37xo mdcy573o mdcy694o mdcy905o mdcy263o mdcy452o mdcy574o mdcy695o mdcy906o mdcy264o mdcy453o mdcy576o mdcy697o mdcy907o mdcy265o mdcy456o mdcy578o mdcy698o mdcy909o mdcy267o mdcy457o mdcy579o mdcy69xo mdcy9x5o mdcy268o mdcy458o mdcy57xo mdcy702o mdcy9x6o mdcy269o mdcy459o mdcy582o mdcy703o mdcy9x7o mdcy26xo mdcy462o mdcy583o mdcy704o mdcy9x8o mdcy34mo mdcy463o mdcy584o mdcy705o !MDxOXOyJ mdmoxo2j md3oxo7j md5oxo8j md7oxo5j md9oxo6j mdmoxo3j md4oxo2j md5oxo9j md7oxo6j md9oxo7j md2oxomj md4oxo3j md6oxo2j md7oxo8j md9oxo8j md2oxo3j md4oxo5j md6oxo3j md7oxo9j md9oxo10j md2oxo4j md4oxo6j md6oxo4j md7oxo10j md10oxo6j md2oxo5j md4oxo7j md6oxo5j md8oxo4j md10oxo7j md2oxo6j md4oxo8j md6oxo7j md8oxo5j md10oxo8j md3oxomj md5oxo2j md6oxo8j md8oxo6j md10oxo9j md3oxo2j md5oxo3j md6oxo9j md8oxo7j md3oxo4j md5oxo4j md6oxo10j md8oxo9j md3oxo5j md5oxo6j md7oxo3j md8oxo10j md3oxo6j md5oxo7j md7oxo4j md9oxo5j me2oxo2j mp2oxo3j mb2oxo4j mp3oxo3j mb3oxo4j mh4oxo6j mf3oxo5j mf4oxo5j mb4oxo4j mf5oxo5j mh6oxo6j mo6oxo8j ms7oxo7j ms5oxo7j mh5oxo6j ms6oxo7j mo8oxo8j mo7oxo8j memoxo2j mf2oxo5j mh3oxo6j ms4oxo7j mo5oxo8j mn6oxo9j mn7oxo9j mn8oxo9j mn9oxo9j me2oxomj mpmoxo2j mpmoxo3j mp2oxomj mp3oxomj mp3oxo2j mbmoxo2j mbmoxo3j mb2oxomj mb2oxo3j mb3oxomj mb3oxo2j mb4oxo2j mb4oxo3j mfmoxo2j mfmoxo3j mf2oxomj mf2oxo3j mf2oxo4j mf3oxomj mf3oxo2j mf3oxo4j mf4oxo2j mf4oxo3j mf5oxo2j mf5oxo3j mf5oxo4j mhmoxo2j mhmoxo3j mh2oxomj mh2oxo3j mh2oxo4j mh2oxo5j mh2oxo6j mh3oxomj mh3oxo2j mh3oxo4j mh3oxo5j mh4oxo2j mh4oxo3j mh4oxo5j mh5oxo2j mh5oxo3j mh5oxo4j mh6oxo2j mh6oxo3j mh6oxo4j mh6oxo5j msmoxo2j msmoxo3j ms2oxomj ms2oxo3j ms2oxo4j ms2oxo5j ms2oxo6j ms3oxomj ms3oxo2j ms3oxo4j ms3oxo5j ms3oxo6j ms3oxo7j ms4oxo2j ms4oxo3j ms4oxo5j ms4oxo6j ms5oxo2j ms5oxo3j ms5oxo4j ms5oxo6j ms6oxo2j ms6oxo3j ms6oxo4j ms6oxo5j ms7oxo3j ms7oxo4j ms7oxo5j ms7oxo6j momoxo2j momoxo3j mo2oxomj mo2oxo3j mo2oxo4j mo2oxo5j mo2oxo6j mo3oxomj mo3oxo2j mo3oxo4j mo3oxo5j mo3oxo6j mo3oxo7j mo4oxo2j mo4oxo3j mo4oxo5j mo4oxo6j mo4oxo7j mo4oxo8j mo5oxo2j mo5oxo3j mo5oxo4j mo5oxo6j mo5oxo7j mo6oxo2j mo6oxo3j mo6oxo4j mo6oxo5j mo6oxo7j mo7oxo3j mo7oxo4j mo7oxo5j mo7oxo6j mo8oxo4j mo8oxo5j mo8oxo6j mo8oxo7j mnmoxo2j mnmoxo3j mn2oxomj mn2oxo3j mn2oxo4j mn2oxo5j mn2oxo6j mn3oxomj mn3oxo2j mn3oxo4j mn3oxo5j mn3oxo6j mn3oxo7j mn4oxo2j mn4oxo3j mn4oxo5j mn4oxo6j mn4oxo7j mn4oxo8j mn5oxo2j mn5oxo3j mn5oxo4j mn5oxo6j mn5oxo7j mn5oxo8j mn5oxo9j mn6oxo2j mn6oxo3j mn6oxo4j mn6oxo5j mn6oxo7j mn6oxo8j mn7oxo3j mn7oxo4j mn7oxo5j mn7oxo6j mn7oxo8j mn8oxo4j mn8oxo5j mn8oxo6j mn8oxo7j mn9oxo5j mn9oxo6j mn9oxo7j mn9oxo8j c2h5chjcho ch3chjch2cho ch3chjcoch3 c3h7chjcho c2h5chjch2cho ch3chjc2h4cho c2h5chjcoch3 ch3chjch2coch3 c4h9chjcho c3h7chjch2cho c2h5chjc2h4cho ch3chjc3h6cho c3h7chjcoch3 ch3chjcoc3h7 c2h5chjch2coch3 ch3chjch2coc2h5 ch3chjc2h4coch3 c2h5chjcoc2h5 c5h11chjcho c4h9chjch2cho c3h7chjc2h4cho c2h5chjc3h6cho c4h9chjcoch3 ch3chjcoc4h9 c3h7chjch2coch3 ch3chjch2coc3h7 c2h5chjc2h4coch3 ch3chjc2h4coc2h5 ch3chjc3h6coch3 c3h7chjcoc2h5 c2h5chjcoc3h7 c2h5chjch2coc2h5 c6h13chjcho c5h11chjch2cho c4h9chjc2h4cho c3h7chjc3h6cho c5h11chjcoch3 ch3chjcoc5h11 c4h9chjch2coch3 ch3chjch2coc4h9 c3h7chjc2h4coch3 ch3chjc2h4coc3h7 c2h5chjc3h6coch3 ch3chjc3h6coc2h5 c4h9chjcoc2h5 c2h5chjcoc4h9 c3h7chjch2coc2h5 c2h5chjch2coc3h7 c2h5chc2h4coc2h5 c3h7chjcoc3h7 c7h15chjcho c6h13chjch2cho c5h11chjc2h4cho c4h9chjc3h6cho c6h13chjcoch3 ch3chjcoc6h13 c5h11chjch2coch3 ch3chjch2coc5h11 c4h9chjc2h4coch3 ch3chjc2h4coc4h9 c3h7chjc3h6coch3 ch3chjc3h6coc3h7 c5h11chjcoc2h5 c2h5chjcoc5h11 c4h9chjch2coc2h5 c2h5chjch2coc4h9 c3h7chc2h4coc2h5 c2h5chc2h4coc3h7 c2h5chc3h6coc2h5 c4h9chjcoc3h7 c3h7chjcoc4h9 c3h7chjch2coc3h7 c4h9coc4h8 ch3coc4h8 c2h5coc4h8 c3h7coc4h8 c5h11coc3h6 c6h13coc2h4 c7h15coch2 c4h8cho ! ! ! ! ! ! !Radicals from reaction type 27b cym23j cym24j cym34j cym35j cy23mj cy234j cy235j cy235ja cy235jb cy24mj cy24mja cy24mjb cy243ja cy243jb cy245j cy245jb cy246j cy246ja cy246jb cy25mj cy25mja cy25mjb cy253ja cy253jb cy253jc cy253jd cy254ja cy254jb cy254jd cy256j cy256ja cy257j cy257ja cy26mj cy26mja cy26mjb cy263ja cy263jb cy263jc cy264ja cy264jb cy264jc cy264jd cy265ja cy265jb cy267ja cy267jb cy268ja cy268jc cy34mja cy34mjc cy342ja cy342jb cy345ja cy346ja cy346jb cy346jc cy35mj cy35mja cy352j cy352jb cy354ja cy354jb cy356j cy356ja cy357j cy357ja cy357jb cy36mj cy36mjb cy362j cy362ja cy364ja cy364jb cy364jc cy364jd cy365ja cy365jb cy365jd cy367j cy367jb cy368j cy368jb cy37mj cy37mja cy37mjb cy372j cy372ja cy372jb cy374ja cy374jb cy374jc cy375ja cy375jb cy375jc cy375jd cy376ja cy376jb cy378j cy378jb cy379j cy379jb cy452j cy452ja cy453j cy456j cy457j cy457ja cy457jb cy462j cy462jb cy463j cy465ja cy465jb cy467j cy467jb cy468j cy468ja cy468jb cy472j cy472ja cy473j cy475ja cy475jb cy475jc cy475jd cy476ja cy476jb cy478j cy478ja cy479j cy479ja cy482j cy482ja cy483j cy483ja cy483jb cy485ja cy485jb cy485jc cy486ja cy486jb cy486jc cy486jd cy487ja cy487jb cy489j cy489ja cy4810j cy4810ja cy562j cy563j cy563jb cy567j cy568j cy568ja cy568jb cy572j cy572jb cy573j cy573ja cy576ja cy576jb cy578j cy578ja cy579j cy579ja cy579jb cy582j cy582ja cy583j cy583jb cy586ja cy586jb cy586jc cy586jd cy587ja cy587jb cy587jc cy589j cy589jb cy5810j cy5810jb cy592j cy592ja cy592jb cy593j cy593ja cy593jb cy596ja cy596jb cy596jc cy597ja cy597jb cy597jc cy597jd cy598ja cy598jb cy5910j cy5910jb cy672j cy672ja cy673j cy678j cy679j cy679ja cy679jb cy682j cy682jb cy683j cy687ja cy687jb cy689j cy689jb cy6810j cy6810ja cy6810jb cy692j cy693j cy697ja cy697jb cy697jc cy698ja cy698jb cy698jd cy6910j cy6910ja cy702j cy703j cy707ja cy708ja cy708jb cy709ja cy783j cy783jb cy784j cy789j cy7810j cy7810ja cy7810jb cy793j cy793ja cy794j cy798j cy7910j cy7910ja cy803j cy804j cy808ja cy808jb cy809jb cy894j cy894ja cy895j cy8910j cy904j cy905j cy909ja cy1005j cy257jb cy36mja cy476jc cy476jd cy692ja !molecules without o h2 ch4 c2h4 c2h6 c3h6 ic4h8 c2h2 c3h8 c3h4-a c3h4-p c9h18-1 c8h16-1 c7h14-1 c6h12-1 c5h10-1 c4h8-1 c5h10-2 c6h12-2 c6h12-3 c7h14-2 c7h14-3 c8h16-2 c8h16-3 c8h16-4 c9h18-2 c9h18-3 c9h18-4 c4h8-2 c4h6 c5h8-13 c5h8-14 c6h10-13 c6h10-14 c6h10-15 c7h12-13 c7h12-14 c7h12-15 c7h12-16 c8h14-13 c8h14-14 c8h14-15 c8h14-16 c8h14-17 c9h16-13 c9h16-14 c9h16-15 c9h16-16 c9h16-17 c9h16-18 c4h6-1 c5h8-1 c6h10-1 c7h12-1 c8h14-1 c9h16-1 c4h6-12 c5h8-12 c6h10-12 c7h12-12 c8h14-12 c9h16-12 !molecules with o o2 h2o h2o2 co co2 ch2o ch3oh ch3o2h ho2cho hocho och2o2h hoch2o2h c2h5o2h ch3co3h c2h5oh hccoh ch3coch2o2h ch3ocho ch3och3 ch3och2o2h ho2ch2ocho nc3h7o2h ic3h7o2h c3h6oh c3h51-2,3ooh ac3h5ooh me md c2h3chco c3h5chco c4h7chco c5h9chco c6h11chco c7h13chco c8h15chco mf24d mh35d ms46d mo57d mn68d md79d mn58d mo47d mn48d mf34d ms36d mo37d mn38d mb23d mh25d ms26d mo27d mn28d mn78d mo67d ms56d mh45d ch3chco c2h5chco c7h15cocho c6h13coch2cho c6h13cocho c5h11cocho c5h11coc2h4cho c4h9coc3h6cho c5h11coch2cho c4h9coc2h4cho c4h9coch2cho c4h9cocho c3h7coc3h6cho c3h7coc2h4cho c3h7coch2cho c3h7cocho c2h5coc3h6cho c2h5coc2h4cho c2h5coch2cho c2h5cocho ch3coc3h6cho ch3coc2h4cho ch3coch2cho ch3cocho c3h6cho choc3h6cho choc2h4cho choch2cho chocho coco ch3cochco c2h5cochco c3h7cochco c4h9cochco c5h11cochco c6h13cochco ch3coch2chco c2h5coch2chco c3h7coch2chco c4h9coch2chco c5h11coch2chco ch3coc2h4chco c2h5coc2h4chco c3h7coc2h4chco c4h9coc2h4chco ch3coc3h6chco c2h5coc3h6chco c3h7coc3h6chco hcoco ch3coco c2h5coco c3h7coco c4h9coco c5h11coco c6h13coco c7h15coco ch2cco mp2t mb3t mf4t mh5t ms6t mo7t mn8t md9t !Aldehydes and Ketones c8h17cho c7h15cho c6h13cho c5h11cho c4h9cho c3h7cho c2h5coch3 c3h7coch3 c2h5coc2h5 c4h9coch3 c3h7coc2h5 c5h11coch3 c4h9coc2h5 c3h7coc3h7 c6h13coch3 c5h11coc2h5 c4h9coc3h7 c7h15coch3 c6h13coc2h5 c5h11coc3h7 c4h9coc4h9 c2h5cho ch3coch3 c2h3cho ch3cho ch2ohchco c5h9cho c4h7cho c3h5cho c2h3coc6h13 c3h5coc5h11 c2h3coc5h11 c4h7coc4h9 c3h5coc4h9 c2h3coc4h9 c5h9coc3h7 c3h5coc3h7 c2h3coc3h7 c5h9coc2h5 c4h7coc2h5 c4h7coc3h7 c3h5coc2h5 c2h3coc2h5 c5h9coch3 c4h7coch3 c3h5coch3 c2h3coch3 c7h15cochco c6h13coch2chco c5h11coc2h4chco c4h9coc3h6chco c5h11c2h2ch2cho c6h13c2h2cho c5h11c2h2cho c4h9c2h2c2h4cho c4h9c2h2ch2cho c4h9c2h2cho c3h7c2h2c3h6cho c3h7c2h2c2h4cho c3h7c2h2ch2cho c3h7c2h2cho c2h5c2h2c4h8cho c2h5c2h2c3h6cho c2h5c2h2c2h4cho c2h5c2h2ch2cho c2h5c2h2cho ch3c2h2c5h10cho ch3c2h2c4h8cho ch3c2h2c3h6cho ch3c2h2c2h4cho ch3c2h2ch2cho ch3c2h2cho c2h3c6h12cho c2h3c5h10cho c2h3c4h8cho c2h3c3h6cho c2h3c2h4cho c8h15chco-2 c8h15chco-3 c8h15chco-4 c8h15chco-5 c8h15chco-6 c8h15chco-7 c8h15chco-8 !Cyclic ethers c4h8o1-2 c4h8o1-3 c4h8o1-4 c4h8o2-3 c5h10o1-2 c5h10o1-3 c5h10o1-4 c5h10o1-5 c5h10o2-3 c5h10o2-4 c6h12o1-2 c6h12o1-3 c6h12o1-4 c6h12o1-5 c6h12o2-3 c6h12o2-4 c6h12o2-5 c6h12o3-4 c7h14o1-2 c7h14o1-3 c7h14o1-4 c7h14o1-5 c7h14o2-3 c7h14o2-4 c7h14o2-5 c7h14o2-6 c7h14o3-4 c7h14o3-5 c8h16o1-2 c8h16o1-3 c8h16o1-4 c8h16o1-5 c8h16o2-3 c8h16o2-4 c8h16o2-5 c8h16o2-6 c8h16o3-4 c8h16o3-5 c8h16o3-6 c8h16o4-5 c9h18o1-2 c9h18o1-3 c9h18o1-4 c9h18o1-5 c9h18o2-3 c9h18o2-4 c9h18o2-5 c9h18o2-6 c9h18o3-4 c9h18o3-5 c9h18o3-6 c9h18o3-7 c9h18o4-5 c9h18o4-6 meom-2 mpom-2 mpom-3 mpo2-3 mbom-2 mbom-3 mbo2-3 mbo2-4 mbo3-4 mfom-2 mfom-3 mfo2-3 mfo2-4 mfo2-5 mfo3-4 mfo3-5 mfo4-5 mhom-2 mhom-3 mho2-3 mho2-4 mho2-5 mho2-6 mho3-4 mho3-5 mho3-6 mho4-5 mho4-6 mho5-6 msom-2 msom-3 mso2-3 mso2-4 mso2-5 mso2-6 mso3-4 mso3-5 mso3-6 mso3-7 mso4-5 mso4-6 mso4-7 mso5-6 mso5-7 mso6-7 moom-2 moom-3 moo2-3 moo2-4 moo2-5 moo2-6 moo3-4 moo3-5 moo3-6 moo3-7 moo4-5 moo4-6 moo4-7 moo4-8 moo5-6 moo5-7 moo5-8 moo6-7 moo6-8 moo7-8 mnom-2 mnom-3 mno2-3 mno2-4 mno2-5 mno2-6 mno3-4 mno3-5 mno3-6 mno3-7 mno4-5 mno4-6 mno4-7 mno4-8 mno5-6 mno5-7 mno5-8 mno5-9 mno6-7 mno6-8 mno6-9 mno7-8 mno7-9 mno8-9 mdom-2 mdom-3 mdo2-3 mdo2-4 mdo2-5 mdo2-6 mdo3-4 mdo3-5 mdo3-6 mdo3-7 mdo4-5 mdo4-6 mdo4-7 mdo4-8 mdo5-6 mdo5-7 mdo5-8 mdo5-9 mdo6-7 mdo6-8 mdo6-9 mdo6-10 mdo7-8 mdo7-9 mdo7-10 mdo8-9 mdo8-10 mdo9-10 !Keto-esters et al. memoxo me2oxo mpmoxo mp2oxo mp3oxo mbmoxo mb2oxo mb3oxo mb4oxo mfmoxo mf2oxo mf3oxo mf4oxo mf5oxo mhmoxo mh2oxo mh3oxo mh4oxo mh5oxo mh6oxo msmoxo ms2oxo ms3oxo ms4oxo ms5oxo ms6oxo ms7oxo mamoxo mo2oxo mo3oxo mo4oxo mo5oxo mo6oxo mo7oxo mo8oxo mnmoxo mn2oxo mn3oxo mn4oxo mn5oxo mn6oxo mn7oxo mn8oxo mn9oxo mdmoxo md2oxo md3oxo md4oxo md5oxo md6oxo md7oxo md8oxo md9oxo md10oxo !unstaurated keo-esters mpmoxo2d mp3oxo2d mbmoxo3d mb2oxo3d mb4oxo3d mf2oxo4d mf3oxo4d mf5oxo4d mh2oxo5d mh3oxo5d mh4oxo5d ms2oxo6d ms3oxo6d ms4oxo6d ms5oxo6d mo3oxo7d mo4oxo7d mo5oxo7d mn4oxo8d mh6oxo5d mn5oxo8d mo6oxo7d mn6oxo8d ms7oxo6d mn9oxo8d mo8oxo7d mn7oxo8d mb4oxo2d mf5oxo3d mf5oxo2d mh6oxo4d mh6oxo3d mh6oxo2d ms7oxo4d ms7oxo5d ms7oxo3d ms7oxo2d mo8oxo6d mo8oxo4d mo8oxo5d mo8oxo3d mn9oxo6d mn9oxo4d mn9oxo5d mn9oxo7d mdmoxo2d mdmoxo3d md2oxo3d md2oxo4d md2oxo5d md2oxo6d md2oxo7d md2oxo8d md2oxo9d md3oxo4d md3oxo5d md3oxo6d md3oxo7d md3oxo8d md3oxo9d md4oxo2d md4oxo5d md4oxo6d md4oxo7d md4oxo8d md4oxo9d md5oxo2d md5oxo3d md5oxo6d md5oxo7d md5oxo8d md5oxo9d md6oxo2d md6oxo3d md6oxo4d md6oxo7d md6oxo8d md6oxo9d md7oxo2d md7oxo3d md7oxo4d md7oxo5d md7oxo8d md7oxo9d md8oxo3d md8oxo4d md8oxo5d md8oxo6d md8oxo9d md9oxo4d md9oxo5d md9oxo6d md9oxo7d md10oxo5d md10oxo6d md10oxo7d md10oxo8d md10oxo9d !Alkenols c3h5oh1d1 c4h7oh1d1 c5h9oh1d1 c6h11oh1d1 c7h13oh1d1 c8h15oh1d1 c9h17oh1d1 c3h5oh2d1 c4h7oh2d1 c5h9oh2d1 c6h11oh2d1 c7h13oh2d1 c8h15oh2d1 c9h17oh2d1 c3h5oh1d2 c2h3oh mp2doh2 mp2doh3 mb3doh3 mb3doh4 mf4doh4 mf4doh5 mh5doh5 mh5doh6 ms6doh6 ms6doh7 mo7doh7 mo7doh8 mn8doh8 mn8doh9 md9doh9 md9doh10 !Ketohydroperoxyde mdketm2 mdketm3 mdket2m mdket23 mdket24 mdket25 mdket26 mdket3m mdket32 mdket34 mdket35 mdket36 mdket37 mdket43 mdket42 mdket45 mdket46 mdket47 mdket48 mdket54 mdket53 mdket52 mdket56 mdket57 mdket58 mdket59 mdket65 mdket64 mdket63 mdket62 mdket67 mdket68 mdket69 mdket70 mdket76 mdket75 mdket74 mdket73 mdket78 mdket79 mdket80 mdket87 mdket86 mdket85 mdket84 mdket89 mdket90 mdket98 mdket97 mdket96 mdket95 mdket100 mdket109 mdket108 mdket107 mdket106 !Alkeneooh md2dmooh md3dmooh md2d2ooh md3d2ooh md4d2ooh md5d2ooh md6d2ooh md2d3ooh md3d3ooh md4d3ooh md5d3ooh md6d3ooh md7d3ooh md2d4ooh md3d4ooh md4d4ooh md5d4ooh md6d4ooh md7d4ooh md8d4ooh md2d5ooh md3d5ooh md4d5ooh md5d5ooh md6d5ooh md7d5ooh md8d5ooh md9d5ooh md2d6ooh md3d6ooh md4d6ooh md5d6ooh md6d6ooh md7d6ooh md8d6ooh md9d6ooh md2d7ooh md3d7ooh md4d7ooh md5d7ooh md6d7ooh md7d7ooh md8d7ooh md9d7ooh md3d8ooh md4d8ooh md5d8ooh md6d8ooh md7d8ooh md8d8ooh md9d8ooh md4d9ooh md5d9ooh md6d9ooh md7d9ooh md8d9ooh md9d9ooh md5d10ooh md6d10ooh md7d10ooh md8d10ooh md9d10ooh !hydroperoxy cyclic ether mdcy37-m mdcym3-2 mdcy23-m mdcy24-m mdcy25-m mdcy26-m mdcym2-3 mdcym2-4 mdcym2-5 mdcym2-6 mdcy34-m mdcy35-m mdcy36-m mdcy24-3 mdcy24-5 mdcy24-6 mdcy24-7 mdcy24-8 mdcy34-2 mdcy45-2 mdcy56-2 mdcy67-2 mdcy25-3 mdcy25-4 mdcy25-6 mdcy25-7 mdcy25-8 mdcy25-9 mdcy35-2 mdcy46-2 mdcy57-2 mdcy68-2 mdcy37-2 mdcy48-2 mdcy59-2 mdcy36-2 mdcy47-2 mdcy58-2 mdcy69-2 mdcy26-3 mdcy26-4 mdcy26-5 mdcy26-7 mdcy26-8 mdcy26-9 mdcy23-4 mdcy23-5 mdcy23-6 mdcy23-7 mdcym3-4 mdcym3-5 mdcym3-6 mdcym3-7 mdcy35-4 mdcy46-3 mdcy57-3 mdcy35-6 mdcy68-3 mdcy35-7 mdcy46-5 mdcy57-4 mdcy46-7 mdcy79-4 mdcy46-8 mdcy57-6 mdcy79-5 mdcy35-8 mdcy57-8 mdcy35-9 mdcy57-9 mdcy68-7 mdcy46-9 mdcy68-9 mdcy79-8 mdcy45-3 mdcy34-5 mdcy56-3 mdcy34-6 mdcy67-3 mdcy34-7 mdcy78-3 mdcy56-4 mdcy45-6 mdcy67-4 mdcy45-7 mdcy78-4 mdcy34-8 mdcy45-8 mdcy89-4 mdcy67-5 mdcy56-7 mdcy78-5 mdcy56-8 mdcy89-5 mdcy45-9 mdcy56-9 mdcy78-6 mdcy67-8 mdcy89-6 mdcy67-9 mdcy89-7 mdcy78-9 mdcy36-4 mdcy47-3 mdcy36-5 mdcy58-3 mdcy69-3 mdcy36-7 mdcy47-5 mdcy58-4 mdcy47-6 mdcy69-4 mdcy47-8 mdcy69-5 mdcy58-6 mdcy58-7 mdcy58-9 mdcy69-7 mdcy36-8 mdcy36-9 mdcy69-8 mdcy47-9 mdcy70-2 mdcy37-4 mdcy48-3 mdcy37-5 mdcy59-3 mdcy37-6 mdcy48-5 mdcy59-4 mdcy48-6 mdcy48-7 mdcy59-6 mdcy59-7 mdcy59-8 mdcy37-8 mdcy37-9 mdcy48-9 mdcy70-3 mdcy70-4 mdcy70-5 mdcy70-7 mdcy70-8 mdcy70-9 mdcy80-3 mdcy80-4 mdcy80-5 mdcy80-6 mdcy80-8 mdcy80-9 mdcy90-4 mdcy90-5 mdcy90-6 mdcy90-7 mdcy90-9 mdcy100-5 mdcy100-6 mdcy100-7 mdcy100-8 mdcy46-10 mdcy68-10 mdcy57-10 mdcy79-10 mdcy36-10 mdcy69-10 mdcy47-10 mdcy58-10 mdcy56-10 mdcy67-10 mdcy78-10 mdcy89-10 mdcy26-10 mdcy37-10 mdcy48-10 mdcy59-10 mdcy68-4 mdcy68-5 mdcy79-3 mdcy79-6 !Peroxydes md10ooh md9ooh md8ooh md7ooh md6ooh md5ooh md4ooh md3ooh md2ooh mdmooh mn9ooh mn8ooh mn7ooh mn6ooh mn5ooh mn4ooh mn3ooh mn2ooh mnmooh mo8ooh mo7ooh mo6ooh mo5ooh mo4ooh mo3ooh mo2ooh mamooh ms7ooh ms6ooh ms5ooh ms4ooh ms3ooh ms2ooh msmooh mh6ooh mh5ooh mh4ooh mh3ooh mh2ooh mhmooh mf5ooh mf4ooh mf3ooh mf2ooh mfmooh mb4ooh mb3ooh mb2ooh mbmooh mp3ooh mp2ooh mpmooh me2ooh memooh pc4h9ooh sc4h9ooh c5h11ooh-1 c5h11ooh-2 c5h11ooh-3 c6h13ooh-1 c6h13ooh-2 c6h13ooh-3 c7h15ooh-1 c7h15ooh-2 c7h15ooh-3 c7h15ooh-4 c8h17ooh-1 c8h17ooh-2 c8h17ooh-3 c8h17ooh-4 c9h19ooh-1 c9h19ooh-2 c9h19ooh-3 c9h19ooh-4 c9h19ooh-5 !carboxylic acids ea pa ba fa ha sa oa na da !A classer ch3ocooo ch2ocoooh c9h18coooh2j c9h18coooh3j c9h18coooh4j c9h18coooh5j cyc9h19coo2 cyc9h19coo3 cyc9h19coo4 cyc9h19coo5 cych2ocoo c9h19cooo !Madioxoxy medioxom2 mpdioxo23 mpdioxom3 mbdioxo24 mbdioxo34 mfdioxo25 mfdioxo35 mfdioxo45 mhdioxo36 mhdioxo46 mhdioxo56 mhdioxo26 msdioxo57 msdioxo47 msdioxo67 msdioxo37 modioxo48 modioxo78 modioxo58 mndioxo69 modioxo68 mndioxo79 mndioxo59 mndioxo89 mddioxom2 mddioxom3 mddioxo23 mddioxo24 mddioxo25 mddioxo26 mddioxo34 mddioxo35 mddioxo36 mddioxo37 mddioxo45 mddioxo46 mddioxo47 mddioxo48 mddioxo56 mddioxo57 mddioxo58 mddioxo59 mddioxo67 mddioxo68 mddioxo69 mddioxo70 mddioxo78 mddioxo79 mddioxo80 mddioxo89 mddioxo90 mddioxo100 !Keto cyclic esters mdcym23oxo mdcym24oxo mdcym25oxo mdcym26oxo mdcym32oxo mdcym34oxo mdcym35oxo mdcym36oxo mdcym37oxo mdcy23moxo mdcy234oxo mdcy235oxo mdcy236oxo mdcy237oxo mdcy24moxo mdcy243oxo mdcy245oxo mdcy246oxo mdcy247oxo mdcy25moxo mdcy253oxo mdcy254oxo mdcy256oxo mdcy257oxo mdcy258oxo mdcy259oxo mdcy26moxo mdcy263oxo mdcy264oxo mdcy265oxo mdcy267oxo mdcy268oxo mdcy269oxo mdcy26xoxo mdcy34moxo mdcy342oxo mdcy345oxo mdcy346oxo mdcy347oxo mdcy348oxo mdcy35moxo mdcy352oxo mdcy354oxo mdcy356oxo mdcy357oxo mdcy358oxo mdcy359oxo mdcy36moxo mdcy362oxo mdcy364oxo mdcy365oxo mdcy367oxo mdcy368oxo mdcy369oxo mdcy36xoxo mdcy37moxo mdcy372oxo mdcy374oxo mdcy375oxo mdcy376oxo mdcy378oxo mdcy379oxo mdcy37xoxo mdcy452oxo mdcy453oxo mdcy456oxo mdcy457oxo mdcy458oxo mdcy462oxo mdcy463oxo mdcy465oxo mdcy467oxo mdcy468oxo mdcy469oxo mdcy46xoxo mdcy472oxo mdcy473oxo mdcy475oxo mdcy476oxo mdcy478oxo mdcy479oxo mdcy47xoxo mdcy482oxo mdcy483oxo mdcy485oxo mdcy486oxo mdcy487oxo mdcy489oxo mdcy48xoxo mdcy562oxo mdcy563oxo mdcy564oxo mdcy567oxo mdcy568oxo mdcy569oxo mdcy56xoxo mdcy572oxo mdcy573oxo mdcy574oxo mdcy576oxo mdcy578oxo mdcy579oxo mdcy57xoxo mdcy582oxo mdcy583oxo mdcy584oxo mdcy586oxo mdcy587oxo mdcy589oxo mdcy58xoxo mdcy592oxo mdcy593oxo mdcy594oxo mdcy596oxo mdcy597oxo mdcy598oxo mdcy59xoxo mdcy672oxo mdcy673oxo mdcy674oxo mdcy675oxo mdcy678oxo mdcy679oxo mdcy67xoxo mdcy682oxo mdcy683oxo mdcy684oxo mdcy685oxo mdcy687oxo mdcy689oxo mdcy68xoxo mdcy692oxo mdcy693oxo mdcy694oxo mdcy695oxo mdcy697oxo mdcy698oxo mdcy69xoxo mdcy702oxo mdcy703oxo mdcy704oxo mdcy705oxo mdcy707oxo mdcy708oxo mdcy709oxo mdcy783oxo mdcy784oxo mdcy785oxo mdcy786oxo mdcy789oxo mdcy78xoxo mdcy793oxo mdcy794oxo mdcy795oxo mdcy796oxo mdcy798oxo mdcy79xoxo mdcy803oxo mdcy804oxo mdcy805oxo mdcy806oxo mdcy808oxo mdcy809oxo mdcy894oxo mdcy895oxo mdcy896oxo mdcy897oxo mdcy89xoxo mdcy904oxo mdcy905oxo mdcy906oxo mdcy907oxo mdcy909oxo mdcy9x5oxo mdcy9x6oxo mdcy9x7oxo mdcy9x8oxo mdcy248oxo mdcy459oxo !Molecules from reaction type 27b cyc2h2o chochco c2h3oc2h3 choch2chco choc2h4chco c2h3ochco choc3h6chco cym23 cym24 cym25 cym26 cym32 cym34 cym35 cym36 cym37 cy234 cy235 cy236 cy237 cy243a cy243b cy245 cy246 cy247 cy248 cy253a cy253b cy254a cy254b cy256 cy257 cy258 cy259 cy263a cy263b cy264a cy264b cy265a cy265b cy267 cy268a cy269 cy342a cy345a cy346a cy347 cy348 cy352 cy354a cy356 cy357 cy358 cy359 cy362 cy364a cy364b cy365a cy365b cy367 cy368 cy369 cy372 cy374a cy374b cy375a cy375b cy376a cy376b cy378 cy379 cy452 cy453 cy456 cy457 cy458 cy459 cy462 cy463 cy465a cy465b cy467 cy468 cy469 cy472 cy473 cy475a cy475b cy476a cy476b cy478 cy479 cy482 cy483 cy485c cy485d cy486a cy486b cy487a cy487b cy489 cy562 cy563 cy564 cy567 cy568 cy569 cy572 cy573 cy574 cy576a cy576b cy578 cy579 cy582 cy583 cy584 cy586a cy586b cy587a cy587b cy589 cy592 cy593 cy594 cy596a cy597a cy597b cy598 cy672 cy673 cy674 cy675 cy678 cy679 cy682 cy683 cy684 cy685 cy687 cy689 cy692 cy693 cy694 cy695 cy697a cy697b cy698 cy702 cy703 cy704 cy705 cy707 cy708 cy709 cy783 cy784 cy785 cy786 cy789 cy793 cy794 cy795 cy796 cy798 cy803 cy804 cy805 cy806 cy808 cy809 cy894 cy895 cy896 cy897 cy904 cy905 cy906 cy907 cy909 cy1005 cy1006 cy1007 cy1008 cy354b cy687b !Species added for the low T part of n-heptane nc7h16 nc7ket12 nc7ket13 nc7ket14 nc7ket15 nc7ket21 nc7ket23 nc7ket24 nc7ket25 nc7ket26 nc7ket31 nc7ket32 nc7ket34 nc7ket35 nc7ket36 nc7ket37 nc7ket41 nc7ket42 nc7ket43 c7h13-22 c7h13-23 c7h13-24 c7h13-25 c7h13-26 c7h13-33 c7h13-34 c7h13-35 c7h13-36 c7h15o2h1 c7h15o2h2 c7h15o2h3 c7h15o2h4 c7h14oh2j3 c7h14oh3j2 c7h14oh3j4 c7h14oh4j3 c7h13oh2d2 c7h13oh3d2 c7h13oh3d3 c7h13oh4d3 c2h3chohch3 ch3c2h2oh c2h3chohc2h5 c3h7c2h2oh c2h5c2h2oh c2h3chohc3h7 c7h14ooh1-2o2 c7h14ooh1-3o2 c7h14ooh1-4o2 c7h14ooh1-5o2 c7h14ooh2-1o2 c7h14ooh2-3o2 c7h14ooh2-4o2 c7h14ooh2-5o2 c7h14ooh2-6o2 c7h14ooh3-1o2 c7h14ooh3-2o2 c7h14ooh3-4o2 c7h14ooh3-5o2 c7h14ooh3-6o2 c7h14ooh3-7o2 c7h14ooh4-1o2 c7h14ooh4-2o2 c7h14ooh4-3o2 c7h13ooh1-1 c7h13ooh1-2 c7h13ooh1-3 c7h13ooh1-4 c7h13ooh1-5 c7h13ooh2-1 c7h13ooh2-2 c7h13ooh2-3 c7h13ooh2-4 c7h13ooh2-5 c7h13ooh2-6 c7h13ooh3-1 c7h13ooh3-2 c7h13ooh3-3 c7h13ooh3-4 c7h13ooh3-5 c7h13ooh3-6 c7h13ooh4-1 c7h13ooh4-2 c7h13ooh4-3 c7h12-2 c7h12-23 c7h12-24 c7h12-25 c7h12-3 c7h12-34 c7h13dipx12j3 c7h13dipx12j4 c7h13dipx12j5 c7h13dipx12j6 c7h13dipx13j2 c7h13dipx13j4 c7h13dipx13j5 c7h13dipx13j6 c7h13dipx13j7 c7h13dipx14j2 c7h13dipx14j3 c7h13dipx14j5 c7h13dipx14j6 c7h13dipx14j7 c7h13dipx15j2 c7h13dipx15j3 c7h13dipx15j4 c7h13dipx15j6 c7h13dipx15j7 c7h13dipx23j1 c7h13dipx23j4 c7h13dipx23j5 c7h13dipx23j6 c7h13dipx23j7 c7h13dipx24j1 c7h13dipx24j3 c7h13dipx24j5 c7h13dipx24j6 c7h13dipx24j7 c7h13dipx25j1 c7h13dipx25j3 c7h13dipx25j4 c7h13dipx25j6 c7h13dipx25j7 c7h13dipx26j1 c7h13dipx26j3 c7h13dipx26j4 c7h13dipx34j1 c7h13dipx34j2 c7h13dipx34j5 c7h13dipx34j6 c7h13dipx34j7 c7h13dipx35j1 c7h13dipx35j2 c7h13dipx35j4 c7cy123 c7cy124 c7cy125 c7cy126 c7cy132 c7cy134 c7cy135 c7cy136 c7cy137 c7cy142 c7cy143 c7cy145 c7cy146 c7cy147 c7cy152 c7cy153 c7cy154 c7cy156 c7cy157 c7cy231 c7cy234 c7cy235 c7cy236 c7cy237 c7cy241 c7cy243 c7cy245 c7cy246 c7cy247 c7cy251 c7cy253 c7cy254 c7cy256 c7cy257 c7cy261 c7cy263 c7cy264 c7cy341 c7cy342 c7cy345 c7cy346 c7cy347 c7cy351 c7cy352 c7cy354 nc7ket12o nc7ket13o nc7ket14o nc7ket15o nc7ket21o nc7ket23o nc7ket24o nc7ket25o nc7ket26o nc7ket31o nc7ket32o nc7ket34o nc7ket35o nc7ket36o nc7ket37o nc7ket41o nc7ket42o nc7ket43o c7h13o1-1 c7h13o1-2 c7h13o1-3 c7h13o1-4 c7h13o1-5 c7h13o2-1 c7h13o2-2 c7h13o2-3 c7h13o2-4 c7h13o2-5 c7h13o2-6 c7h13o3-1 c7h13o3-2 c7h13o3-3 c7h13o3-4 c7h13o3-5 c7h13o3-6 c7h13o4-1 c7h13o4-2 c7h13o4-3 c4h9cococh3 c3h7coch2coch3 c2h5coc2h4coch3 ch3coc3h6coch3 c3h7cococ2h5 c2h5coch2coc2h5 c3h7c2h2coch3 c2h5c2h2ch2coch3 ch3c2h2c2h4coch3 c2h5c2h2coc2h5 ch3c2h2ch2coc2h5 ch3c2h2coc3h7 c7cy12o3 c7cy12o4 c7cy12o5 c7cy12o6 c7cy13o2 c7cy13o4 c7cy13o5 c7cy13o6 c7cy13o7 c7cy14o2 c7cy14o3 c7cy14o5 c7cy14o6 c7cy14o7 c7cy15o2 c7cy15o3 c7cy15o4 c7cy15o6 c7cy15o7 c7cy23o1 c7cy23o4 c7cy23o5 c7cy23o6 c7cy23o7 c7cy24o1 c7cy24o3 c7cy24o5 c7cy24o6 c7cy24o7 c7cy25o1 c7cy25o3 c7cy25o4 c7cy25o6 c7cy25o7 c7cy26o1 c7cy26o3 c7cy26o4 c7cy34o1 c7cy34o2 c7cy34o5 c7cy34o6 c7cy34o7 c7cy35o1 c7cy35o2 c7cy35o4 c7cy142j c7cy143j c7cy152j c7cy153j c7cy154j c7cy243j c7cy253j c7cy254ja c7cy254jb end reactions cal/mole ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! Oa/Reactions of small species C0-C3 ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! h+o2=o+oh 1.915e+14 0.000 16440.0 ! from All_huge_v1a.mech o+h2=h+oh 5.080e+04 2.670 06292.0 ! from All_huge_v1a.mech oh+h2=h+h2o 2.160e+08 1.510 03430.0 ! from All_huge_v1a.mech o+h2o<=>oh+oh 2.970e+06 2.020 13400.0 ! from All_huge_v1a.mech h+h+m=h2+m 1.146e+20 -1.680 00820.0 ! from All_huge_v1a.mech h2/2.5/ h2o/12/ co/1.9/ co2/3.8/ o+o+m=o2+m 6.165e+15 -0.500 00000.0 ! from All_huge_v1a.mech h2/2.5/ h2o/12/ ar/.83/ co/1.9/ co2/3.8/ ch4/2/ c2h6/3/ o+h+m=oh+m 4.714e+18 -1.000 00000.0 ! from All_huge_v1a.mech h2/2.5/ h2o/12/ ar/.75/ co/1.5/ co2/2/ ch4/2/ c2h6/3/ h+oh+m=h2o+m 4.500e+22 -2.000 00000.0 ! from All_huge_v1a.mech h2/.73/ h2o/12/ ar/.38/ ch4/2/ ch/3/ h+o2(+m)=ho2(+m) 1.475e+12 0.600 00000.0 ! from All_huge_v1a.mech low / 3.482e+16 -0.411 -01115.0 / troe / 5.0000e-01 1.0000e-30 1.0000e+30 1.0000e+99 / ! troe fall-off reaction h2/1.3/ h2o/14/ ar/.67/ co/1.9/ co2/3.8/ ch4/2/ c2h6/3/ ho2+h=h2+o2 1.660e+13 0.000 00823.0 ! from All_huge_v1a.mech ho2+h=oh+oh 7.079e+13 0.000 00295.0 ! from All_huge_v1a.mech ho2+o=oh+o2 3.250e+13 0.000 00000.0 ! from All_huge_v1a.mech ho2+oh=h2o+o2 2.890e+13 0.000 -00497.0 ! from All_huge_v1a.mech ho2+ho2=h2o2+o2 4.200e+14 0.000 11980.0 ! from All_huge_v1a.mech duplicate ho2+ho2=h2o2+o2 1.300e+11 0.000 -01629.0 ! from All_huge_v1a.mech duplicate h2o2(+m)=oh+oh(+m) 2.951e+14 0.000 48430.0 ! from All_huge_v1a.mech low / 1.202e+17 0.000 45500.0 / troe / 5.0000e-01 1.0000e-30 1.0000e+30 1.0000e+99 / ! troe fall-off reaction h2/2.5/ h2o/12/ ar/.64/ co/1.9/ co2/3.8/ ch4/2/ c2h6/3/ h2o2+h=h2o+oh 2.410e+13 0.000 03970.0 ! from All_huge_v1a.mech h2o2+h=h2+ho2 6.025e+13 0.000 07950.0 ! from All_huge_v1a.mech h2o2+o=oh+ho2 9.550e+06 2.000 03970.0 ! from All_huge_v1a.mech h2o2+oh=h2o+ho2 1.000e+12 0.000 00000.0 ! from All_huge_v1a.mech duplicate h2o2+oh=h2o+ho2 5.800e+14 0.000 09557.0 ! from All_huge_v1a.mech duplicate co+o(+m)=co2(+m) 1.800e+10 0.000 02384.0 low / 1.350e+24 -2.788 04191.0 / ! lindemann fall-off reaction h2/2/ o2/6/ h2o/6/ ar/.5/ co/1.5/ co2/3.5/ ch4/2/ c2h6/3/ co+o2=co2+o 1.050e+12 0.000 42540.0 co+oh=co2+h 1.400e+05 1.950 -01347.0 co+ho2=co2+oh 3.010e+13 0.000 23000.0 hco+m=h+co+m 1.860e+17 -1.000 17000.0 h2/2/ h2o/12/ co/1.5/ co2/2/ ch4/2/ c2h6/3/ hco+o2=co+ho2 2.710e+10 0.680 -00469.0 hco+h=co+h2 7.340e+13 0.000 00000.0 hco+o=co+oh 3.020e+13 0.000 00000.0 hco+o=co2+h 3.000e+13 0.000 00000.0 hco+oh=co+h2o 1.020e+14 0.000 00000.0 hco+ch3=ch4+co 2.650e+13 0.000 00000.0 ch2o+o2=hco+ho2 8.070e+15 0.000 53420.0 hco+ho2=co2+h+oh 3.000e+13 0.000 00000.0 hco+o2=o2cho 1.200e+11 0.000 -01100.0 ch2o+o2cho=hco+ho2cho 1.990e+12 0.000 11660.0 ho2cho=ocho+oh 5.010e+14 0.000 40150.0 h+co2+m=ocho+m 7.500e+13 0.000 29000.0 hco+hco=ch2o+co 1.800e+13 0.000 00000.0 hco+hco=h2+co+co 3.000e+12 0.000 00000.0 hco+h(+m)=ch2o(+m) 1.090e+12 0.480 -00260.0 low / 1.350e+24 -2.570 01425.0 / troe / 7.8240e-01 2.7100e+02 2.7550e+03 6.5700e+03 / !troe fall-off reaction h2/2/ h2o/6/ ar/.7/ co/1.5/ co2/2/ ch4/2/ c2h6/3/ co+h2(+m)=ch2o(+m) 4.300e+07 1.500 79600.0 low / 5.070e+27 -3.420 84348.0 / troe / 9.3200e-01 1.9700e+02 1.5400e+03 1.0300e+04 / !troe fall-off reaction h2/2/ h2o/6/ ar/.7/ co/1.5/ co2/2/ ch4/2/ c2h6/3/ ch2o+oh=hco+h2o 7.820e+07 1.630 -01055.0 ch2o+h=hco+h2 5.740e+07 1.900 02740.0 ch2o+o=hco+oh 6.260e+09 1.150 02260.0 ch2o+ch3=hco+ch4 3.830e+01 3.360 04312.0 ch2o+ho2=hco+h2o2 7.100e-03 4.520 06580.0 ch2o+oh=hoch2o 4.500e+15 -1.100 00000.0 hoch2o=hocho+h 1.000e+14 0.000 14900.0 hocho=co+h2o 2.300e+13 0.000 50000.0 hocho=co2+h2 1.500e+16 0.000 57000.0 hco+oh=hocho 1.000e+14 0.000 00000.0 ocho+ho2=hocho+o2 3.500e+10 0.000 -03275.0 hocho+oh=h2o+co2+h 2.620e+06 2.060 00916.0 rev/ 0.000e+00 0.000 00000.0 / hocho+oh=h2o+co+oh 1.850e+07 1.510 -00962.0 rev/ 0.000e+00 0.000 00000.0 / hocho+h=h2+co2+h 4.240e+06 2.100 04868.0 rev/ 0.000e+00 0.000 00000.0 / hocho+h=h2+co+oh 6.030e+13 -0.350 02988.0 rev/ 0.000e+00 0.000 00000.0 / hocho+ch3=ch4+co+oh 3.900e-07 5.800 02200.0 rev/ 0.000e+00 0.000 00000.0 / ocho+h2o2=hocho+ho2 2.400e+12 0.000 10000.0 hocho+ho2=h2o2+co+oh 1.000e+12 0.000 01192.0 rev/ 0.000e+00 0.000 00000.0 / hocho+o=co+oh+oh 1.770e+18 -1.900 02975.0 rev/ 0.000e+00 0.000 00000.0 / hocho+hco=ch2o+ocho 8.584e+11 0.040 26750.0 rev/ 5.600e+12 0.000 13600.0 / ch3o(+m)=ch2o+h(+m) 6.800e+13 0.000 26170.0 low / 1.867e+25 -3.000 24307.0 / troe / 9.0000e-01 2.5000e+03 1.3000e+03 1.0000e+99 / !troe fall-off reaction h2/2/ h2o/6/ co/1.5/ co2/2/ ch4/2/ c2h6/3/ ch3o+o2=ch2o+ho2 4.380e-19 9.500 -05501.0 ch2o+ch3o=ch3oh+hco 6.620e+11 0.000 02294.0 ch3+ch3oh=ch4+ch3o 1.440e+01 3.100 06935.0 ch3o+ch3=ch2o+ch4 1.200e+13 0.000 00000.0 ch3o+h=ch2o+h2 2.000e+13 0.000 00000.0 ch3o+ho2=ch2o+h2o2 3.010e+11 0.000 00000.0 ch2o+h(+m)=ch2oh(+m) 5.400e+11 0.450 03600.0 low / 1.2700e+32 -4.820 06530.0 / troe / 7.1870e-01 1.0300e+02 1.2910e+03 4.1600e+03 / !troe fall-off reaction h2/2/ h2o/6/ co/1.5/ co2/2/ ch4/2/ c2h6/3/ ch2oh+o2=ch2o+ho2 1.510e+15 -1.000 00000.0 dup ch2oh+o2=ch2o+ho2 2.410e+14 0.000 05017.0 dup ch2oh+h=ch2o+h2 6.000e+12 0.000 00000.0 ch2oh+ho2=ch2o+h2o2 1.200e+13 0.000 00000.0 ch2oh+hco=ch2o+ch2o 1.800e+14 0.000 00000.0 ch2oh+ch3o=ch2o+ch3oh 2.400e+13 0.000 00000.0 ch3oh+hco=ch2oh+ch2o 9.630e+03 2.900 13110.0 oh+ch2oh=h2o+ch2o 2.400e+13 0.000 00000.0 o+ch2oh=oh+ch2o 4.200e+13 0.000 00000.0 ch2oh+ch2oh=ch2o+ch3oh 3.000e+12 0.000 00000.0 ch2oh+ho2=hoch2o+oh 1.000e+13 0.000 00000.0 ch2o+ho2=och2o2h 1.500e+11 0.000 11900.0 och2o2h=hoch2o2 3.000e+11 0.000 08600.0 hoch2o2+ho2=hoch2o2h+o2 3.500e+10 0.000 -03275.0 hoch2o+oh=hoch2o2h 1.000e+13 0.000 00000.0 ch3oh(+m)=ch3+oh(+m) 1.900e+16 0.000 91730.0 low / 2.950e+44 -7.350 95460.0 / troe / 4.1400e-01 2.7900e+02 5.4590e+03 1.0000e+99 / !troe fall-off reaction ch3oh(+m)=ch2oh+h(+m) 2.690e+16 -0.080 98940.0 low / 2.340e+40 -6.330 103100.0 / troe / 7.7300e-01 6.9300e+02 5.3330e+03 1.0000e+99 / !troe fall-off reaction ch3oh+h=ch3o+h2 3.600e+12 0.000 06095.0 ch3oh+h=ch2oh+h2 1.204e+06 2.400 02583.0 ch3oh+o=ch2oh+oh 3.880e+05 2.500 03080.0 ch3oh+oh=ch3o+h2o 5.130e+05 2.130 02450.0 ch3oh+oh=ch2oh+h2o 1.440e+06 2.000 -00839.0 ch3oh+o2=ch2oh+ho2 2.050e+13 0.000 44900.0 ch3oh+ho2=ch2oh+h2o2 1.080e+04 2.550 10530.0 ch3oh+ch3=ch2oh+ch4 3.190e+01 3.170 07172.0 ch3o+ch3oh=ch2oh+ch3oh 3.000e+11 0.000 04074.0 ch3o+ch3o=ch3oh+ch2o 6.030e+13 0.000 00000.0 ch3+h(+m)=ch4(+m) 2.108e+14 0.000 00000.0 low / 6.165e+23 -1.800 00000.0 / troe / 3.7000e-01 3.3150e+03 6.1000e+01 1.0000e+99 / !troe fall-off reaction h2/2/ h2o/6/ ar/.7/ co/1.5/ co2/2/ ch4/2/ c2h6/3/ ch4+h=ch3+h2 6.140e+05 2.500 09587.0 ch4+oh=ch3+h2o 5.830e+04 2.600 02190.0 ch4+o=ch3+oh 4.396e+05 2.500 06577.0 ch4+ho2=ch3+h2o2 6.776e+04 2.500 21000.0 ch4+ch2=ch3+ch3 2.460e+06 2.000 08270.0 ch3+oh=ch2o+h2 3.190e+09 0.000 05027.0 ch3+oh=ch2(s)+h2o 6.440e+17 -1.340 01417.0 ch3+oh=ch3o+h 7.226e+11 0.000 05484.0 ch3+oh=ch2oh+h 1.204e+10 0.000 13890.0 ch3+oh=ch2+h2o 5.600e+07 1.600 05420.0 ch3+ho2=ch3o+oh 1.100e+13 0.000 00000.0 ch3+ho2=ch4+o2 3.610e+12 0.000 00000.0 ch3+o=ch2o+h 5.540e+13 0.050 -00136.0 ch3+o2=ch3o+o 1.375e+13 0.000 30520.0 ch3+o2=ch2o+oh 5.870e+11 0.000 14240.0 ch3+o2(+m)=ch3o2(+m) 1.006e+08 1.630 00000.0 low / 3.816e+31 -4.890 03432.0 / troe / 4.5000e-02 8.8010e+02 2.5000e+09 1.7860e+09 / !troe fall-off reaction ch3o2+ch2o=ch3o2h+hco 1.990e+12 0.000 11660.0 ch4+ch3o2=ch3+ch3o2h 1.810e+11 0.000 18480.0 ch3oh+ch3o2=ch2oh+ch3o2h 1.810e+12 0.000 13710.0 ch3o2+ch3=ch3o+ch3o 9.000e+12 0.000 -01200.0 ch3o2+ho2=ch3o2h+o2 2.470e+11 0.000 -01570.0 ch3o2+ch3o2=ch2o+ch3oh+o2 3.110e+14 -1.610 -01051.0 rev/ 0.000e+00 0.000 00000.0 / ch3o2+ch3o2=o2+ch3o+ch3o 1.400e+16 -1.610 01860.0 rev/ 0.000e+00 0.000 00000.0 / ch3o2+h=ch3o+oh 9.600e+13 0.000 00000.0 ch3o2+o=ch3o+o2 3.600e+13 0.000 00000.0 ch3o2+oh=ch3oh+o2 6.000e+13 0.000 00000.0 h2+ch3o2=h+ch3o2h 1.500e+14 0.000 26030.0 ch3o2h=ch3o+oh 6.310e+14 0.000 42300.0 ch2(s)=ch2 1.000e+13 0.000 00000.0 ch2(s)+ch4=ch3+ch3 1.600e+13 0.000 -00570.0 ch2(s)+o2=co+oh+h 7.000e+13 0.000 00000.0 rev/ 0.000e+00 0.000 00000.0 / ch2(s)+h2=ch3+h 7.000e+13 0.000 00000.0 ch2(s)+h=ch2+h 3.000e+13 0.000 00000.0 ch2(s)+h=ch+h2 3.000e+13 0.000 00000.0 ch2(s)+o=co+h+h 3.000e+13 0.000 00000.0 rev/ 0.000e+00 0.000 00000.0 / ch2(s)+oh=ch2o+h 3.000e+13 0.000 00000.0 ch2(s)+co2=ch2o+co 3.000e+12 0.000 00000.0 ch2+h(+m)=ch3(+m) 2.500e+16 -0.800 00000.0 low / 3.200e+27 -3.140 01230.0 / troe / 6.8000e-01 7.8000e+01 1.9950e+03 5.5900e+03 / !troe fall-off reaction h2/2/ h2o/6/ ar/.7/ co/1.5/ co2/2/ ch4/2/ c2h6/3/ ch2+o2=co+h2o 7.280e+19 -2.540 01809.0 ch2+o2=hco+oh 1.290e+20 -3.300 00284.0 ch2+o2=co2+h+h 3.290e+21 -3.300 0286830 rev/ 0.000e+00 0.000 00000.0 / ch2+o2=ch2o+o 3.290e+21 -3.300 02868.0 ch2+o2=co2+h2 1.010e+21 -3.300 01508.0 ch2+o=co+h+h 5.000e+13 0.000 00000.0 rev/ 0.000e+00 0.000 00000.0 / ch2+h=ch+h2 1.000e+18 -1.560 00000.0 duplicate ch2+oh=ch+h2o 1.130e+07 2.000 03000.0 ch+o2=hco+o 3.300e+13 0.000 00000.0 c+oh=co+h 5.000e+13 0.000 00000.0 c+o2=co+o 5.000e+13 0.000 00000.0 ch+h=c+h2 5.000e+13 0.000 00000.0 ch+o=co+h 5.700e+13 0.000 00000.0 ch+oh=hco+h 3.000e+13 0.000 00000.0 ch2+h=ch+h2 2.700e+11 0.670 25700.0 duplicate ch+h2o=h+ch2o 1.713e+13 0.000 -00755.0 ch+co2=hco+co 1.700e+12 0.000 00685.0 c2h4+h(+m)=c2h5(+m) 3.975e+09 1.280 01292.0 low / 2.791e+18 0.000 00755.0 / troe / 7.6000e-01 4.0000e+01 1.0250e+03 1.0000e+99 / !troe fall-off reaction h2/2/ h2o/6/ ar/.7/ co/1.5/ co2/2/ ch4/2/ c2h6/3/ h2+c2h5o2=h+c2h5o2h 1.500e+14 0.000 26030.0 c2h5+o2=c2h5o+o 1.100e-17 -0.210 27940.0 c2h4+c2h4=c2h5+c2h3 4.820e+14 0.000 71530.0 ch3+c2h5=ch4+c2h4 1.950e+13 -0.500 00000.0 ch3+ch3=c2h5+h 3.160e+13 0.000 14670.0 c2h5+h=c2h4+h2 2.000e+12 0.000 00000.0 c2h5+o=ch3cho+h 1.100e+14 0.000 00000.0 c2h5+ho2=c2h5o+oh 1.100e+13 0.000 00000.0 ch3o2+c2h5=ch3o+c2h5o 8.000e+12 0.000 -01000.0 c2h5o+o2=ch3cho+ho2 4.280e+10 0.000 01097.0 ch3+ch2o=c2h5o 3.000e+11 0.000 06336.0 ch3cho+h=c2h5o 8.000e+12 0.000 06400.0 c2h5+o2=c2h5o2 2.940e+13 -0.440 00000.0 c2h5o2+ch2o=c2h5o2h+hco 1.990e+12 0.000 11660.0 ch4+c2h5o2=ch3+c2h5o2h 1.810e+11 0.000 18480.0 ch3oh+c2h5o2=ch2oh+c2h5o2h 1.810e+12 0.000 13710.0 c2h5o2+ho2=c2h5o2h+o2 1.750e+10 0.000 -03275.0 c2h6+c2h5o2=c2h5+c2h5o2h 1.320e+13 0.000 20470.0 c2h5o2h=c2h5o+oh 6.310e+14 0.000 42300.0 c2h5o2=c2h4o2h 7.900e+06 1.790 35820.0 c2h5o2=c2h4+ho2 8.800e+05 2.240 29610.0 c2h4o2h=c2h4o1-2+oh 1.320e+10 0.720 15380.0 c2h4o2h=c2h4+ho2 1.280e+11 0.520 16150.0 c2h5o2=c2h5o+o 2.980e+15 -0.090 61600.0 c2h4o1-2=ch3+hco 3.630e+13 0.000 57200.0 c2h4o1-2=ch3cho 7.407e+12 0.000 53800.0 c2h4o1-2+oh=c2h3o1-2+h2o 1.780e+13 0.000 03610.0 c2h4o1-2+h=c2h3o1-2+h2 8.000e+13 0.000 09680.0 c2h4o1-2+ho2=c2h3o1-2+h2o2 1.130e+13 0.000 30430.0 c2h4o1-2+ch3o2=c2h3o1-2+ch3o2h 1.130e+13 0.000 30430.0 c2h4o1-2+c2h5o2=c2h3o1-2+c2h5o2h 1.130e+13 0.000 30430.0 c2h4o1-2+ch3=c2h3o1-2+ch4 1.070e+12 0.000 11830.0 c2h4o1-2+ch3o=c2h3o1-2+ch3oh 1.200e+11 0.000 06750.0 c2h3o1-2=ch3co 8.500e+14 0.000 14000.0 c2h3o1-2=ch2cho 1.000e+14 0.000 14000.0 ch3+hco=ch3cho 1.750e+13 0.000 00000.0 ch3cho+h=ch3co+h2 1.110e+13 0.000 03110.0 ch3cho+o=ch3co+oh 5.940e+12 0.000 01868.0 ch3cho+oh=ch3co+h2o 2.000e+06 1.800 01300.0 ch3cho+o2=ch3co+ho2 3.010e+13 0.000 39150.0 ch3cho+ch3=ch3co+ch4 1.760e+03 2.790 04950.0 ch3cho+ho2=ch3co+h2o2 3.010e+12 0.000 11920.0 ch3o2+ch3cho=ch3o2h+ch3co 3.010e+12 0.000 11920.0 ch3cho+ch3co3=ch3co+ch3co3h 3.010e+12 0.000 11920.0 ch3cho+oh=ch3+hocho 3.000e+15 -1.080 00000.0 ch3cho+oh=ch2cho+h2o 1.720e+05 2.400 00815.0 ch3co(+m)=ch3+co(+m) 3.000e+12 0.000 16720.0 low / 1.200e+15 0.000 12518.0 / !lindemann fall-off reaction ch3co+h=ch2co+h2 2.000e+13 0.000 00000.0 ch3co+o=ch2co+oh 2.000e+13 0.000 00000.0 ch3co+ch3=ch2co+ch4 5.000e+13 0.000 00000.0 ch3co+o2=ch3co3 1.200e+11 0.000 -01100.0 ch3co3+ho2=ch3co3h+o2 1.750e+10 0.000 -03275.0 h2o2+ch3co3=ho2+ch3co3h 2.410e+12 0.000 09936.0 ch4+ch3co3=ch3+ch3co3h 1.810e+11 0.000 18480.0 ch2o+ch3co3=hco+ch3co3h 1.990e+12 0.000 11660.0 c2h6+ch3co3=c2h5+ch3co3h 1.700e+13 0.000 20460.0 ch3co3h=ch3co2+oh 5.010e+14 0.000 40150.0 ch3co2+m=ch3+co2+m 4.400e+15 0.000 10500.0 ch2co+h=ch2cho 5.000e+13 0.000 12300.0 ch2cho+o2=ch2o+co+oh 2.000e+13 0.000 04200.0 rev/ 0.000e+00 0.000 00000.0 / ch2+co(+m)=ch2co(+m) 8.100e+11 0.000 00000.0 low / 2.690e+33 -5.110 07095.0 / troe / 5.9070e-01 2.7500e+02 1.2260e+03 5.1850e+03 / !troe fall-off reaction h2/2/ h2o/6/ ar/.7/ co/1.5/ co2/2/ ch4/2/ c2h6/3/ ch2co+h=ch3+co 1.100e+13 0.000 03400.0 ch2co+h=hcco+h2 2.000e+14 0.000 08000.0 ch2co+o=ch2+co2 1.750e+12 0.000 01350.0 ch2co+o=hcco+oh 1.000e+13 0.000 08000.0 ch2co+oh=hcco+h2o 1.000e+13 0.000 02000.0 ch2co+oh=ch2oh+co 3.730e+12 0.000 -01013.0 ch2(s)+ch2co=c2h4+co 1.600e+14 0.000 00000.0 hcco+oh=hco+hco 1.000e+13 0.000 00000.0 h+hcco=ch2(s)+co 1.100e+13 0.000 00000.0 hcco+o=h+co+co 8.000e+13 0.000 00000.0 rev/ 0.000e+00 0.000 00000.0 / hcco+o2=co2+hco 2.400e+11 0.000 -00854.0 hcco+m=ch+co+m 6.500e+15 0.000 58820.0 ch+ch2o=h+ch2co 9.460e+13 0.000 -00515.0 ch+hcco=co+c2h2 5.000e+13 0.000 00000.0 c2h3+h(+m)=c2h4(+m) 1.360e+14 0.170 00660.0 low / 1.400e+30 -3.860 03320.0 / troe / 7.8200e-01 2.0750e+02 2.6630e+03 6.0950e+03 / !troe fall-off reaction h2/2/ h2o/6/ ar/.7/ co/1.5/ co2/2/ ch4/2/ c2h6/3/ c2h4(+m)=c2h2+h2(+m) 8.000e+12 0.440 88770.0 low / 1.580e+51 -9.300 97800.0 / troe / 7.3500e-01 1.8000e+02 1.0350e+03 5.4170e+03 / !troe fall-off reaction h2/2/ h2o/6/ ar/.7/ co/1.5/ co2/2/ ch4/2/ c2h6/3/ c2h4+h=c2h3+h2 5.070e+07 1.930 12950.0 c2h4+o=ch3+hco 8.564e+06 1.880 00183.0 c2h4+o=ch2cho+h 4.986e+06 1.880 00183.0 c2h4+oh=c2h3+h2o 2.090e+06 2.010 01160.0 c2h4+ch3=c2h3+ch4 6.620e+00 3.700 09500.0 c2h4+o2=c2h3+ho2 4.000e+13 0.000 58200.0 c2h4+ch3o=c2h3+ch3oh 1.200e+11 0.000 06750.0 c2h4+ch3o2=c2h3+ch3o2h 2.230e+12 0.000 17190.0 c2h4+c2h5o2=c2h3+c2h5o2h 2.230e+12 0.000 17190.0 c2h4+ch3co3=c2h3+ch3co3h 1.130e+13 0.000 30430.0 c2h4+ch3o2=c2h4o1-2+ch3o 2.820e+12 0.000 17110.0 c2h4+c2h5o2=c2h4o1-2+c2h5o 2.820e+12 0.000 17110.0 c2h4+ho2=c2h4o1-2+oh 2.230e+12 0.000 17190.0 ch+ch4=c2h4+h 6.000e+13 0.000 00000.0 ch2(s)+ch3=c2h4+h 2.000e+13 0.000 00000.0 c2h2+h(+m)=c2h3(+m) 5.600e+12 0.000 02400.0 low / 3.8000e+40 -7.270 07220.0 / troe / 7.5100e-01 9.8500e+01 1.3020e+03 4.1670e+03 / !troe fall-off reaction h2/2/ h2o/6/ ar/.7/ co/1.5/ co2/2/ ch4/2/ c2h6/3/ c2h3+o2=c2h2+ho2 2.120e-06 6.000 09484.0 c2h3+o2=ch2o+hco 1.700e+29 -5.310 06500.0 c2h3+o2=ch2cho+o 5.500e+14 -0.610 05260.0 ch3+c2h3=ch4+c2h2 3.920e+11 0.000 00000.0 c2h3+h=c2h2+h2 3.000e+13 0.000 00000.0 c2h3+oh=c2h2+h2o 5.000e+12 0.000 00000.0 c2h+h(+m)=c2h2(+m) 1.000e+17 0.000 00000.0 low / 3.750e+33 -4.800 01900.0 / troe / 6.4600e-01 1.3200e+02 1.3150e+03 5.5660e+03 / !troe fall-off reaction h2/2/ h2o/6/ ar/.7/ co/1.5/ co2/2/ ch4/2/ c2h6/3/ c2h2+o2=hcco+oh 2.000e+08 1.500 30100.0 o+c2h2=c2h+oh 4.600e+19 -1.400 28950.0 c2h2+o=ch2+co 2.349e+08 1.400 02206.0 c2h2+o=hcco+h 9.394e+08 1.400 02206.0 c2h2+oh=c2h+h2o 3.370e+07 2.000 14000.0 c2h2+oh=ch2co+h 3.236e+13 0.000 12000.0 c2h2+oh=ch3+co 4.830e-04 4.000 -02000.0 oh+c2h2=h+hccoh 5.040e+05 2.300 13500.0 h+hccoh=h+ch2co 1.000e+13 0.000 00000.0 c2h5oh(+m)=ch2oh+ch3(+m) 5.710e+23 -1.680 94400.0 low / 3.110e+85 -18.84 113100.0 / troe / 5.0000e-01 5.5000e+02 8.2500e+02 6.1000e+03 / !troe fall-off reaction h2/2/ h2o/5/ co/2/ co2/3/ c2h5oh(+m)=c2h5+oh(+m) 2.400e+23 -1.620 99540.0 low / 5.110e+85 -18.80 118770.0 / troe / 5.0000e-01 6.5000e+02 8.0000e+02 1.0000e+15 / !troe fall-off reaction h2/2/ h2o/5/ co/2/ co2/3/ c2h5oh(+m)=c2h4+h2o(+m) 2.790e+13 0.090 66140.0 low / 2.570e+83 -18.85 86453.0 / troe / 7.0000e-01 3.5000e+02 8.0000e+02 3.8000e+03 / !troe fall-off reaction h2o/5/ c2h5oh(+m)=ch3cho+h2(+m) 7.240e+11 0.100 91010.0 low / 4.460e+87 -19.42 115580.0 / troe / 9.0000e-01 9.0000e+02 1.1000e+03 3.5000e+03 / !troe fall-off reaction h2o/5/ c2h5oh+o2=pc2h4oh+ho2 2.000e+13 0.000 52800.0 c2h5oh+o2=sc2h4oh+ho2 1.500e+13 0.000 50150.0 c2h5oh+oh=pc2h4oh+h2o 1.740e+11 0.270 00600.0 c2h5oh+oh=sc2h4oh+h2o 4.640e+11 0.150 00000.0 c2h5oh+oh=c2h5o+h2o 7.460e+11 0.300 01634.0 c2h5oh+h=pc2h4oh+h2 1.230e+07 1.800 05098.0 c2h5oh+h=sc2h4oh+h2 2.580e+07 1.650 02827.0 c2h5oh+h=c2h5o+h2 1.500e+07 1.600 03038.0 c2h5oh+ho2=pc2h4oh+h2o2 1.230e+04 2.550 15750.0 c2h5oh+ho2=sc2h4oh+h2o2 8.200e+03 2.550 10750.0 c2h5oh+ho2=c2h5o+h2o2 2.500e+12 0.000 24000.0 c2h5oh+ch3o2=pc2h4oh+ch3o2h 1.230e+04 2.550 15750.0 c2h5oh+ch3o2=sc2h4oh+ch3o2h 8.200e+03 2.550 10750.0 c2h5oh+ch3o2=c2h5o+ch3o2h 2.500e+12 0.000 24000.0 c2h5oh+o=pc2h4oh+oh 9.410e+07 1.700 05459.0 c2h5oh+o=sc2h4oh+oh 1.880e+07 1.850 01824.0 c2h5oh+o=c2h5o+oh 1.580e+07 2.000 04448.0 c2h5oh+ch3=pc2h4oh+ch4 1.330e+02 3.180 09362.0 c2h5oh+ch3=sc2h4oh+ch4 4.440e+02 2.900 07690.0 c2h5oh+ch3=c2h5o+ch4 1.340e+02 2.920 07452.0 c2h5oh+c2h5=pc2h4oh+c2h6 5.000e+10 0.000 13400.0 c2h5oh+c2h5=sc2h4oh+c2h6 5.000e+10 0.000 10400.0 c2h4+oh=pc2h4oh 4.170e+20 -2.840 01240.0 sc2h4oh+m=ch3cho+h+m 1.000e+14 0.000 25000.0 o2c2h4oh=pc2h4oh+o2 3.900e+16 -1.000 30000.0 o2c2h4oh=oh+ch2o+ch2o 3.125e+09 0.000 18900.0 rev/ 0.000e+00 0.000 00000.0 / sc2h4oh+o2=ch3cho+ho2 3.810e+06 2.000 01641.0 ch3coch3(+m)=ch3co+ch3(+m) 7.108e+21 -1.570 84680.0 low / 9.915e+89 -20.38 107350.0 / troe / 2.8400e-01 1.9700e+01 1.0000e+10 9.9240e+09 / !troe fall-off reaction ch3coch3+oh=ch3coch2+h2o 1.958e+01 3.640 -01128.0 ch3coch3+h=ch3coch2+h2 2.940e+06 2.430 05160.0 ch3coch3+o=ch3coch2+oh 5.130e+11 0.210 04890.0 ch3coch3+ch3=ch3coch2+ch4 3.960e+11 0.000 09784.0 ch3coch3+ch3o=ch3coch2+ch3oh 4.340e+11 0.000 06460.0 ch3coch3+o2=ch3coch2+ho2 6.030e+13 0.000 48500.0 ch3coch3+ho2=ch3coch2+h2o2 1.700e+13 0.000 20460.0 ch3coch3+ch3o2=ch3coch2+ch3o2h 1.700e+13 0.000 20460.0 ch3coch2=ch2co+ch3 1.000e+14 0.000 31000.0 ch3coch2+o2=ch3coch2o2 1.200e+11 0.000 -01100.0 ch3coch3+ch3coch2o2=ch3coch2+ch3coch2o2h 1.000e+11 0.000 05000.0 ch2o+ch3coch2o2=hco+ch3coch2o2h 1.288e+11 0.000 09000.0 ho2+ch3coch2o2=ch3coch2o2h+o2 1.000e+12 0.000 00000.0 rev/ 0.000e+00 0.000 00000.0 / ch3coch2o2h=ch3coch2o+oh 1.000e+16 0.000 43000.0 ch3co+ch2o=ch3coch2o 1.000e+11 0.000 11900.0 c2h3+hco=c2h3cho 1.810e+13 0.000 00000.0 c2h3cho+h=c2h3co+h2 1.340e+13 0.000 03300.0 c2h3cho+o=c2h3co+oh 5.940e+12 0.000 01868.0 c2h3cho+oh=c2h3co+h2o 9.240e+06 1.500 -00962.0 c2h3cho+o2=c2h3co+ho2 1.005e+13 0.000 40700.0 c2h3cho+ho2=c2h3co+h2o2 3.010e+12 0.000 11920.0 c2h3cho+ch3=c2h3co+ch4 2.608e+06 1.780 05911.0 c2h3cho+c2h3=c2h3co+c2h4 1.740e+12 0.000 08440.0 c2h3cho+ch3o=c2h3co+ch3oh 1.000e+12 0.000 03300.0 c2h3cho+ch3o2=c2h3co+ch3o2h 3.010e+12 0.000 11920.0 c2h3+co=c2h3co 1.510e+11 0.000 04810.0 c2h5+hco=c2h5cho 1.810e+13 0.000 00000.0 c2h5cho+h=c2h5co+h2 4.000e+13 0.000 04200.0 c2h5cho+o=c2h5co+oh 5.000e+12 0.000 01790.0 c2h5cho+oh=c2h5co+h2o 2.690e+10 0.760 -00340.0 c2h5cho+ch3=c2h5co+ch4 2.608e+06 1.780 05911.0 c2h5cho+ho2=c2h5co+h2o2 2.800e+12 0.000 13600.0 c2h5cho+ch3o=c2h5co+ch3oh 1.000e+12 0.000 03300.0 c2h5cho+ch3o2=c2h5co+ch3o2h 3.010e+12 0.000 11920.0 c2h5cho+c2h5=c2h5co+c2h6 1.000e+12 0.000 08000.0 c2h5cho+c2h5o=c2h5co+c2h5oh 6.026e+11 0.000 03300.0 c2h5cho+c2h5o2=c2h5co+c2h5o2h 3.010e+12 0.000 11920.0 c2h5cho+o2=c2h5co+ho2 1.005e+13 0.000 40700.0 c2h5cho+ch3co3=c2h5co+ch3co3h 3.010e+12 0.000 11920.0 c2h5cho+c2h3=c2h5co+c2h4 1.700e+12 0.000 08440.0 c2h5+co=c2h5co 1.510e+11 0.000 04810.0 ch3och3(+m)=ch3+ch3o(+m) 4.061e+15 0.160 79490.0 low / 2.541e+70 -14.43 96080.0 / troe / 8.3300e-01 4.7060e+09 5.7944e+02 6.7000e+08 / !troe fall-off reaction ch3och3+oh=ch3och2+h2o 6.324e+06 2.000 -00651.7 ch3och3+h=ch3och2+h2 7.721e+06 2.090 03384.0 ch3och3+o=ch3och2+oh 1.855e-03 5.290 -00109.0 ch3och3+ho2=ch3och2+h2o2 1.680e+13 0.000 17690.0 ch3och3+ch3o2=ch3och2+ch3o2h 1.680e+13 0.000 17690.0 ch3och3+ch3=ch3och2+ch4 1.445e-06 5.730 05699.0 ch3och3+o2=ch3och2+ho2 4.100e+13 0.000 44910.0 ch3och3+ch3o=ch3och2+ch3oh 6.020e+11 0.000 04074.0 ch3och3+ch3och2o2=ch3och2+ch3och2o2h 5.000e+12 0.000 17690.0 ch3och3+o2cho=ch3och2+ho2cho 4.425e+04 2.600 13910.0 ch3och3+ocho=ch3och2+hocho 1.000e+13 0.000 17690.0 ch3och2=ch2o+ch3 1.600e+13 0.000 25500.0 ch3och2+ch3o=ch3och3+ch2o 2.410e+13 0.000 00000.0 ch3och2+ch2o=ch3och3+hco 5.490e+03 2.800 05862.0 ch3och2+ch3cho=ch3och3+ch3co 1.260e+12 0.000 08499.0 ch3och2+o2=ch3och2o2 2.000e+12 0.000 00000.0 ch3och2o2+ch2o=ch3och2o2h+hco 1.000e+12 0.000 11660.0 ch3och2o2+ch3cho=ch3och2o2h+ch3co 2.800e+12 0.000 13600.0 ch3och2o2+ch3och2o2=o2+ch3och2o+ch3och2o 2.210e+23 -4.500 00000.0 rev/ 0.000e+00 0.000 00000.0 / ch3och2o+oh=ch3och2o2h 2.000e+13 0.000 00000.0 ch3o+ch2o=ch3och2o 1.000e+11 0.000 11900.0 ch3och2o+o2=ch3ocho+ho2 5.000e+10 0.000 00500.0 ch3ocho+h=ch3och2o 1.000e+13 0.000 07838.0 ch3och2o2=ch2och2o2h 6.000e+10 0.000 21580.0 ch2och2o2h=oh+ch2o+ch2o 1.500e+13 0.000 20760.0 rev/ 0.000e+00 0.000 00000.0 / ch2och2o2h+o2=o2ch2och2o2h 7.000e+11 0.000 00000.0 o2ch2och2o2h=ho2ch2ocho+oh 4.000e+10 0.000 18580.0 ho2ch2ocho=och2ocho+oh 2.000e+16 0.000 40500.0 ch2o+ocho=och2ocho 1.250e+11 0.000 11900.0 och2ocho=hoch2oco 1.000e+11 0.000 14000.0 hoch2o+co=hoch2oco 1.500e+11 0.000 04800.0 ch2oh+co2=hoch2oco 1.500e+11 0.000 35720.0 ch2ocho+h=ch3ocho 1.000e+14 0.000 00000.0 ch3oco+h=ch3ocho 1.000e+14 0.000 00000.0 ch3ocho=ch3oh+co 1.000e+14 0.000 62500.0 ch3o+hco=ch3ocho 3.000e+13 0.000 00000.0 ch3+ocho=ch3ocho 1.000e+13 0.000 00000.0 ch3ocho+o2=ch3oco+ho2 1.000e+13 0.000 49700.0 ch3ocho+o2=ch2ocho+ho2 2.050e+13 0.000 52000.0 ch3ocho+oh=ch3oco+h2o 2.340e+07 1.610 -00035.0 ch3ocho+oh=ch2ocho+h2o 5.270e+09 0.970 01586.0 ch3ocho+ho2=ch3oco+h2o2 4.820e+03 2.600 13910.0 ch3ocho+ho2=ch2ocho+h2o2 2.380e+04 2.550 16490.0 ch3ocho+o=ch3oco+oh 2.755e+05 2.450 02830.0 ch3ocho+o=ch2ocho+oh 9.800e+05 2.430 04750.0 ch3ocho+h=ch3oco+h2 6.500e+05 2.400 04471.0 ch3ocho+h=ch2ocho+h2 6.650e+05 2.540 06756.0 ch3ocho+ch3=ch3oco+ch4 7.550e-01 3.460 05481.0 ch3ocho+ch3=ch2ocho+ch4 4.520e-01 3.650 07154.0 ch3ocho+ch3o=ch3oco+ch3oh 5.480e+11 0.000 05000.0 ch3ocho+ch3o=ch2ocho+ch3oh 2.170e+11 0.000 06458.0 ch3ocho+ch3o2=ch3oco+ch3o2h 4.820e+03 2.600 13910.0 ch3ocho+ch3o2=ch2ocho+ch3o2h 2.380e+04 2.550 16490.0 ch3ocho+hco=ch3oco+ch2o 5.400e+06 1.900 17010.0 ch3ocho+hco=ch2ocho+ch2o 1.025e+05 2.500 18430.0 ch2ocho=ch3oco 2.620e+11 -0.030 38180.0 ch2o+hco=ch2ocho 1.500e+11 0.000 11900.0 ch3+co2=ch3oco 4.760e+07 1.540 34700.0 !0 glaude et al., 2005 ch3o+co=ch3oco 1.550e+06 2.020 05730.0 !0 glaude et al., 2005 !added 070131 ch3+c2h5(+m)=c3h8(+m) 1.880e+13 0.000 00000.0 low / 2.710e+74 -16.82 13065.0 / troe / 1.5270e-01 2.9100e+02 2.7420e+03 7.7480e+03 / !troe fall-off reaction h2/2/ h2o/6/ ar/.7/ co/1.5/ co2/2/ ch4/2/ ch/3/ nc3h7+h=c3h8 1.000e+14 0.000 00000.0 ic3h7+h=c3h8 1.000e+14 0.000 00000.0 c3h8+o2=ic3h7+ho2 2.000e+13 0.000 49640.0 c3h8+o2=nc3h7+ho2 6.000e+13 0.000 52290.0 h+c3h8=h2+ic3h7 1.300e+06 2.400 04471.0 h+c3h8=h2+nc3h7 1.330e+06 2.540 06756.0 c3h8+o=ic3h7+oh 5.490e+05 2.500 03140.0 c3h8+o=nc3h7+oh 3.710e+06 2.400 05505.0 c3h8+oh=nc3h7+h2o 1.054e+10 0.970 01586.0 c3h8+oh=ic3h7+h2o 4.670e+07 1.610 -00035.0 c3h8+ho2=ic3h7+h2o2 5.880e+04 2.500 14860.0 c3h8+ho2=nc3h7+h2o2 8.100e+04 2.500 16690.0 ch3+c3h8=ch4+ic3h7 6.400e+04 2.170 07520.0 ch3+c3h8=ch4+nc3h7 9.040e-01 3.650 07154.0 ic3h7+c3h8=nc3h7+c3h8 3.000e+10 0.000 12900.0 c2h3+c3h8=c2h4+ic3h7 1.000e+11 0.000 10400.0 c2h3+c3h8=c2h4+nc3h7 1.000e+11 0.000 10400.0 c2h5+c3h8=c2h6+ic3h7 1.000e+11 0.000 10400.0 c2h5+c3h8=c2h6+nc3h7 1.000e+11 0.000 10400.0 c3h8+c3h5-a=nc3h7+c3h6 7.940e+11 0.000 20500.0 c3h8+c3h5-a=ic3h7+c3h6 7.940e+11 0.000 16200.0 c3h8+ch3o=nc3h7+ch3oh 3.000e+11 0.000 07000.0 c3h8+ch3o=ic3h7+ch3oh 3.000e+11 0.000 07000.0 ch3o2+c3h8=ch3o2h+nc3h7 8.100e+04 2.500 16690.0 ch3o2+c3h8=ch3o2h+ic3h7 5.880e+04 2.500 14860.0 c2h5o2+c3h8=c2h5o2h+nc3h7 8.100e+04 2.500 16690.0 c2h5o2+c3h8=c2h5o2h+ic3h7 5.880e+04 2.500 14860.0 nc3h7o2+c3h8=nc3h7o2h+nc3h7 1.700e+13 0.000 20460.0 nc3h7o2+c3h8=nc3h7o2h+ic3h7 2.000e+12 0.000 17000.0 ic3h7o2+c3h8=ic3h7o2h+nc3h7 1.700e+13 0.000 20460.0 ic3h7o2+c3h8=ic3h7o2h+ic3h7 2.000e+12 0.000 17000.0 c3h8+ch3co3=ic3h7+ch3co3h 2.000e+12 0.000 17000.0 c3h8+ch3co3=nc3h7+ch3co3h 1.700e+13 0.000 20460.0 c3h8+o2cho=nc3h7+ho2cho 5.520e+04 2.550 16480.0 c3h8+o2cho=ic3h7+ho2cho 1.475e+04 2.600 13910.0 h+c3h6=ic3h7 2.640e+13 0.000 02160.0 ic3h7+h=c2h5+ch3 2.000e+13 0.000 00000.0 ic3h7+o2=c3h6+ho2 4.500e-19 0.000 05020.0 ic3h7+oh=c3h6+h2o 2.410e+13 0.000 00000.0 ic3h7+o=ch3coch3+h 4.818e+13 0.000 00000.0 ic3h7+o=ch3cho+ch3 4.818e+13 0.000 00000.0 ch3+c2h4=nc3h7 2.422e+34 -7.010 16850.0 h+c3h6=nc3h7 2.070e+37 -7.390 12020.0 c2h5cho+nc3h7=c2h5co+c3h8 1.700e+12 0.000 08440.0 c2h5cho+ic3h7=c2h5co+c3h8 1.700e+12 0.000 08440.0 c2h5cho+c3h5-a=c2h5co+c3h6 1.700e+12 0.000 08440.0 c3h6=c2h3+ch3 2.730e+62 -13.28 123200.0 c3h6=c3h5-a+h 2.010e+61 -13.26 118500.0 c3h6=c3h5-s+h 7.710e+69 -16.09 140000.0 c3h6=c3h5-t+h 5.620e+71 -16.58 139300.0 c3h6+o=c2h5+hco 1.580e+07 1.760 -01216.0 c3h6+o=ch2co+ch3+h 2.500e+07 1.760 00076.0 rev/ 0.000e+00 0.000 00000.0 / c3h6+o=ch3chco+h+h 2.500e+07 1.760 00076.0 rev/ 0.000e+00 0.000 00000.0 / c3h6+o=c3h5-a+oh 5.240e+11 0.700 05884.0 c3h6+o=c3h5-s+oh 1.200e+11 0.700 08959.0 c3h6+o=c3h5-t+oh 6.030e+10 0.700 07632.0 c3h6+oh=c3h5-a+h2o 3.120e+06 2.000 -00298.0 c3h6+oh=c3h5-s+h2o 2.110e+06 2.000 02778.0 c3h6+oh=c3h5-t+h2o 1.110e+06 2.000 01451.0 c3h6+ho2=c3h5-a+h2o2 9.640e+03 2.600 13910.0 c3h6+ho2=c3h5-s+h2o2 7.500e-21 0.000 12570.0 c3h6+ho2=c3h5-t+h2o2 3.000e-21 0.000 09930.0 c3h6+h=c3h5-a+h2 1.730e+05 2.500 02492.0 c3h6+h=c3h5-s+h2 8.040e+05 2.500 12280.0 c3h6+h=c3h5-t+h2 4.050e+05 2.500 09794.0 c3h6+h=c2h4+ch3 4.830e+34 -5.810 18500.0 c3h6+o2=c3h5-a+ho2 4.000e+12 0.000 39900.0 c3h6+o2=c3h5-s+ho2 2.000e+12 0.000 62900.0 c3h6+o2=c3h5-t+ho2 1.400e+12 0.000 60700.0 c3h6+ch3=c3h5-a+ch4 2.210e+00 3.500 05675.0 c3h6+ch3=c3h5-s+ch4 1.348e+00 3.500 12850.0 c3h6+ch3=c3h5-t+ch4 8.400e-01 3.500 11660.0 c3h6+c2h5=c3h5-a+c2h6 1.000e+11 0.000 09800.0 c3h6+ch3co3=c3h5-a+ch3co3h 3.240e+11 0.000 14900.0 c3h6+ch3o2=c3h5-a+ch3o2h 3.240e+11 0.000 14900.0 c3h6+ho2=c3h6o1-2+oh 1.290e+12 0.000 14900.0 c3h6+c2h5o2=c3h5-a+c2h5o2h 3.240e+11 0.000 14900.0 c3h6+nc3h7o2=c3h5-a+nc3h7o2h 3.240e+11 0.000 14900.0 c3h6+ic3h7o2=c3h5-a+ic3h7o2h 3.240e+11 0.000 14900.0 c3h6+oh=c3h6oh 9.930e+11 0.000 -00960.0 c3h6oh+o2=hoc3h6o2 1.200e+11 0.000 -01100.0 hoc3h6o2=ch3cho+ch2o+oh 1.250e+10 0.000 18900.0 rev/ 0.000e+00 0.000 00000.0 / c2h2+ch3=c3h5-a 2.610e+46 -9.820 36950.0 c3h4-a+h=c3h5-a 2.400e+11 0.690 03007.0 c3h5-a+ho2=c3h5o+oh 7.000e+12 0.000 -01000.0 c3h5-a+ch3o2=c3h5o+ch3o 7.000e+12 0.000 -01000.0 c3h5-a+h=c3h4-a+h2 1.810e+13 0.000 00000.0 c3h5-a+ch3=c3h4-a+ch4 1.000e+11 0.000 00000.0 c3h5-a+c2h5=c2h6+c3h4-a 4.000e+11 0.000 00000.0 c3h5-a+c2h5=c2h4+c3h6 4.000e+11 0.000 00000.0 c3h5-a+c2h3=c2h4+c3h4-a 1.000e+12 0.000 00000.0 c3h5-a+c3h5-a=c3h4-a+c3h6 1.000e+12 0.000 00000.0 c3h5-a+o2=c3h4-a+ho2 2.180e+21 -2.850 30760.0 c3h5-a+o2=ch2cho+ch2o 7.140e+15 -1.210 21050.0 c3h5-a+o2=c2h3cho+oh 2.470e+13 -0.440 23020.0 c3h5-a+o2=c2h2+ch2o+oh 9.720e+29 -5.710 21450.0 c2h2+ch3=c3h5-s 1.610e+40 -8.580 20330.0 c3h4-p+h=c3h5-s 5.800e+12 0.000 03100.0 c3h5-s+o2=ch3cho+hco 4.335e+12 0.000 00000.0 c3h5-s+h=c3h4-a+h2 3.333e+12 0.000 00000.0 c3h5-s+ch3=c3h4-a+ch4 1.000e+11 0.000 00000.0 c2h2+ch3=c3h5-t 1.610e+40 -8.580 20330.0 c3h4-a+h=c3h5-t 8.500e+12 0.000 02000.0 c3h4-p+h=c3h5-t 6.500e+12 0.000 02000.0 c3h5-t+o2=c3h4-a+ho2 1.890e+30 -5.590 15540.0 ch3coch2+o=c3h5-t+o2 2.000e+11 0.000 17500.0 c3h5-t+o2=ch2o+ch3co 3.710e+25 -3.960 07043.0 c3h5-t+h=c3h4-p+h2 3.333e+12 0.000 00000.0 c3h5-t+ch3=c3h4-p+ch4 1.000e+11 0.000 00000.0 c3h4-a+m=c3h3+h+m 1.143e+17 0.000 70000.0 c3h4-a=c3h4-p 1.202e+15 0.000 92400.0 c3h4-a+o2=c3h3+ho2 4.000e+13 0.000 39160.0 c3h4-a+ho2=ch2co+ch2+oh 4.000e+12 0.000 19000.0 rev/ 1.000e+00 0.000 00000.0 / c3h4-a+oh=ch2co+ch3 3.120e+12 0.000 -00397.0 c3h4-a+oh=c3h3+h2o 1.000e+07 2.000 01000.0 c3h4-a+o=c2h4+co 7.800e+12 0.000 01600.0 c3h4-a+o=c2h2+ch2o 3.000e-03 4.610 -04243.0 c3h4-a+h=c3h3+h2 2.000e+07 2.000 05000.0 c3h4-a+ch3=c3h3+ch4 3.670e-02 4.010 06830.0 c3h4-a+c3h5-a=c3h3+c3h6 2.000e+11 0.000 07700.0 c3h4-a+c2h=c3h3+c2h2 1.000e+13 0.000 00000.0 c3h4-p+m=c3h3+h+m 1.143e+17 0.000 70000.0 c3h4-p=c2h+ch3 4.200e+16 0.000 100000.0 c3h4-p+o2=hcco+oh+ch2 1.000e+07 1.500 30100.0 rev/ 1.000e+00 0.000 00000.0 / c3h4-p+o2=c3h3+ho2 2.000e+13 0.000 41600.0 c3h4-p+ho2=c2h4+co+oh 3.000e+12 0.000 19000.0 c3h4-p+oh=c3h3+h2o 1.000e+07 2.000 01000.0 c3h4-p+oh=ch2co+ch3 5.000e-04 4.500 -01000.0 c3h4-p+o=ch2co+ch2 3.200e-18 0.000 02010.0 c3h4-p+o=c2h3+hco 3.200e+12 0.000 02010.0 c3h4-p+o=c2h4+co 3.200e-18 0.000 02010.0 c3h4-p+o=hcco+ch3 9.600e+08 1.000 00000.0 c3h4-p+o=hcco+ch2+h 3.200e-19 0.000 02010.0 c3h4-p+o=c3h3+oh 7.650e+08 1.500 08600.0 c3h4-p+h=c3h3+h2 2.000e+07 2.000 05000.0 c3h4-p+ch3=c3h3+ch4 1.500e+00 3.500 05600.0 c3h4-p+c2h=c3h3+c2h2 1.000e+12 0.000 00000.0 c3h4-p+c2h3=c3h3+c2h4 1.000e+12 0.000 07700.0 c3h4-p+c3h5-a=c3h3+c3h6 1.000e+12 0.000 07700.0 c3h3+o=ch2o+c2h 1.000e+13 0.000 00000.0 c3h3+oh=c3h2+h2o 1.000e+13 0.000 00000.0 c3h3+o2=ch2co+hco 3.010e+10 0.000 02870.0 c2h5+c2h=c3h3+ch3 1.810e+13 0.000 00000.0 c3h2+o2=hco+hcco 5.000e+13 0.000 00000.0 c3h4-a+ho2=c2h4+co+oh 1.000e+12 0.000 14000.0 c3h4-a+ho2=c3h3+h2o2 3.000e+13 0.000 14000.0 c3h4-p+h=c2h2+ch3 1.000e+14 0.000 04000.0 c3h4-a+h=c2h2+ch3 4.400e+25 -3.340 22640.0 c3h3+h=c3h2+h2 5.000e+13 0.000 00000.0 c3h2+oh=c2h2+hco 5.000e+13 0.000 00000.0 c3h2+o2=hcco+co+h 5.000e+13 0.000 00000.0 rev/ 0.000e+00 0.000 00000.0 / ch3chco+oh=c2h5+co2 1.730e+12 0.000 -01010.0 ch3chco+oh=sc2h4oh+co 2.000e+12 0.000 -01010.0 ch3chco+h=c2h5+co 4.400e+12 0.000 01459.0 ch3chco+o=ch3cho+co 3.200e+12 0.000 -00437.0 nc3h7+ho2=nc3h7o+oh 7.000e+12 0.000 -01000.0 ic3h7+ho2=ic3h7o+oh 7.000e+12 0.000 -01000.0 ch3o2+nc3h7=ch3o+nc3h7o 7.000e+12 0.000 -01000.0 ch3o2+ic3h7=ch3o+ic3h7o 7.000e+12 0.000 -01000.0 nc3h7+o2=nc3h7o2 4.520e+12 0.000 00000.0 ic3h7+o2=ic3h7o2 7.540e+12 0.000 00000.0 nc3h7o2+ch2o=nc3h7o2h+hco 5.600e+12 0.000 13600.0 nc3h7o2+ch3cho=nc3h7o2h+ch3co 2.800e+12 0.000 13600.0 ic3h7o2+ch2o=ic3h7o2h+hco 5.600e+12 0.000 13600.0 ic3h7o2+ch3cho=ic3h7o2h+ch3co 2.800e+12 0.000 13600.0 nc3h7o2+ho2=nc3h7o2h+o2 1.750e+10 0.000 -03275.0 ic3h7o2+ho2=ic3h7o2h+o2 1.750e+10 0.000 -03275.0 c2h4+nc3h7o2=c2h3+nc3h7o2h 1.130e+13 0.000 30430.0 c2h4+ic3h7o2=c2h3+ic3h7o2h 1.130e+13 0.000 30430.0 ch3oh+nc3h7o2=ch2oh+nc3h7o2h 6.300e+12 0.000 19360.0 ch3oh+ic3h7o2=ch2oh+ic3h7o2h 6.300e+12 0.000 19360.0 c2h3cho+nc3h7o2=c2h3co+nc3h7o2h 2.800e+12 0.000 13600.0 c2h3cho+ic3h7o2=c2h3co+ic3h7o2h 2.800e+12 0.000 13600.0 ch4+nc3h7o2=ch3+nc3h7o2h 1.120e+13 0.000 24640.0 ch4+ic3h7o2=ch3+ic3h7o2h 1.120e+13 0.000 24640.0 nc3h7o2+ch3o2=nc3h7o+ch3o+o2 1.400e+16 -1.610 01860.0 rev/ 0.000e+00 0.000 00000.0 / ic3h7o2+ch3o2=ic3h7o+ch3o+o2 1.400e+16 -1.610 01860.0 rev/ 0.000e+00 0.000 00000.0 / h2+nc3h7o2=h+nc3h7o2h 3.010e+13 0.000 26030.0 h2+ic3h7o2=h+ic3h7o2h 3.010e+13 0.000 26030.0 ic3h7o2+c2h6=ic3h7o2h+c2h5 1.700e+13 0.000 20460.0 nc3h7o2+c2h6=nc3h7o2h+c2h5 1.700e+13 0.000 20460.0 ic3h7o2+c2h5cho=ic3h7o2h+c2h5co 2.000e+11 0.000 09500.0 nc3h7o2+c2h5cho=nc3h7o2h+c2h5co 2.000e+11 0.000 09500.0 ic3h7o2+ch3co3=ic3h7o+ch3co2+o2 1.400e+16 -1.610 01860.0 rev/ 0.000e+00 0.000 00000.0 / nc3h7o2+ch3co3=nc3h7o+ch3co2+o2 1.400e+16 -1.610 01860.0 rev/ 0.000e+00 0.000 00000.0 / ic3h7o2+c2h5o2=ic3h7o+c2h5o+o2 1.400e+16 -1.610 01860.0 rev/ 0.000e+00 0.000 00000.0 / nc3h7o2+c2h5o2=nc3h7o+c2h5o+o2 1.400e+16 -1.610 01860.0 rev/ 0.000e+00 0.000 00000.0 / ic3h7o2+ic3h7o2=o2+ic3h7o+ic3h7o 1.400e+16 -1.610 01860.0 rev/ 0.000e+00 0.000 00000.0 / nc3h7o2+nc3h7o2=o2+nc3h7o+nc3h7o 1.400e+16 -1.610 01860.0 rev/ 0.000e+00 0.000 00000.0 / ic3h7o2+nc3h7o2=ic3h7o+nc3h7o+o2 1.400e+16 -1.610 01860.0 rev/ 0.000e+00 0.000 00000.0 / ic3h7o2+ch3=ic3h7o+ch3o 7.000e+12 0.000 -01000.0 ic3h7o2+c2h5=ic3h7o+c2h5o 7.000e+12 0.000 -01000.0 ic3h7o2+ic3h7=ic3h7o+ic3h7o 7.000e+12 0.000 -01000.0 ic3h7o2+nc3h7=ic3h7o+nc3h7o 7.000e+12 0.000 -01000.0 ic3h7o2+c3h5-a=ic3h7o+c3h5o 7.000e+12 0.000 -01000.0 nc3h7o2+ch3=nc3h7o+ch3o 7.000e+12 0.000 -01000.0 nc3h7o2+c2h5=nc3h7o+c2h5o 7.000e+12 0.000 -01000.0 nc3h7o2+ic3h7=nc3h7o+ic3h7o 7.000e+12 0.000 -01000.0 nc3h7o2+nc3h7=nc3h7o+nc3h7o 7.000e+12 0.000 -01000.0 nc3h7o2+c3h5-a=nc3h7o+c3h5o 7.000e+12 0.000 -01000.0 nc3h7o2h=nc3h7o+oh 1.500e+16 0.000 42500.0 ic3h7o2h=ic3h7o+oh 9.450e+15 0.000 42600.0 c2h5+ch2o=nc3h7o 1.000e+11 0.000 03496.0 c2h5cho+h=nc3h7o 4.000e+12 0.000 06260.0 ch3+ch3cho=ic3h7o 1.000e+11 0.000 09256.0 ch3coch3+h=ic3h7o 2.000e+12 0.000 07270.0 ic3h7o+o2=ch3coch3+ho2 9.090e+09 0.000 00390.0 nc3h7o2=c3h6ooh1-2 6.000e+11 0.000 26850.0 nc3h7o2=c3h6ooh1-3 1.125e+11 0.000 24400.0 ic3h7o2=c3h6ooh2-1 1.800e+12 0.000 29400.0 ic3h7o2=c3h6ooh2-2 1.230e+35 -6.960 48880.0 c3h6ooh1-2=c3h6o1-2+oh 6.000e+11 0.000 22000.0 c3h6ooh1-3=c3h6o1-3+oh 7.500e+10 0.000 15250.0 c3h6ooh2-1=c3h6o1-2+oh 6.000e+11 0.000 22000.0 c3h6+ho2=c3h6ooh1-2 1.000e+11 0.000 10750.0 c3h6+ho2=c3h6ooh2-1 1.000e+11 0.000 11750.0 c3h6ooh1-3=oh+ch2o+c2h4 3.035e+15 -0.790 27400.0 rev/ 0.000e+00 0.000 00000.0 / c2h3ooh+ch3=c3h6ooh2-1 4.460e+22 -4.240 10630.0 c3h6ooh1-2=c2h4+ch2o+oh 1.310e+33 -7.010 48120.0 rev/ 0.000e+00 0.000 00000.0 / c3h6ooh2-2=ch3coch3+oh 9.000e+14 0.000 01500.0 c3h6ooh1-2+o2=c3h6ooh1-2o2 5.000e+12 0.000 00000.0 c3h6ooh1-3+o2=c3h6ooh1-3o2 4.520e+12 0.000 00000.0 c3h6ooh2-1+o2=c3h6ooh2-1o2 4.520e+12 0.000 00000.0 c3h6ooh1-2o2=c3ket12+oh 6.000e+11 0.000 26400.0 c3h6ooh1-3o2=c3ket13+oh 7.500e+10 0.000 21400.0 c3h6ooh2-1o2=c3ket21+oh 3.000e+11 0.000 23850.0 c3h6ooh2-1o2=c3h51-2,3ooh 1.125e+11 0.000 24400.0 c3h6ooh1-2o2=c3h51-2,3ooh 9.000e+11 0.000 29400.0 c3h51-2,3ooh=ac3h5ooh+ho2 2.560e+13 -0.490 17770.0 !c3h6ooh1-3o2 =c3h52-1,3ooh 6.000e+11 0.000 26850.0 !c3h52-1,3ooh=ac3h5ooh+ho2 1.150e+14 -0.630 17250.0 c3ket12=ch3cho+hco+oh 9.450e+15 0.000 43000.0 rev/ 0.000e+00 0.000 00000.0 / c3ket13=ch2o+ch2cho+oh 1.000e+16 0.000 43000.0 rev/ 0.000e+00 0.000 00000.0 / c3ket21=ch2o+ch3co+oh 1.000e+16 0.000 43000.0 rev/ 0.000e+00 0.000 00000.0 / c3h5o+oh=ac3h5ooh 2.000e+13 0.000 00000.0 c3h5o=c2h3cho+h 1.000e+14 0.000 29100.0 c2h3+ch2o=c3h5o 1.500e+11 0.000 10600.0 c3h5o+o2=c2h3cho+ho2 1.000e+12 0.000 06000.0 c2h3ooh=ch2cho+oh 8.400e+14 0.000 43000.0 c3h6o1-2=c2h4+ch2o 6.000e+14 0.000 60000.0 c3h6o1-2+oh=ch2o+c2h3+h2o 5.000e+12 0.000 00000.0 rev/ 0.000e+00 0.000 00000.0 / c3h6o1-2+h=ch2o+c2h3+h2 2.630e+07 2.000 05000.0 rev/ 0.000e+00 0.000 00000.0 / c3h6o1-2+o=ch2o+c2h3+oh 8.430e+13 0.000 05200.0 rev/ 0.000e+00 0.000 00000.0 / c3h6o1-2+ho2=ch2o+c2h3+h2o2 1.000e+13 0.000 15000.0 rev/ 0.000e+00 0.000 00000.0 / c3h6o1-2+ch3o2=ch2o+c2h3+ch3o2h 1.000e+13 0.000 19000.0 rev/ 0.000e+00 0.000 00000.0 / c3h6o1-2+ch3=ch2o+c2h3+ch4 2.000e+11 0.000 10000.0 rev/ 0.000e+00 0.000 00000.0 / c3h6o1-3=c2h4+ch2o 6.000e+14 0.000 60000.0 c3h6o1-3+oh=ch2o+c2h3+h2o 5.000e+12 0.000 00000.0 rev/ 0.000e+00 0.000 00000.0 / c3h6o1-3+o=ch2o+c2h3+oh 8.430e+13 0.000 05200.0 rev/ 0.000e+00 0.000 00000.0 / c3h6o1-3+h=ch2o+c2h3+h2 2.630e+07 2.000 05000.0 rev/ 0.000e+00 0.000 00000.0 / c3h6o1-3+ch3o2=ch2o+c2h3+ch3o2h 1.000e+13 0.000 19000.0 rev/ 0.000e+00 0.000 00000.0 / c3h6o1-3+ho2=ch2o+c2h3+h2o2 1.000e+13 0.000 15000.0 rev/ 0.000e+00 0.000 00000.0 / c3h6o1-3+ch3=ch2o+c2h3+ch4 2.000e+11 0.000 10000.0 rev/ 0.000e+00 0.000 00000.0 / ic3h7o2=c3h6+ho2 4.680e+09 1.160 30870.0 nc3h7o2=c3h6+ho2 3.780e+07 1.510 29640.0 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !! C4/Reactions of C4 species !! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! !C4-1/Unimolecular Initiations ! ! !C4-2/H-atom abstractions ! ! !C4-3/Decompositions c2h4+c2h5=pc4h9 1.320e+04 2.480 06130.0 !C4-3 c4h8-1+h=pc4h9 2.500e+11 0.510 02620.0 !C4-3 c3h6+ch3=sc4h9 1.760e+04 2.480 06130.0 !C4-3 c4h8-1+h=sc4h9 4.240e+11 0.510 01230.0 !C4-3 c4h8-2+h=sc4h9 2.500e+11 0.510 02620.0 !C4-3 ! ! !C4-4/High temperature direct abstraction (not in the Huge Mechanism) pc4h9+o2=c4h8-1+ho2 1.600e+12 0.000 05000.0 !C4-4 Nancy, Exgas ! ! !C4-5/Isomerizations pc4h9=sc4h9 3.560e+10 0.880 37300.0 !C4-5 matheu, 2003 1,2 h-shift p->s duplicate pc4h9=sc4h9 3.800e+10 0.670 36600.0 !C4-5 matheu, 2003 1,3 h-shift p->s duplicate ! ! !C4-6/H-atom abstraction from olefins c4h8-1+h=c4h7-11+h2 8.040e+05 2.500 12280.0 !C4-6 c4h8-1+h=c4h7-12+h2 4.050e+05 2.500 09794.0 !C4-6 c4h8-1+h=c4h7-13+h2 3.376e+05 2.360 00207.0 !C4-6 c4h8-1+h=c4h7-14+h2 9.400e+04 2.750 06280.0 !C4-6 ! c4h8-1+ho2=c4h7-11+h2o2 7.500e+09 0.000 12570.0 !C4-6 c4h8-1+ho2=c4h7-12+h2o2 3.000e+09 0.000 09930.0 !C4-6 c4h8-1+ho2=c4h7-13+h2o2 4.820e+03 2.550 10530.0 !C4-6 c4h8-1+ho2=c4h7-14+h2o2 4.050e+04 2.500 16690.0 !C4-6 ! c4h8-1+oh=c4h7-11+h2o 2.110e+06 2.000 02778.0 !C4-6 c4h8-1+oh=c4h7-12+h2o 1.110e+06 2.000 01451.0 !C4-6 c4h8-1+oh=c4h7-13+h2o 2.764e+04 2.640 -01919.0 !C4-6 c4h8-1+oh=c4h7-14+h2o 5.270e+09 0.970 01590.0 !C4-6 ! c4h8-1+o2=c4h7-11+ho2 2.000e+12 0.000 62900.0 !C4-6 c4h8-1+o2=c4h7-12+ho2 1.400E+12 0.000 60700.0 !C4-6 c4h8-1+o2=c4h7-13+ho2 2.200e+12 0.000 37220.0 !C4-6 c4h8-1+o2=c4h7-14+ho2 6.000e+13 0.000 52800.0 !C4-6 ! c4h8-1+o=c4h7-11+oh 1.200E+11 0.700 08959.0 !C4-6 c4h8-1+o=c4h7-12+oh 6.030E+10 0.700 07632.0 !C4-6 c4h8-1+o=c4h7-13+oh 6.600e+05 2.430 01210.0 !C4-6 c4h8-1+o=c4h7-14+oh 1.046e+06 2.420 04766.0 !C4-6 ! c4h8-1+ch3=c4h7-11+ch4 1.348E+00 3.500 12850.0 !C4-6 c4h8-1+ch3=c4h7-12+ch4 8.400E-01 3.500 11660.0 !C4-6 c4h8-1+ch3=c4h7-13+ch4 3.690e+00 3.310 04002.0 !C4-6 c4h8-1+ch3=c4h7-14+ch4 4.520e-01 3.650 07154.0 !C4-6 ! !c4h8-1+ch3o=c4h7-11+ch3oh !c4h8-1+ch3o=c4h7-12+ch3oh c4h8-1+ch3o=c4h7-13+ch3oh 4.000e+01 2.900 08609.0 !C4-6 c4h8-1+ch3o=c4h7-14+ch3oh 1.500e+10 0.000 07000.0 !C4-6 ! c4h8-1+ch3o2=c4h7-11+ch3o2h 7.500e+09 0.000 12570.0 !C4-6 c4h8-1+ch3o2=c4h7-12+ch3o2h 3.000e+09 0.000 09930.0 !C4-6 c4h8-1+ch3o2=c4h7-13+ch3o2h 4.820e+03 2.550 10530.0 !C4-6 c4h8-1+ch3o2=c4h7-14+ch3o2h 4.050e+04 2.500 16690.0 !C4-6 ! c4h8-1+c2h3=c4h7-11+c2h4 1.387e+00 3.500 10870.0 !C4-6 c4h8-1+c2h3=c4h7-12+c2h4 8.401e-01 3.500 09680.0 !C4-6 c4h8-1+c2h3=c4h7-13+c2h4 2.211E+00 3.500 04690.0 !C4-6 c4h8-1+c2h3=c4h7-14+c2h4 5.000e+11 0.000 18000.0 !C4-6 ! !c4h8-1+c2h5=c4h7-11+c2h6 !c4h8-1+c2h5=c4h7-12+c2h6 c4h8-1+c2h5=c4h7-13+c2h6 1.000e+11 0.000 09800.0 !C4-6 c4h8-1+c2h5=c4h7-14+c2h6 5.000e+10 0.000 13400.0 !C4-6 ! ! !C4-7/Additions c4h8-1+oh=c4h8oh2j1 1.129e+05 2.280 -1241.0 !C4-7 Zhu et al., 2005 c2h4+oh A/2 c4h8-1+oh=c4h8oh1j2 1.129e+05 2.280 -1241.0 !C4-7 Zhu et al., 2005 c2h4+oh A/2 ! c4h8-1+oh=c4h7oh2d1+h 3.041e+07 1.380 01615.0 !C4-3 Zhu et al., 2005 c2h4+oh A/2 c4h8-1+oh=c4h7oh1d1+h 3.041e+07 1.380 01615.0 !C4-3 Zhu et al., 2005 c2h4+oh A/2 ! c3h7cho+h=pc4h9o 4.000e+12 0.000 06260.0 !C4-3 Curran, 2006 ch3cho+h ch3+c3h5oh1d2=c4h8oh1j2 1.760e+04 2.480 06130.0 !C4-3 Curran, 2006 ch3+c3h6=sc4h9 ch3+c2h5cho=sc4h9o 5.000e+10 0.000 09043.0 !C4-3 Curran, 2006 c2h5+ch3cho=sc4h9o 3.330e+10 0.000 06397.0 !C4-3 Curran, 2006 c2h5coch3+h=sc4h9o 2.000e+12 0.000 07270.0 !C4-3 Curran, 2006 ch3coch3+h c2h5+c2h3oh=c4h8oh2j1 1.890e+03 2.670 06850.0 !C4-3 Curran, 2006 c3h6+ch3=ic4h9 ! c4h8oh1j2=pc4h9o 3.695e+14 0.000 42070.0 !C4-5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 c4h8oh2j1=sc4h9o 3.695e+14 0.000 42070.0 !C4-5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 ! ! !C4-8/Decomposiitons and isomerizations c2h2+c2h5=c4h7-11 8.800e+03 2.480 06130.0 !C4-8 h+c4h6-1=c4h7-11 2.500e+11 0.510 02620.0 !C4-8 c3h4-a+ch3=c4h7-12 8.800e+03 2.480 06130.0 !C4-8 h+c4h6-12=c4h7-12 2.500e+11 0.510 02620.0 !C4-8 h+c4h6-1=c4h7-12 2.500e+11 0.510 02620.0 !C4-8 h+c4h6=c4h7-13 4.240e+11 0.510 01230.0 !C4-8 h+c4h6=c4h7-14 2.500e+11 0.510 02620.0 !C4-8 c2h3+c2h4=c4h7-14 2.000E+11 0.000 02007.0 !C4-8 Weissman et Benson, 1984 ! !Isomerizations c4h7-14=c4h7-13 3.560e+10 0.880 31500.0 !C4-8 Matheu et al., 2003 1,2 h-shift s->a ! ! !C4-9/Unimolecular Initiations and Molecular Decompositions c3h5-a+ch3=c4h8-1 1.350e+13 0.000 00000.0 !C4-9 c4h7-13+h=c4h8-1 1.000E+14 0.000 00000.0 !C4-9 ! ! !C4-10/First Addition to o2 pc4h9+o2=pc4h9o2 4.520e+12 0.000 00000.0 !C4-10 sc4h9+o2=sc4h9o2 7.540e+12 0.000 00000.0 !C4-10 ! ! !C4-11/R+R'O2=RO+R'O ! ! !C4-11b/RO2+H=ROOH ! ! !C4-12-I/Isomerization to QOOH pc4h9o2=c4h8ooh1-2 2.000e+11 0.000 26850.0 !12-I 5s pc4h9o2=c4h8ooh1-3 2.500e+10 0.000 20850.0 !12-I 6s pc4h9o2=c4h8ooh1-4 4.688e+09 0.000 22350.0 !12-I 7p sc4h9o2=c4h8ooh2-1 3.000e+11 0.000 29400.0 !12-I 5p sc4h9o2=c4h8ooh2-3 2.000e+11 0.000 26850.0 !12-I 5s sc4h9o2=c4h8ooh2-4 3.750e+10 0.000 24400.0 !12-I 6p ! ! !C4-12-II/RO2=olefin+HO2 pc4h9o2=c4h8-1+ho2 3.780e+07 1.510 29640.0 !12-II sc4h9o2=c4h8-1+ho2 4.680e+09 1.160 30870.0 !12-II sc4h9o2=c4h8-2+ho2 3.780e+07 1.510 29640.0 !12-II ! ! !C4-12-III/RO2=aldehyde+OH pc4h9o2=c3h7cho+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 sc4h9o2=c2h5coch3+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ! ! !C4-13/RO2+HO2=ROOH+O2 pc4h9o2+ho2=pc4h9ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 sc4h9o2+ho2=sc4h9ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 ! ! !C4-14/RO2+H2O2=ROOH+HO2 pc4h9o2+h2o2=pc4h9ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 sc4h9o2+h2o2=sc4h9ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 ! ! !C4-15/RO2+CH3O2=RO+CH3O+O2 pc4h9o2+ch3o2=pc4h9o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 sc4h9o2+ch3o2=sc4h9o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 ! ! !C4-16/RO2+R'O2=RO+R'O+O2 ! ! !C4-17/ROOH=RO+OH pc4h9ooh=oh+pc4h9o 1.810E+13 0.000 42330.0 !17 Lightfoot et al., 1991 sc4h9ooh=oh+sc4h9o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 ! ! !C4-18/RO decomposition ! ! !C4-19/Decomposiiton to Cyclic Ethers c4h8ooh1-2=c4h8o1-2+oh 6.000e+11 0.000 22000.0 !19 oxirane c4h8ooh1-3=c4h8o1-3+oh 7.500e+10 0.000 15250.0 !19 oxetane c4h8ooh1-4=c4h8o1-4+oh 9.375e+09 0.000 07000.0 !19 oxalane c4h8ooh2-1=c4h8o1-2+oh 6.000e+11 0.000 22000.0 !19 oxirane c4h8ooh2-3=c4h8o2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane c4h8ooh2-4=c4h8o1-3+oh 7.500e+10 0.000 15250.0 !19 oxetane ! ! !C4-20-I/qooh = olefin + ho2 c4h8-1+ho2=c4h8ooh1-2 1.000e+11 0.000 10750.0 !20-I c4h8-1+ho2=c4h8ooh2-1 1.000e+11 0.000 11750.0 !20-I c4h8-2+ho2=c4h8ooh2-3 1.000e+11 0.000 11750.0 !20-I ! ! !C4-21/qooh=olefin+carbonyl+oh c4h8ooh1-3=c3h6+ch2o+oh 6.637e+13 -0.160 29900.0 !21 rev/ 0.000e+00 0.000 00000.0 / c4h8ooh2-4=c2h4+ch3cho+oh 1.945e+18 -1.630 26790.0 !21 rev/ 0.000e+00 0.000 00000.0 / ! ! !C4-22-QOOH+O2=OOQOOH ! ! !C4-23/OOQOOH isomerization to ketohydroperoxyde + oh ! ! !C4-23a/OOQOOH to alkeneooh + ho2 ! ! !C4-23b/OOQOOH to HOOQOOH !except when HOOQOOH leads to a keto compounds + oh (see reaction type 23) ! ! !C4-23c/HOOQOOH to olefinHP + ho2 ! ! !C4-23d/HOOQOOH to HP cyclic ether + OH ! ! !C4-24/hydroperoxyketone decomposition ! ! !C4-24b/Decomposition of the radicals from reaction type 24 ! ! !C4-25/Decomposition of cyclic ethers ! ! !C4-25b/decomposition of radicals from reaction type 25 ! ! !C4-26/mdxdyooh decomposition to mdxdyo + OH ! ! !C4-26b/Decomposition of the radicals from reaction type 26 ! ! !C4-27/hydroperoxy cyclic ether to alkoxy cyclic ether ! ! !C4-27b/decomposition reactions of radicals from reaction type 27 ! ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !! C5/Reactions of C5 species !! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! !C5-1/Unimolecular Initiations ! ! !C5-2/H-atom abstractions ! ! !C5-3/Decompositions nc3h7+c2h4=c5h11-1 8.800e+03 2.480 06130.0 !C5-3 c5h10-1+h=c5h11-1 2.500e+11 0.510 02620.0 !C5-3 c2h5+c3h6=c5h11-2 8.800e+03 2.480 06130.0 !C5-3 c5h10-1+h=c5h11-2 4.240e+11 0.510 01230.0 !C5-3 c5h10-2+h=c5h11-2 2.500e+11 0.510 02620.0 !C5-3 c4h8-1+ch3=c5h11-3 1.760e+04 2.480 06130.0 !C5-3 c5h10-2+h=c5h11-3 5.000e+11 0.510 02620.0 !C5-3 ! ! !C5-4/High temperature direct abstraction (not in the Huge Mechanism) c5h11-1+o2=c5h10-1+ho2 1.600e+12 0.000 05000.0 !C5-4 Nancy, Exgas ! ! !C5-5/Isomerizations c5h11-1=c5h11-2 3.560e+10 0.880 37300.0 !C5-5 matheu, 2003 1,2 h-shift p->s duplicate c5h11-1=c5h11-3 3.800e+10 0.670 36600.0 !C5-5 matheu, 2003 1,3 h-shift p->s c5h11-1=c5h11-2 7.850e+11 -0.120 20600.0 !C5-5 matheu, 2003 1,4 h-shift p->s duplicate c5h11-2=c5h11-3 3.560e+10 0.880 39100.0 !C5-5 matheu, 2003 1,2 h-shift s->s ! ! !C5-6/H-atom abstraction from olefins c5h10-1+h=c5h9-11+h2 8.040e+05 2.500 12280.0 !C5-6 c5h10-1+h=c5h9-12+h2 4.050e+05 2.500 09794.0 !C5-6 c5h10-1+h=c5h9-13+h2 3.376e+05 2.360 00207.0 !C5-6 c5h10-1+h=c5h9-14+h2 1.300e+06 2.400 04471.0 !C5-6 c5h10-1+h=c5h9-15+h2 9.400e+04 2.750 06280.0 !C5-6 ! c5h10-1+ho2=c5h9-11+h2o2 7.500e+09 0.000 12570.0 !C5-6 c5h10-1+ho2=c5h9-12+h2o2 3.000e+09 0.000 09930.0 !C5-6 c5h10-1+ho2=c5h9-13+h2o2 4.820e+03 2.550 10530.0 !C5-6 c5h10-1+ho2=c5h9-14+h2o2 5.880e+04 2.500 14860.0 !C5-6 c5h10-1+ho2=c5h9-15+h2o2 4.050e+04 2.500 16690.0 !C5-6 ! c5h10-1+oh=c5h9-11+h2o 2.110e+06 2.000 02778.0 !C5-6 c5h10-1+oh=c5h9-12+h2o 1.110e+06 2.000 01451.0 !C5-6 c5h10-1+oh=c5h9-13+h2o 2.764e+04 2.640 -01919.0 !C5-6 c5h10-1+oh=c5h9-14+h2o 4.670e+07 1.610 -00035.0 !C5-6 c5h10-1+oh=c5h9-15+h2o 5.270e+09 0.970 01590.0 !C5-6 ! c5h10-1+o2=c5h9-11+ho2 2.000e+12 0.000 62900.0 !C5-6 c5h10-1+o2=c5h9-12+ho2 1.400E+12 0.000 60700.0 !C5-6 c5h10-1+o2=c5h9-13+ho2 2.200e+12 0.000 37220.0 !C5-6 c5h10-1+o2=c5h9-14+ho2 4.000e+13 0.000 50160.0 !C5-6 c5h10-1+o2=c5h9-15+ho2 6.000e+13 0.000 52800.0 !C5-6 ! c5h10-1+o=c5h9-11+oh 1.200E+11 0.700 08959.0 !C5-6 c5h10-1+o=c5h9-12+oh 6.030E+10 0.700 07632.0 !C5-6 c5h10-1+o=c5h9-13+oh 6.600e+05 2.430 01210.0 !C5-6 c5h10-1+o=c5h9-14+oh 5.946e+05 2.440 02846.0 !C5-6 c5h10-1+o=c5h9-15+oh 1.046e+06 2.420 04766.0 !C5-6 ! !c5h10-1+ch3=c5h9-11+ch4 1.348E+00 3.500 12850.0 !C5-6 !c5h10-1+ch3=c5h9-12+ch4 8.400E-01 3.500 11660.0 !C5-6 c5h10-1+ch3=c5h9-13+ch4 3.690e+00 3.310 04002.0 !C5-6 c5h10-1+ch3=c5h9-14+ch4 8.400e+04 2.130 07574.0 !C5-6 c5h10-1+ch3=c5h9-15+ch4 4.520e-01 3.650 07154.0 !C5-6 ! !c5h10-1+ch3o=c5h9-11+ch3oh !c5h10-1+ch3o=c5h9-12+ch3oh c5h10-1+ch3o=c5h9-13+ch3oh 4.000e+01 2.900 08609.0 !C5-6 c5h10-1+ch3o=c5h9-14+ch3oh 1.100e+11 0.000 05000.0 !C5-6 c5h10-1+ch3o=c5h9-15+ch3oh 1.500e+10 0.000 07000.0 !C5-6 ! c5h10-1+ch3o2=c5h9-11+ch3o2h 7.500e+09 0.000 12570.0 !C5-6 c5h10-1+ch3o2=c5h9-12+ch3o2h 3.000e+09 0.000 09930.0 !C5-6 c5h10-1+ch3o2=c5h9-13+ch3o2h 4.820e+03 2.550 10530.0 !C5-6 c5h10-1+ch3o2=c5h9-14+ch3o2h 5.880e+04 2.500 14860.0 !C5-6 c5h10-1+ch3o2=c5h9-15+ch3o2h 4.050e+04 2.500 16690.0 !C5-6 ! c5h10-1+c2h3=c5h9-11+c2h4 1.387e+00 3.500 10870.0 !C5-6 c5h10-1+c2h3=c5h9-12+c2h4 8.401e-01 3.500 09680.0 !C5-6 c5h10-1+c2h3=c5h9-13+c2h4 2.211E+00 3.500 04690.0 !C5-6 c5h10-1+c2h3=c5h9-14+c2h4 4.000e+11 0.000 16800.0 !C5-6 c5h10-1+c2h3=c5h9-15+c2h4 5.000e+11 0.000 18000.0 !C5-6 ! !c5h10-1+c2h5=c5h9-11+c2h6 !c5h10-1+c2h5=c5h9-12+c2h6 c5h10-1+c2h5=c5h9-13+c2h6 1.000e+11 0.000 09800.0 !C5-6 c5h10-1+c2h5=c5h9-14+c2h6 5.000e+10 0.000 10400.0 !C5-6 c5h10-1+c2h5=c5h9-15+c2h6 5.000e+10 0.000 13400.0 !C5-6 ! ! !C5-7/Additions c5h10-1+oh=c5h10oh2j1 1.129e+05 2.280 -1241.0 !C5-7 Zhu et al., 2005 c2h4+oh A/2 c5h10-1+oh=c5h10oh1j2 1.129e+05 2.280 -1241.0 !C5-7 Zhu et al., 2005 c2h4+oh A/2 ! c5h10-1+oh=c5h9oh2d1+h 3.041e+07 1.380 01615.0 !C5-3 Zhu et al., 2005 c2h4+oh A/2 c5h10-1+oh=c5h9oh1d1+h 3.041e+07 1.380 01615.0 !C5-3 Zhu et al., 2005 c2h4+oh A/2 ! pc4h9+ch2o=c5h11o-1 5.000e+10 0.000 03457.0 !C5-3 Curran, 2006 nc3h7+ch2o c4h9cho+h=c5h11o-1 4.000e+12 0.000 06260.0 !C5-3 Curran, 2006 ch3cho+h c2h5+c3h5oh1d2=c5h10oh1j2 8.800e+03 2.480 06130.0 !C5-3 Curran, 2006 c3h6+c2h5=c5h11-2 ch3+c3h7cho=c5h11o-2 5.000e+10 0.000 09043.0 !C5-3 Curran, 2006 c2h5cho+ch3 nc3h7+ch3cho=c5h11o-2 3.330e+10 0.000 06397.0 !C5-3 Curran, 2006 c2h5+ch3cho c3h7coch3+h=c5h11o-2 2.000e+12 0.000 07270.0 !C5-3 Curran, 2006 ch3coch3+h nc3h7+c2h3oh=c5h10oh2j1 1.890e+03 2.670 06850.0 !C5-3 Curran, 2006 c3h6+ch3=ic4h9 ! c5h10oh1j2=c5h11o-1 3.695e+14 0.000 42070.0 !C5-5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 c5h10oh2j1=c5h11o-2 3.695e+14 0.000 42070.0 !C5-5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 ! ! !C5-8/Decomposiitons and isomerizations c2h2+nc3h7=c5h9-11 8.800e+03 2.480 06130.0 !C5-8 h+c5h8-1=c5h9-11 2.500e+11 0.510 02620.0 !C5-8 c3h4-a+c2h5=c5h9-12 8.800e+03 2.480 06130.0 !C5-8 h+c5h8-1=c5h9-12 2.500e+11 0.510 02620.0 !C5-8 h+c5h8-12=c5h9-12 2.500e+11 0.510 02620.0 !C5-8 h+c5h8-13=c5h9-13 2.500e+11 0.510 02620.0 !C5-8 ch3+c4h6=c5h9-13 3.580e+04 2.480 06130.0 !C5-8 A*2 h+c5h8-13=c5h9-14 2.500e+11 0.510 02620.0 !C5-8 h+c5h8-14=c5h9-14 4.240e+11 0.510 01230.0 !C5-8 c2h3+c3h6=c5h9-14 2.000E+11 0.000 02007.0 !C5-8 Weissman et Benson, 1984 h+c5h8-14=c5h9-15 5.000e+11 0.510 02620.0 !C5-8 A*2 c5h9-15=c2h4+c3h5-a 3.310e+13 0.000 21460.0 !C5-8 gierczak et al., 1986 ! !Isomerizations c5h9-14=c5h9-13 3.560e+10 0.880 31500.0 !C5-8 Matheu et al., 2003 1,2 h-shift s->a c5h9-15=c5h9-13 3.800e+10 0.670 30600.0 !C5-8 1,3 h-shift s->a correlation from 1,2 h-shift s->s & s->a c5h9-15=c5h9-14 3.560e+10 0.880 37300.0 !C5-8 Matheu et al., 2003 1,2 h-shift p->s ! ! !C5-9/Unimolecular Initiations and Molecular Decompositions !Unimoleular decomposition c3h5-a+c2h5=c5h10-1 2.500E+16 0.000 71000.0 !C5-9 Edelson et Allara, 1980 c5h9-13+h=c5h10-1 1.000E+14 0.000 00000.0 !C5-9 ! !Retroene c5h10-1=c3h6+c2h4 3.980e+12 0.000 57630.0 !C5-9 King, 1979 ! ! !C5-10/First Addition to o2 c5h11-1+o2=c5h11o2-1 4.520e+12 0.000 00000.0 !C5-10 c5h11-2+o2=c5h11o2-2 7.540e+12 0.000 00000.0 !C5-10 c5h11-3+o2=c5h11o2-3 7.540e+12 0.000 00000.0 !C5-10 ! ! !C5-11/R+R'O2=RO+R'O ! ! !C5-11b/RO2+H=ROOH ! ! !C5-12-I/Isomerization to QOOH c5h11o2-1=c5h10ooh1-2 2.000e+11 0.000 26850.0 !C5-12-I 5s c5h11o2-1=c5h10ooh1-3 2.500e+10 0.000 20850.0 !C5-12-I 6s c5h11o2-1=c5h10ooh1-4 3.125e+09 0.000 19050.0 !C5-12-I 7s c5h11o2-1=c5h10ooh1-5 5.860e+08 0.000 25550.0 !C5-12-I 8p c5h11o2-2=c5h10ooh2-1 3.000e+11 0.000 29400.0 !C5-12-I 5p c5h11o2-2=c5h10ooh2-3 2.000e+11 0.000 26850.0 !C5-12-I 5s c5h11o2-2=c5h10ooh2-4 2.500e+10 0.000 20850.0 !C5-12-I 6s c5h11o2-2=c5h10ooh2-5 4.688e+09 0.000 22350.0 !C5-12-I 7p c5h11o2-3=c5h10ooh3-1 7.500e+10 0.000 24400.0 !C5-12-I 6p c5h11o2-3=c5h10ooh3-2 4.000e+11 0.000 26850.0 !C5-12-I 5s ! ! !C5-12-II/RO2=olefin+HO2 c5h11o2-1=c5h10-1+ho2 3.780e+07 1.510 29640.0 !C5-12-II c5h11o2-2=c5h10-1+ho2 4.680e+09 1.160 30870.0 !C5-12-II c5h11o2-2=c5h10-2+ho2 3.780e+07 1.510 29640.0 !C5-12-II c5h11o2-3=c5h10-2+ho2 7.560e+07 1.510 29640.0 !C5-12-II ! ! !C5-12-III/RO2=aldehyde+OH c5h11o2-1=c4h9cho+oh 1.320e+09 1.370 41590.0 !C5-12-III Sheng et al., 2002 c5h11o2-2=c3h7coch3+oh 1.320e+09 1.370 41590.0 !C5-12-III Sheng et al., 2002 c5h11o2-3=c2h5coc2h5+oh 1.320e+09 1.370 41590.0 !C5-12-III Sheng et al., 2002 ! ! !C5-13/RO2+HO2=ROOH+O2 c5h11o2-1+ho2=c5h11ooh-1+o2 1.750E+11 0.000 01710.0 !C5-13 Lightfoot et al., 1991 c5h11o2-2+ho2=c5h11ooh-2+o2 1.750E+11 0.000 01710.0 !C5-13 Lightfoot et al., 1991 c5h11o2-3+ho2=c5h11ooh-3+o2 1.750E+11 0.000 01710.0 !C5-13 Lightfoot et al., 1991 ! ! !C5-14/RO2+H2O2=ROOH+HO2 c5h11o2-1+h2o2=c5h11ooh-1+ho2 2.410E+12 0.000 09940.0 !C5-14 Tsang and Hampson, 1986 c5h11o2-2+h2o2=c5h11ooh-2+ho2 2.410E+12 0.000 09940.0 !C5-14 Tsang and Hampson, 1986 c5h11o2-3+h2o2=c5h11ooh-3+ho2 2.410E+12 0.000 09940.0 !C5-14 Tsang and Hampson, 1986 ! ! !C5-15/RO2+CH3O2=RO+CH3O+O2 c5h11o2-1+ch3o2=c5h11o-1+ch3o+o2 1.400E+16 -1.610 01860.0 !C5-15 c5h11o2-2+ch3o2=c5h11o-2+ch3o+o2 1.400E+16 -1.610 01860.0 !C5-15 c5h11o2-3+ch3o2=c5h11o-3+ch3o+o2 1.400E+16 -1.610 01860.0 !C5-15 ! ! !C5-16/RO2+R'O2=RO+R'O+O2 ! ! !C5-17/ROOH=RO+OH c5h11ooh-1=oh+c5h11o-1 6.310E+14 0.000 42330.0 !C5-17 Lightfoot et al., 1991 c5h11ooh-2=oh+c5h11o-2 6.310E+14 0.000 42330.0 !C5-17 Lightfoot et al., 1991 c5h11ooh-3=oh+c5h11o-3 6.310E+14 0.000 42330.0 !C5-17 Lightfoot et al., 1991 ! ! !C5-18/RO decomposition c2h5+c2h5cho=c5h11o-3 6.660E+10 0.000 06397.0 !C5-18 Curran, 2006 c2h5+ch3cho h+c2h5coc2h5=c5h11o-3 2.000E+12 0.000 07270.0 !C5-18 Curran, 2006 ch3coch3+h ! ! !C5-19/Decomposiiton to Cyclic Ethers c5h10ooh1-2=c5h10o1-2+oh 6.000e+11 0.000 22000.0 !C5-19 oxirane c5h10ooh1-3=c5h10o1-3+oh 7.500e+10 0.000 15250.0 !C5-19 oxetane c5h10ooh1-4=c5h10o1-4+oh 9.375e+09 0.000 07000.0 !C5-19 oxalane c5h10ooh1-5=c5h10o1-5+oh 1.172e+09 0.000 01800.0 !C5-19 oxane c5h10ooh2-1=c5h10o1-2+oh 6.000e+11 0.000 22000.0 !C5-19 oxirane c5h10ooh2-3=c5h10o2-3+oh 6.000e+11 0.000 22000.0 !C5-19 oxirane c5h10ooh2-4=c5h10o2-4+oh 7.500e+10 0.000 15250.0 !C5-19 oxetane c5h10ooh2-5=c5h10o1-4+oh 9.375e+09 0.000 07000.0 !C5-19 oxalane c5h10ooh3-1=c5h10o1-3+oh 7.500e+10 0.000 15250.0 !C5-19 oxetane c5h10ooh3-2=c5h10o2-3+oh 6.000e+11 0.000 22000.0 !C5-19 oxirane ! ! !C5-20-I/qooh = olefin + ho2 c5h10-1+ho2=c5h10ooh1-2 1.000e+11 0.000 10750.0 !C5-20-I c5h10-1+ho2=c5h10ooh2-1 1.000e+11 0.000 11750.0 !C5-20-I c5h10-2+ho2=c5h10ooh2-3 1.000e+11 0.000 11750.0 !C5-20-I c5h10-2+ho2=c5h10ooh3-2 2.000e+11 0.000 11750.0 !C5-20-I ! ! !C5-21/qooh=olefin+carbonyl+oh c5h10ooh1-3=c4h8-1+ch2o+oh 8.283e+13 -0.170 30090.0 !C5-21 rev/ 0.000e+00 0.000 00000.0 / c5h10ooh2-4=c3h6+ch3cho+oh 8.312e+17 -1.400 27170.0 !C5-21 rev/ 0.000e+00 0.000 00000.0 / c5h10ooh3-1=c2h4+c2h5cho+oh 3.096e+18 -1.730 26820.0 !C5-21 rev/ 0.000e+00 0.000 00000.0 / ! ! !C5-22-QOOH+O2=OOQOOH ! ! !C5-23/OOQOOH isomerization to ketohydroperoxyde + oh ! ! !C5-23a/OOQOOH to alkeneooh + ho2 ! ! !C5-23b/OOQOOH to HOOQOOH !except when HOOQOOH leads to a keto compounds + oh (see reaction type 23) ! ! !C5-23c/HOOQOOH to olefinHP + ho2 ! ! !C5-23d/HOOQOOH to HP cyclic ether + OH ! ! !C5-24/hydroperoxyketone decomposition ! ! !C5-24b/Decomposition of the radicals from reaction type 24 ! ! !C5-25/Decomposition of cyclic ethers ! ! !C5-25b/decomposition of radicals from reaction type 25 ! ! !C5-26/mdxdyooh decomposition to mdxdyo + OH ! ! !C5-26b/Decomposition of the radicals from reaction type 26 ! ! !C5-27/hydroperoxy cyclic ether to alkoxy cyclic ether ! ! !C5-27b/decomposition reactions of radicals from reaction type 27 ! ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !! C6/Reactions of C6 species !! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! !C6-1/Unimolecular Initiations ! ! !C6-2/H-atom abstractions ! ! !C6-3/Decompositions c2h4+pc4h9=c6h13-1 8.800e+03 2.480 06130.0 !C6-3 c6h12-1+h=c6h13-1 2.500e+11 0.510 02620.0 !C6-3 nc3h7+c3h6=c6h13-2 8.800e+03 2.480 06130.0 !C6-3 c6h12-1+h=c6h13-2 4.240e+11 0.510 01230.0 !C6-3 c6h12-2+h=c6h13-2 2.500e+11 0.510 02620.0 !C6-3 c2h5+c4h8-1=c6h13-3 8.800e+03 2.480 06130.0 !C6-3 ch3+c5h10-1=c6h13-3 8.800e+03 2.480 06130.0 !C6-3 c6h12-2+h=c6h13-3 2.500e+11 0.510 02620.0 !C6-3 c6h12-3+h=c6h13-3 2.500e+11 0.510 02620.0 !C6-3 ! ! !C6-4/High temperature direct abstraction (not in the Huge Mechanism) c6h13-1+o2=c6h12-1+ho2 1.600e+12 0.000 05000.0 !C6-4 Nancy, Exgas ! ! !C6-5/Isomerizations c6h13-1=c6h13-2 3.560e+10 0.880 37300.0 !C6-5 matheu, 2003 1,2 h-shift p->s duplicate c6h13-1=c6h13-3 3.800e+10 0.670 36600.0 !C6-5 matheu, 2003 1,3 h-shift p->s duplicate c6h13-1=c6h13-3 6.980e+00 3.200 16560.0 !C6-5 tsang, 2006 1,4 h-shift p->s (hexenyl radical) duplicate c6h13-1=c6h13-2 1.830e+02 2.550 10960.0 !C6-5 tsang, 2006 1,5 h-shift p->s (hexenyl radical) duplicate c6h13-2=c6h13-3 3.560e+10 0.880 39100.0 !C6-5 matheu, 2003 1,2 h-shift s->s duplicate c6h13-2=c6h13-3 3.800e+10 0.670 38200.0 !C6-5 matheu, 2003 1,3 h-shift s->s duplicate ! ! !C6-6/H-atom abstraction from olefins c6h12-1+h=c6h11-11+h2 8.040e+05 2.500 12280.0 !C6-6 c6h12-1+h=c6h11-12+h2 4.050e+05 2.500 09794.0 !C6-6 c6h12-1+h=c6h11-13+h2 3.376e+05 2.360 00207.0 !C6-6 c6h12-1+h=c6h11-14+h2 1.300e+06 2.400 04471.0 !C6-6 c6h12-1+h=c6h11-15+h2 1.300e+06 2.400 04471.0 !C6-6 c6h12-1+h=c6h11-16+h2 9.400e+04 2.750 06280.0 !C6-6 ! c6h12-1+ho2=c6h11-11+h2o2 7.500e+09 0.000 12570.0 !C6-6 c6h12-1+ho2=c6h11-12+h2o2 3.000e+09 0.000 09930.0 !C6-6 c6h12-1+ho2=c6h11-13+h2o2 4.820e+03 2.550 10530.0 !C6-6 c6h12-1+ho2=c6h11-14+h2o2 5.880e+04 2.500 14860.0 !C6-6 c6h12-1+ho2=c6h11-15+h2o2 5.880e+04 2.500 14860.0 !C6-6 c6h12-1+ho2=c6h11-16+h2o2 4.050e+04 2.500 16690.0 !C6-6 ! c6h12-1+oh=c6h11-11+h2o 2.110e+06 2.000 02778.0 !C6-6 c6h12-1+oh=c6h11-12+h2o 1.110e+06 2.000 01451.0 !C6-6 c6h12-1+oh=c6h11-13+h2o 2.764e+04 2.640 -01919.0 !C6-6 c6h12-1+oh=c6h11-14+h2o 4.670e+07 1.610 -00035.0 !C6-6 c6h12-1+oh=c6h11-15+h2o 4.670e+07 1.610 -00035.0 !C6-6 c6h12-1+oh=c6h11-16+h2o 5.270e+09 0.970 01590.0 !C6-6 ! c6h12-1+o2=c6h11-11+ho2 2.000e+12 0.000 62900.0 !C6-6 c6h12-1+o2=c6h11-12+ho2 1.400E+12 0.000 60700.0 !C6-6 c6h12-1+o2=c6h11-13+ho2 2.200e+12 0.000 37220.0 !C6-6 c6h12-1+o2=c6h11-14+ho2 4.000e+13 0.000 50160.0 !C6-6 c6h12-1+o2=c6h11-15+ho2 4.000e+13 0.000 50160.0 !C6-6 c6h12-1+o2=c6h11-16+ho2 6.000e+13 0.000 52800.0 !C6-6 ! c6h12-1+o=c6h11-11+oh 1.200E+11 0.700 08959.0 !C6-6 c6h12-1+o=c6h11-12+oh 6.030E+10 0.700 07632.0 !C6-6 c6h12-1+o=c6h11-13+oh 6.600e+05 2.430 01210.0 !C6-6 c6h12-1+o=c6h11-14+oh 5.946e+05 2.440 02846.0 !C6-6 c6h12-1+o=c6h11-15+oh 5.946e+05 2.440 02846.0 !C6-6 c6h12-1+o=c6h11-16+oh 1.046e+06 2.420 04766.0 !C6-6 ! c6h12-1+ch3=c6h11-11+ch4 1.348E+00 3.500 12850.0 !C6-6 c6h12-1+ch3=c6h11-12+ch4 8.400E-01 3.500 11660.0 !C6-6 c6h12-1+ch3=c6h11-13+ch4 3.690e+00 3.310 04002.0 !C6-6 c6h12-1+ch3=c6h11-14+ch4 8.400e+04 2.130 07574.0 !C6-6 c6h12-1+ch3=c6h11-15+ch4 8.400e+04 2.130 07574.0 !C6-6 c6h12-1+ch3=c6h11-16+ch4 4.520e-01 3.650 07154.0 !C6-6 ! !c6h12-1+ch3o=c6h11-11+ch3oh !c6h12-1+ch3o=c6h11-12+ch3oh c6h12-1+ch3o=c6h11-13+ch3oh 4.000e+01 2.900 08609.0 !C6-6 c6h12-1+ch3o=c6h11-14+ch3oh 1.100e+11 0.000 05000.0 !C6-6 c6h12-1+ch3o=c6h11-15+ch3oh 1.100e+11 0.000 05000.0 !C6-6 c6h12-1+ch3o=c6h11-16+ch3oh 1.500e+10 0.000 07000.0 !C6-6 ! c6h12-1+ch3o2=c6h11-11+ch3o2h 7.500e+09 0.000 12570.0 !C6-6 c6h12-1+ch3o2=c6h11-12+ch3o2h 3.000e+09 0.000 09930.0 !C6-6 c6h12-1+ch3o2=c6h11-13+ch3o2h 4.820e+03 2.550 10530.0 !C6-6 c6h12-1+ch3o2=c6h11-14+ch3o2h 5.880e+04 2.500 14860.0 !C6-6 c6h12-1+ch3o2=c6h11-15+ch3o2h 5.880e+04 2.500 14860.0 !C6-6 c6h12-1+ch3o2=c6h11-16+ch3o2h 4.050e+04 2.500 16690.0 !C6-6 ! c6h12-1+c2h3=c6h11-11+c2h4 1.387e+00 3.500 10870.0 !C6-6 c6h12-1+c2h3=c6h11-12+c2h4 8.401e-01 3.500 09680.0 !C6-6 c6h12-1+c2h3=c6h11-13+c2h4 2.211E+00 3.500 04690.0 !C6-6 c6h12-1+c2h3=c6h11-14+c2h4 4.000e+11 0.000 16800.0 !C6-6 c6h12-1+c2h3=c6h11-15+c2h4 4.000e+11 0.000 16800.0 !C6-6 c6h12-1+c2h3=c6h11-16+c2h4 5.000e+11 0.000 18000.0 !C6-6 ! !c6h12-1+c2h5=c6h11-11+c2h6 !c6h12-1+c2h5=c6h11-12+c2h6 c6h12-1+c2h5=c6h11-13+c2h6 1.000e+11 0.000 09800.0 !C6-6 c6h12-1+c2h5=c6h11-14+c2h6 5.000e+10 0.000 10400.0 !C6-6 c6h12-1+c2h5=c6h11-15+c2h6 5.000e+10 0.000 10400.0 !C6-6 c6h12-1+c2h5=c6h11-16+c2h6 5.000e+10 0.000 13400.0 !C6-6 ! ! !C6-7/Additions c6h12-1+oh=c6h11oh2d1+h 3.041e+07 1.380 01615.0 !C6-3 Zhu et al., 2005 c2h4+oh A/2 c6h12-1+oh=c6h11oh1d1+h 3.041e+07 1.380 01615.0 !C6-3 Zhu et al., 2005 c2h4+oh A/2 ! c6h12-1+oh=c6h12oh2j1 1.129e+05 2.280 -1241.0 !C6-7 Zhu et al., 2005 c2h4+oh A/2 c6h12-1+oh=c6h12oh1j2 1.129e+05 2.280 -1241.0 !C6-7 Zhu et al., 2005 c2h4+oh A/2 ! c5h11-1+ch2o=c6h13o-1 5.000e+10 0.000 03457.0 !C6-3 Curran, 2006 nc3h7+ch2o c5h11cho+h=c6h13o-1 4.000e+12 0.000 06260.0 !C6-3 Curran, 2006 ch3cho+h nc3h7+c3h5oh1d2=c6h12oh1j2 8.800e+03 2.480 06130.0 !C6-3 Curran, 2006 c3h6+c2h5=c5h11-2 ch3+c4h9cho=c6h13o-2 5.000e+10 0.000 09043.0 !C6-3 Curran, 2006 c2h5cho+ch3 pc4h9+ch3cho=c6h13o-2 3.330e+10 0.000 06397.0 !C6-3 Curran, 2006 c2h5+ch3cho c4h9coch3+h=c6h13o-2 2.000e+12 0.000 07270.0 !C6-3 Curran, 2006 ch3coch3+h pc4h9+c2h3oh=c6h12oh2j1 1.890e+03 2.670 06850.0 !C6-3 Curran, 2006 c3h6+ch3=ic4h9 ! !c6h12oh1j2=c6h13o-1 3.695e+14 0.000 42070.0 !C6-5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 !c6h12oh2j1=c6h13o-2 3.695e+14 0.000 42070.0 !C6-5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 ! ! !C6-8/Decomposiitons and isomerizations c2h2+pc4h9=c6h11-11 8.800e+03 2.480 06130.0 !C6-8 h+c6h10-1=c6h11-11 2.500e+11 0.510 02620.0 !C6-8 c3h4-a+nc3h7=c6h11-12 8.800e+03 2.480 06130.0 !C6-8 h+c6h10-1=c6h11-12 2.500e+11 0.510 02620.0 !C6-8 h+c6h10-12=c6h11-12 2.500e+11 0.510 02620.0 !C6-8 h+c6h10-13=c6h11-13 2.500e+11 0.510 02620.0 !C6-8 c2h5+c4h6=c6h11-13 1.760e+04 2.480 06130.0 !C6-8 A*2 h+c6h10-13=c6h11-14 2.500e+11 0.510 02620.0 !C6-8 h+c6h10-14=c6h11-14 2.500e+11 0.510 02620.0 !C6-8 c2h3+c4h8-1=c6h11-14 2.000E+11 0.000 02007.0 !C6-8 Weissman et Benson, 1984 ch3+c5h8-14=c6h11-14 8.800e+03 2.480 06130.0 !C6-8 h+c6h10-14=c6h11-15 2.500e+11 0.510 02620.0 !C6-8 h+c6h10-15=c6h11-15 4.240e+11 0.510 01230.0 !C6-8 c6h11-15=c3h5-a+c3h6 3.310e+13 0.000 21460.0 !C6-8 gierczak et al., 1986 h+c6h10-15=c6h11-16 5.000e+11 0.510 02620.0 !C6-8 A*2 c2h4+c4h7-14=c6h11-16 8.800e+03 2.480 06130.0 !C6-8 ! !Isomerizations c6h11-14=c6h11-13 3.560e+10 0.880 31500.0 !C6-8 Matheu et al., 2003 1,2 h-shift s->a c6h11-15=c6h11-13 3.800e+10 0.670 30600.0 !C6-8 1,3 h-shift s->a correlation from 1,2 h-shift s->s & s->a c6h11-16=c6h11-13 7.850e+11 -0.120 15900.0 !C6-8 1,4 h-shift s->a correlation from 1,2 h-shift s->s & s->a c6h11-14=c6h11-15 3.560e+10 0.880 39100.0 !C6-8 Matheu et al., 2003 1,2 h-shift s->s c6h11-16=c6h11-14 3.800e+10 0.670 36600.0 !C6-8 Matheu et al., 2003 1,3 h-shift p->s c6h11-16=c6h11-15 3.560e+10 0.880 37300.0 !C6-8 Matheu et al., 2003 1,2 h-shift p->s ! ! !C6-9/Unimolecular Initiations and Molecular Decompositions c3h5-a+nc3h7=c6h12-1 2.500E+16 0.000 71000.0 !C6-9 Edelson et Allara, 1980 c6h11-13+h=c6h12-1 1.000E+14 0.000 00000.0 !C6-9 !retroene c6h12-1=c3h6+c3h6 3.980e+12 0.000 57630.0 !C6-9 King, 1979 ! ! !C6-10/First Addition to o2 c6h13-1+o2=c6h13o2-1 4.520e+12 0.000 00000.0 !C6-10 c6h13-2+o2=c6h13o2-2 7.540e+12 0.000 00000.0 !C6-10 c6h13-3+o2=c6h13o2-3 7.540e+12 0.000 00000.0 !C6-10 ! ! !C6-11/R+R'O2=RO+R'O ! ! !C6-11b/RO2+H=ROOH ! ! !C6-12-I/Isomerization to QOOH c6h13o2-1=c6h12ooh1-2 2.000e+11 0.000 26850.0 !C6-12-I 5s c6h13o2-1=c6h12ooh1-3 2.500e+10 0.000 20850.0 !C6-12-I 6s c6h13o2-1=c6h12ooh1-4 3.125e+09 0.000 19050.0 !C6-12-I 7s c6h13o2-1=c6h12ooh1-5 3.912e+08 0.000 22050.0 !C6-12-I 8s c6h13o2-2=c6h12ooh2-1 3.000e+11 0.000 29400.0 !C6-12-I 5p c6h13o2-2=c6h12ooh2-3 2.000e+11 0.000 26850.0 !C6-12-I 5s c6h13o2-2=c6h12ooh2-4 2.500e+10 0.000 20850.0 !C6-12-I 6s c6h13o2-2=c6h12ooh2-5 3.125e+09 0.000 19050.0 !C6-12-I 7s c6h13o2-2=c6h12ooh2-6 5.860e+08 0.000 25550.0 !C6-12-I 8p c6h13o2-3=c6h12ooh3-1 3.750e+10 0.000 24400.0 !C6-12-I 6p c6h13o2-3=c6h12ooh3-2 2.000e+11 0.000 26850.0 !C6-12-I 5s c6h13o2-3=c6h12ooh3-4 2.000e+11 0.000 26850.0 !C6-12-I 5s c6h13o2-3=c6h12ooh3-5 2.500e+10 0.000 20850.0 !C6-12-I 6s c6h13o2-3=c6h12ooh3-6 4.688e+09 0.000 22350.0 !C6-12-I 7p ! ! !C6-12-II/RO2=olefin+HO2 c6h13o2-1=c6h12-1+ho2 3.780e+07 1.510 29640.0 !C6-12-II c6h13o2-2=c6h12-1+ho2 4.680e+09 1.160 30870.0 !C6-12-II c6h13o2-2=c6h12-2+ho2 3.780e+07 1.510 29640.0 !C6-12-II c6h13o2-3=c6h12-2+ho2 3.780e+07 1.510 29640.0 !C6-12-II c6h13o2-3=c6h12-3+ho2 3.780e+07 1.510 29640.0 !C6-12-II ! ! !C6-12-III/RO2=aldehyde+OH c6h13o2-1=c5h11cho+oh 1.320e+09 1.370 41590.0 !C6-12-III Sheng et al., 2002 c6h13o2-2=c4h9coch3+oh 1.320e+09 1.370 41590.0 !C6-12-III Sheng et al., 2002 c6h13o2-3=c3h7coc2h5+oh 1.320e+09 1.370 41590.0 !C6-12-III Sheng et al., 2002 ! ! !C6-13/RO2+HO2=ROOH+O2 c6h13o2-1+ho2=c6h13ooh-1+o2 1.750E+11 0.000 01710.0 !C6-13 !Lightfoot et al., 1991 c6h13o2-2+ho2=c6h13ooh-2+o2 1.750E+11 0.000 01710.0 !C6-13 !Lightfoot et al., 1991 c6h13o2-3+ho2=c6h13ooh-3+o2 1.750E+11 0.000 01710.0 !C6-13 !Lightfoot et al., 1991 ! ! !C6-14/RO2+H2O2=ROOH+HO2 c6h13o2-1+h2o2=c6h13ooh-1+ho2 2.410E+12 0.000 09940.0 !C6-14 !Tsang and Hampson, 1986 c6h13o2-2+h2o2=c6h13ooh-2+ho2 2.410E+12 0.000 09940.0 !C6-14 !Tsang and Hampson, 1986 c6h13o2-3+h2o2=c6h13ooh-3+ho2 2.410E+12 0.000 09940.0 !C6-14 !Tsang and Hampson, 1986 ! ! !C6-15/RO2+CH3O2=RO+CH3O+O2 c6h13o2-1+ch3o2=c6h13o-1+ch3o+o2 1.400E+16 -1.610 01860.0 !C6-15 c6h13o2-2+ch3o2=c6h13o-2+ch3o+o2 1.400E+16 -1.610 01860.0 !C6-15 c6h13o2-3+ch3o2=c6h13o-3+ch3o+o2 1.400E+16 -1.610 01860.0 !C6-15 ! ! !C6-16/RO2+R'O2=RO+R'O+O2 ! ! !C6-17/ROOH=RO+OH c6h13ooh-1=oh+c6h13o-1 6.310E+14 0.000 42330.0 !C6-17 Lightfoot et al., 1991 c6h13ooh-2=oh+c6h13o-2 6.310E+14 0.000 42330.0 !C6-17 Lightfoot et al., 1991 c6h13ooh-3=oh+c6h13o-3 6.310E+14 0.000 42330.0 !C6-17 Lightfoot et al., 1991 ! ! !C6-18/RO decomposition c2h5+c3h7cho=c6h13o-3 3.330E+10 0.000 06397.0 !C6-18 Curran, 2006 c2h5+ch3cho h+c3h7coc2h5=c6h13o-3 2.000E+12 0.000 07270.0 !C6-18 Curran, 2006 ch3coch3+h nc3h7+c2h5cho=c6h13o-3 3.330E+10 0.000 06397.0 !C6-18 Curran, 2006 c2h5+ch3cho ! ! !C6-19/Decomposiiton to Cyclic Ethers c6h12ooh1-2=c6h12o1-2+oh 6.000e+11 0.000 22000.0 !C6-19 oxirane c6h12ooh1-3=c6h12o1-3+oh 7.500e+10 0.000 15250.0 !C6-19 oxetane c6h12ooh1-4=c6h12o1-4+oh 9.375e+09 0.000 07000.0 !C6-19 oxalane c6h12ooh1-5=c6h12o1-5+oh 1.172e+09 0.000 01800.0 !C6-19 oxane c6h12ooh2-1=c6h12o1-2+oh 6.000e+11 0.000 22000.0 !C6-19 oxirane c6h12ooh2-3=c6h12o2-3+oh 6.000e+11 0.000 22000.0 !C6-19 oxirane c6h12ooh2-4=c6h12o2-4+oh 7.500e+10 0.000 15250.0 !C6-19 oxetane c6h12ooh2-5=c6h12o2-5+oh 9.375e+09 0.000 07000.0 !C6-19 oxalane c6h12ooh2-6=c6h12o1-5+oh 1.172e+09 0.000 01800.0 !C6-19 oxane c6h12ooh3-1=c6h12o1-3+oh 7.500e+10 0.000 15250.0 !C6-19 oxetane c6h12ooh3-2=c6h12o2-3+oh 6.000e+11 0.000 22000.0 !C6-19 oxirane c6h12ooh3-4=c6h12o3-4+oh 6.000e+11 0.000 22000.0 !C6-19 oxirane c6h12ooh3-5=c6h12o2-4+oh 7.500e+10 0.000 15250.0 !C6-19 oxetane c6h12ooh3-6=c6h12o1-4+oh 9.375e+09 0.000 07000.0 !C6-19 oxalane ! ! !C6-20-I/qooh = olefin + ho2 c6h12-1+ho2=c6h12ooh1-2 1.000e+11 0.000 10750.0 !C6-20-I c6h12-1+ho2=c6h12ooh2-1 1.000e+11 0.000 11750.0 !C6-20-I c6h12-2+ho2=c6h12ooh2-3 1.000e+11 0.000 11750.0 !C6-20-I c6h12-2+ho2=c6h12ooh3-2 1.000e+11 0.000 11750.0 !C6-20-I c6h12-3+ho2=c6h12ooh3-4 1.000e+11 0.000 11750.0 !C6-20-I ! ! !C6-21/qooh=olefin+carbonyl+oh c6h12ooh1-3=c5h10-1+ch2o+oh 7.703E+13 -0.160 30090.0 !C6-21 rev/ 0.000e+00 0.000 00000.0 / c6h12ooh2-4=c4h8-1+ch3cho+oh 2.933E+18 -1.700 24080.0 !C6-21 rev/ 0.000e+00 0.000 00000.0 / c6h12ooh3-5=c3h6+c2h5cho+oh 1.171E+17 -1.310 28880.0 !C6-21 rev/ 0.000e+00 0.000 00000.0 / c6h12ooh3-1=c2h4+c3h7cho+oh 7.326E+18 -1.740 27420.0 !C6-21 rev/ 0.000e+00 0.000 00000.0 / ! ! !C6-22-QOOH+O2=OOQOOH ! ! !C6-23/OOQOOH isomerization to ketohydroperoxyde + oh ! ! !C6-23a/OOQOOH to alkeneooh + ho2 ! ! !C6-23b/OOQOOH to HOOQOOH !except when HOOQOOH leads to a keto compounds + oh (see reaction type 23) ! ! !C6-23c/HOOQOOH to olefinHP + ho2 ! ! !C6-23d/HOOQOOH to HP cyclic ether + OH ! ! !C6-24/hydroperoxyketone decomposition ! ! !C6-24b/Decomposition of the radicals from reaction type 24 ! ! !C6-25/Decomposition of cyclic ethers ! ! !C6-25b/decomposition of radicals from reaction type 25 ! ! !C6-26/mdxdyooh decomposition to mdxdyo + OH ! ! !C6-26b/Decomposition of the radicals from reaction type 26 ! ! !C6-27/hydroperoxy cyclic ether to alkoxy cyclic ether ! ! !C6-27b/decomposition reactions of radicals from reaction type 27 ! ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !! C7/Reactions of C7 species !! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! !C7-1/Unimolecular Initiations nc7h16=h+c7h15-1 1.340E+88 -21.170 1.428E+05 !C7-1 rev/ 3.374E+82 -20.220 3.961E+04 / nc7h16=h+c7h15-2 6.500E+87 -21.010 1.395E+05 !C7-1 rev/ 5.207E+80 -19.670 3.889E+04 / nc7h16=h+c7h15-3 6.500E+87 -21.010 1.395E+05 !C7-1 rev/ 5.207E+80 -19.670 3.889E+04 / nc7h16=h+c7h15-4 3.250E+87 -21.010 1.395E+05 !C7-1 rev/ 5.187E+80 -19.670 3.889E+04 / nc7h16=c6h13-1+ch3 2.925E+73 -16.610 1.189E+05 !C7-1 rev/ 8.348E+66 -15.750 3.183E+04 / nc7h16=c5h11-1+c2h5 8.100E+77 -17.620 1.204E+05 !C7-1 rev/ 8.297E+67 -16.050 3.235E+04 / nc7h16=pc4h9+nc3h7 1.415E+78 -17.710 1.207E+05 !C7-1 rev/ 1.363E+68 -16.110 3.246E+04 / ! ! !C7-2/H-atom abstractions nc7h16+h=c7h15-1+h2 1.880E+05 2.750 6.280E+03 !C7-2 rev/ 8.926E+03 2.700 1.055E+04 / nc7h16+h=c7h15-2+h2 2.600E+06 2.400 4.471E+03 !C7-2 rev/ 3.928E+03 2.740 1.126E+04 / nc7h16+h=c7h15-3+h2 2.600E+06 2.400 4.471E+03 !C7-2 rev/ 3.928E+03 2.740 1.126E+04 / nc7h16+h=c7h15-4+h2 1.300E+06 2.400 4.471E+03 !C7-2 rev/ 3.913E+03 2.740 1.126E+04 / nc7h16+o=c7h15-1+oh 1.930E+05 2.680 3.716E+03 !C7-2 rev/ 4.025E+03 2.630 5.893E+03 / nc7h16+o=c7h15-2+oh 9.540E+04 2.710 2.106E+03 !C7-2 rev/ 6.330E+01 3.050 6.798E+03 / nc7h16+o=c7h15-3+oh 9.540E+04 2.710 2.106E+03 !C7-2 rev/ 6.330E+01 3.050 6.798E+03 / nc7h16+o=c7h15-4+oh 4.770E+04 2.710 2.106E+03 !C7-2 rev/ 6.306E+01 3.050 6.798E+03 / nc7h16+oh=c7h15-1+h2o 1.050E+10 0.970 1.590E+03 !C7-2 rev/ 1.500E+10 1.050 2.333E+04 / nc7h16+oh=c7h15-2+h2o 9.400E+07 1.610 -3.500E+01 !C7-2 rev/ 6.148E+05 1.950 2.191E+04 / nc7h16+oh=c7h15-3+h2o 9.400E+07 1.610 -3.500E+01 !C7-2 rev/ 6.148E+05 1.950 2.191E+04 / nc7h16+oh=c7h15-4+h2o 4.700E+07 1.610 -3.500E+01 !C7-2 rev/ 6.125E+05 1.950 2.191E+04 / nc7h16+ho2=c7h15-1+h2o2 1.680E+13 0.000 2.044E+04 !C7-2 rev/ 2.050E+13 -0.380 8.399E+03 / nc7h16+ho2=c7h15-2+h2o2 1.120E+13 0.000 1.769E+04 !C7-2 rev/ 4.348E+11 0.010 8.165E+03 / nc7h16+ho2=c7h15-3+h2o2 1.120E+13 0.000 1.769E+04 !C7-2 rev/ 4.348E+11 0.010 8.165E+03 / nc7h16+ho2=c7h15-4+h2o2 5.600E+12 0.000 1.769E+04 !C7-2 rev/ 4.332E+11 0.010 8.165E+03 / nc7h16+ch3=c7h15-1+ch4 9.040E-01 3.650 7.154E+03 !C7-2 rev/ 1.121E+00 3.600 1.191E+04 / nc7h16+ch3=c7h15-2+ch4 5.410E+04 2.260 7.287E+03 !C7-2 rev/ 2.135E+03 2.600 1.455E+04 / nc7h16+ch3=c7h15-3+ch4 5.410E+04 2.260 7.287E+03 !C7-2 rev/ 2.135E+03 2.600 1.455E+04 / nc7h16+ch3=c7h15-4+ch4 2.705E+04 2.260 7.287E+03 !C7-2 rev/ 2.127E+03 2.600 1.455E+04 / nc7h16+o2=c7h15-1+ho2 6.000E+13 0.000 5.280E+04 !C7-2 rev/ 5.175E+10 0.280 -4.060E+02 / nc7h16+o2=c7h15-2+ho2 4.000E+13 0.000 5.015E+04 !C7-2 rev/ 1.098E+09 0.670 -5.410E+02 / nc7h16+o2=c7h15-3+ho2 4.000E+13 0.000 5.015E+04 !C7-2 rev/ 1.098E+09 0.670 -5.410E+02 / nc7h16+o2=c7h15-4+ho2 2.000E+13 0.000 5.015E+04 !C7-2 rev/ 1.094E+09 0.670 -5.410E+02 / nc7h16+c2h5=c7h15-1+c2h6 1.000E+11 0.000 1.340E+04 !C7-2 rev/ 3.200E+11 0.000 1.230E+04 / nc7h16+c2h5=c7h15-2+c2h6 1.000E+11 0.000 1.040E+04 !C7-2 rev/ 1.000E+11 0.000 1.290E+04 / nc7h16+c2h5=c7h15-3+c2h6 1.000E+11 0.000 1.040E+04 !C7-2 rev/ 1.000E+11 0.000 1.290E+04 / nc7h16+c2h5=c7h15-4+c2h6 5.000E+10 0.000 1.040E+04 !C7-2 rev/ 1.000E+11 0.000 1.290E+04 / nc7h16+ch3o=c7h15-1+ch3oh 3.160E+11 0.000 7.000E+03 !C7-2 rev/ 1.200E+10 0.000 9.200E+03 / nc7h16+ch3o=c7h15-2+ch3oh 2.190E+11 0.000 5.000E+03 !C7-2 rev/ 8.900E+09 0.000 7.200E+03 / nc7h16+ch3o=c7h15-3+ch3oh 2.190E+11 0.000 5.000E+03 !C7-2 rev/ 8.900E+09 0.000 7.200E+03 / nc7h16+ch3o=c7h15-4+ch3oh 1.095E+11 0.000 5.000E+03 !C7-2 rev/ 8.900E+09 0.000 7.200E+03 / nc7h16+c2h3=c7h15-1+c2h4 1.000E+12 0.000 1.800E+04 !C7-2 rev/ 2.570E+12 0.000 2.540E+04 / nc7h16+c2h3=c7h15-2+c2h4 8.000E+11 0.000 1.680E+04 !C7-2 rev/ 2.000E+12 0.000 2.420E+04 / nc7h16+c2h3=c7h15-3+c2h4 8.000E+11 0.000 1.680E+04 !C7-2 rev/ 2.000E+12 0.000 2.420E+04 / nc7h16+c2h3=c7h15-4+c2h4 4.000E+11 0.000 1.680E+04 !C7-2 rev/ 2.000E+12 0.000 2.420E+04 / nc7h16+ch3o2=c7h15-1+ch3o2h 1.210E+13 0.000 2.043E+04 !C7-2 rev/ 3.600E+12 0.000 9.800E+03 / nc7h16+ch3o2=c7h15-2+ch3o2h 8.064E+12 0.000 1.770E+04 !C7-2 rev/ 2.376E+11 0.000 3.700E+03 / nc7h16+ch3o2=c7h15-3+ch3o2h 8.064E+12 0.000 1.770E+04 !C7-2 rev/ 2.376E+11 0.000 3.700E+03 / nc7h16+ch3o2=c7h15-4+ch3o2h 4.032E+12 0.000 1.770E+04 !C7-2 rev/ 2.376E+11 0.000 3.700E+03 / nc7h16+c7h15-1=c7h15-2+nc7h16 1.000E+11 0.000 1.040E+04 !C7-2 rev/ 1.500E+11 0.000 1.230E+04 / nc7h16+c7h15-1=c7h15-3+nc7h16 1.000E+11 0.000 1.040E+04 !C7-2 rev/ 1.500E+11 0.000 1.230E+04 / nc7h16+c7h15-1=c7h15-4+nc7h16 5.000E+10 0.000 1.040E+04 !C7-2 rev/ 1.500E+11 0.000 1.230E+04 / nc7h16+c7h15-2=c7h15-3+nc7h16 1.000E+11 0.000 1.040E+04 !C7-2 rev/ 1.000E+11 0.000 1.040E+04 / nc7h16+c7h15-2=c7h15-4+nc7h16 5.000E+10 0.000 1.040E+04 !C7-2 rev/ 1.000E+11 0.000 1.040E+04 / nc7h16+c7h15-3=c7h15-4+nc7h16 5.000E+10 0.000 1.040E+04 !C7-2 rev/ 1.000E+11 0.000 1.040E+04 / ! ! !C7-3/Decompositions c2h4+c5h11-1=c7h15-1 8.800e+03 2.480 06130.0 !C7-3 c7h14-1+h=c7h15-1 2.500e+11 0.510 02620.0 !C7-3 pc4h9+c3h6=c7h15-2 8.800e+03 2.480 06130.0 !C7-3 c7h14-1+h=c7h15-2 4.240e+11 0.510 01230.0 !C7-3 c7h14-2+h=c7h15-2 2.500e+11 0.510 02620.0 !C7-3 nc3h7+c4h8-1=c7h15-3 8.800e+03 2.480 06130.0 !C7-3 ch3+c6h12-1=c7h15-3 8.800e+03 2.480 06130.0 !C7-3 c7h14-2+h=c7h15-3 2.500e+11 0.510 02620.0 !C7-3 c7h14-3+h=c7h15-3 2.500e+11 0.510 02620.0 !C7-3 c2h5+c5h10-1=c7h15-4 1.760e+04 2.480 06130.0 !C7-3 c7h14-3+h=c7h15-4 5.000e+11 0.510 02620.0 !C7-3 ! !Radicals from Additions !cf. Reaction Type C7-7 ! ! !C7-4/High temperature direct abstraction (not in the Huge Mechanism) c7h15-1+o2=c7h14-1+ho2 1.600e+12 0.000 05000.0 !C7-4 Nancy, Exgas c7h15-2+o2=c7h14-1+ho2 1.600e+12 0.000 05000.0 !C7-4 Nancy, Exgas c7h15-2+o2=c7h14-2+ho2 1.600e+12 0.000 05000.0 !C7-4 Nancy, Exgas c7h15-3+o2=c7h14-2+ho2 1.600e+12 0.000 05000.0 !C7-4 Nancy, Exgas c7h15-3+o2=c7h14-3+ho2 1.600e+12 0.000 05000.0 !C7-4 Nancy, Exgas c7h15-4+o2=c7h14-3+ho2 3.200e+12 0.000 05000.0 !C7-4 Nancy, Exgas ! ! !C7-5/Isomerizations c7h15-1=c7h15-2 3.560e+10 0.880 37300.0 !C7-5 matheu, 2003 1,2 h-shift p->s c7h15-1=c7h15-3 3.800e+10 0.670 36600.0 !C7-5 matheu, 2003 1,3 h-shift p->s duplicate c7h15-1=c7h15-4 7.850e+11 -0.120 20600.0 !C7-5 matheu, 2003 1,4 h-shift p->s c7h15-1=c7h15-3 1.830e+02 2.550 10960.0 !C7-5 tsang, 2006 1,5 h-shift p->s (hexenyl radical) duplicate c7h15-2=c7h15-3 3.560e+10 0.880 39100.0 !C7-5 matheu, 2003 1,2 h-shift s->s duplicate c7h15-2=c7h15-4 3.800e+10 0.670 38200.0 !C7-5 matheu, 2003 1,3 h-shift s->s c7h15-2=c7h15-3 7.850e+11 -0.120 23500.0 !C7-5 matheu, 2003 1,4 h-shift s->s duplicate c7h15-3=c7h15-4 3.560e+10 0.880 39100.0 !C7-5 matheu, 2003 1,2 h-shift s->s ! ! !C7-6/H-atom abstraction from olefins c7h14-1+h=c7h13-11+h2 8.040e+05 2.500 12280.0 !C7-6 c7h14-1+h=c7h13-12+h2 4.050e+05 2.500 09794.0 !C7-6 c7h14-1+h=c7h13-13+h2 3.376e+05 2.360 00207.0 !C7-6 c7h14-1+h=c7h13-14+h2 1.300e+06 2.400 04471.0 !C7-6 c7h14-1+h=c7h13-15+h2 1.300e+06 2.400 04471.0 !C7-6 c7h14-1+h=c7h13-16+h2 1.300e+06 2.400 04471.0 !C7-6 c7h14-1+h=c7h13-17+h2 9.400e+04 2.750 06280.0 !C7-6 ! c7h14-1+ho2=c7h13-11+h2o2 7.500e+09 0.000 12570.0 !C7-6 c7h14-1+ho2=c7h13-12+h2o2 3.000e+09 0.000 09930.0 !C7-6 c7h14-1+ho2=c7h13-13+h2o2 4.820e+03 2.550 10530.0 !C7-6 c7h14-1+ho2=c7h13-14+h2o2 5.880e+04 2.500 14860.0 !C7-6 c7h14-1+ho2=c7h13-15+h2o2 5.880e+04 2.500 14860.0 !C7-6 c7h14-1+ho2=c7h13-16+h2o2 5.880e+04 2.500 14860.0 !C7-6 c7h14-1+ho2=c7h13-17+h2o2 4.050e+04 2.500 16690.0 !C7-6 ! c7h14-1+oh=c7h13-11+h2o 2.110e+06 2.000 02778.0 !C7-6 c7h14-1+oh=c7h13-12+h2o 1.110e+06 2.000 01451.0 !C7-6 c7h14-1+oh=c7h13-13+h2o 2.764e+04 2.640 -01919.0 !C7-6 c7h14-1+oh=c7h13-14+h2o 4.670e+07 1.610 -00035.0 !C7-6 c7h14-1+oh=c7h13-15+h2o 4.670e+07 1.610 -00035.0 !C7-6 c7h14-1+oh=c7h13-16+h2o 4.670e+07 1.610 -00035.0 !C7-6 c7h14-1+oh=c7h13-17+h2o 5.270e+09 0.970 01590.0 !C7-6 ! c7h14-1+o2=c7h13-11+ho2 2.000e+12 0.000 62900.0 !C7-6 c7h14-1+o2=c7h13-12+ho2 1.400E+12 0.000 60700.0 !C7-6 c7h14-1+o2=c7h13-13+ho2 2.200e+12 0.000 37220.0 !C7-6 c7h14-1+o2=c7h13-14+ho2 4.000e+13 0.000 50160.0 !C7-6 c7h14-1+o2=c7h13-15+ho2 4.000e+13 0.000 50160.0 !C7-6 c7h14-1+o2=c7h13-16+ho2 4.000e+13 0.000 50160.0 !C7-6 c7h14-1+o2=c7h13-17+ho2 6.000e+13 0.000 52800.0 !C7-6 ! c7h14-1+o=c7h13-11+oh 1.200E+11 0.700 08959.0 !C7-6 c7h14-1+o=c7h13-12+oh 6.030E+10 0.700 07632.0 !C7-6 c7h14-1+o=c7h13-13+oh 6.600e+05 2.430 01210.0 !C7-6 c7h14-1+o=c7h13-14+oh 5.946e+05 2.440 02846.0 !C7-6 c7h14-1+o=c7h13-15+oh 5.946e+05 2.440 02846.0 !C7-6 c7h14-1+o=c7h13-16+oh 5.946e+05 2.440 02846.0 !C7-6 c7h14-1+o=c7h13-17+oh 1.046e+06 2.420 04766.0 !C7-6 ! c7h14-1+ch3=c7h13-11+ch4 1.348E+00 3.500 12850.0 !C7-6 c7h14-1+ch3=c7h13-12+ch4 8.400E-01 3.500 11660.0 !C7-6 c7h14-1+ch3=c7h13-13+ch4 3.690e+00 3.310 04002.0 !C7-6 c7h14-1+ch3=c7h13-14+ch4 8.400e+04 2.130 07574.0 !C7-6 c7h14-1+ch3=c7h13-15+ch4 8.400e+04 2.130 07574.0 !C7-6 c7h14-1+ch3=c7h13-16+ch4 8.400e+04 2.130 07574.0 !C7-6 c7h14-1+ch3=c7h13-17+ch4 4.520e-01 3.650 07154.0 !C7-6 ! !c7h14-1+ch3o=c7h13-11+ch3oh !c7h14-1+ch3o=c7h13-12+ch3oh c7h14-1+ch3o=c7h13-13+ch3oh 4.000e+01 2.900 08609.0 !C7-6 c7h14-1+ch3o=c7h13-14+ch3oh 1.100e+11 0.000 05000.0 !C7-6 c7h14-1+ch3o=c7h13-15+ch3oh 1.100e+11 0.000 05000.0 !C7-6 c7h14-1+ch3o=c7h13-16+ch3oh 1.100e+11 0.000 05000.0 !C7-6 c7h14-1+ch3o=c7h13-17+ch3oh 1.500e+10 0.000 07000.0 !C7-6 ! c7h14-1+ch3o2=c7h13-11+ch3o2h 7.500e+09 0.000 12570.0 !C7-6 c7h14-1+ch3o2=c7h13-12+ch3o2h 3.000e+09 0.000 09930.0 !C7-6 c7h14-1+ch3o2=c7h13-13+ch3o2h 4.820e+03 2.550 10530.0 !C7-6 c7h14-1+ch3o2=c7h13-14+ch3o2h 5.880e+04 2.500 14860.0 !C7-6 c7h14-1+ch3o2=c7h13-15+ch3o2h 5.880e+04 2.500 14860.0 !C7-6 c7h14-1+ch3o2=c7h13-16+ch3o2h 5.880e+04 2.500 14860.0 !C7-6 c7h14-1+ch3o2=c7h13-17+ch3o2h 4.050e+04 2.500 16690.0 !C7-6 ! c7h14-1+c2h3=c7h13-11+c2h4 1.387e+00 3.500 10870.0 !C7-6 c7h14-1+c2h3=c7h13-12+c2h4 8.401e-01 3.500 09680.0 !C7-6 c7h14-1+c2h3=c7h13-13+c2h4 2.211E+00 3.500 04690.0 !C7-6 c7h14-1+c2h3=c7h13-14+c2h4 4.000e+11 0.000 16800.0 !C7-6 c7h14-1+c2h3=c7h13-15+c2h4 4.000e+11 0.000 16800.0 !C7-6 c7h14-1+c2h3=c7h13-16+c2h4 4.000e+11 0.000 16800.0 !C7-6 c7h14-1+c2h3=c7h13-17+c2h4 5.000e+11 0.000 18000.0 !C7-6 ! !c7h14-1+c2h5=c7h13-11+c2h6 !c7h14-1+c2h5=c7h13-12+c2h6 c7h14-1+c2h5=c7h13-13+c2h6 1.000e+11 0.000 09800.0 !C7-6 c7h14-1+c2h5=c7h13-14+c2h6 5.000e+10 0.000 10400.0 !C7-6 c7h14-1+c2h5=c7h13-15+c2h6 5.000e+10 0.000 10400.0 !C7-6 c7h14-1+c2h5=c7h13-16+c2h6 5.000e+10 0.000 10400.0 !C7-6 c7h14-1+c2h5=c7h13-17+c2h6 5.000e+10 0.000 13400.0 !C7-6 ! ! c7h14-2+h=c7h13-13+h2 3.376e+05 2.360 00207.0 !C7-6 c7h14-2+h=c7h13-22+h2 4.050e+05 2.500 09794.0 !C7-6 c7h14-2+h=c7h13-23+h2 4.050e+05 2.500 09794.0 !C7-6 c7h14-2+h=c7h13-24+h2 3.376e+05 2.360 00207.0 !C7-6 c7h14-2+h=c7h13-25+h2 1.300e+06 2.400 04471.0 !C7-6 c7h14-2+h=c7h13-26+h2 1.300e+06 2.400 04471.0 !C7-6 c7h14-2+h=c7h13-27+h2 9.400e+04 2.750 06280.0 !C7-6 ! c7h14-2+ho2=c7h13-13+h2o2 4.820e+03 2.550 10530.0 !C7-6 c7h14-2+ho2=c7h13-22+h2o2 3.000e+09 0.000 09930.0 !C7-6 c7h14-2+ho2=c7h13-23+h2o2 3.000e+09 0.000 09930.0 !C7-6 c7h14-2+ho2=c7h13-24+h2o2 4.820e+03 2.550 10530.0 !C7-6 c7h14-2+ho2=c7h13-25+h2o2 5.880e+04 2.500 14860.0 !C7-6 c7h14-2+ho2=c7h13-26+h2o2 5.880e+04 2.500 14860.0 !C7-6 c7h14-2+ho2=c7h13-27+h2o2 4.050e+04 2.500 16690.0 !C7-6 ! c7h14-2+oh=c7h13-13+h2o 2.764e+04 2.640 -01919.0 !C7-6 c7h14-2+oh=c7h13-22+h2o 1.110e+06 2.000 01451.0 !C7-6 c7h14-2+oh=c7h13-23+h2o 1.110e+06 2.000 01451.0 !C7-6 c7h14-2+oh=c7h13-24+h2o 2.764e+04 2.640 -01919.0 !C7-6 c7h14-2+oh=c7h13-25+h2o 4.670e+07 1.610 -00035.0 !C7-6 c7h14-2+oh=c7h13-26+h2o 4.670e+07 1.610 -00035.0 !C7-6 c7h14-2+oh=c7h13-27+h2o 5.270e+09 0.970 01590.0 !C7-6 ! c7h14-2+o2=c7h13-13+ho2 2.200e+12 0.000 37220.0 !C7-6 c7h14-2+o2=c7h13-22+ho2 1.400E+12 0.000 60700.0 !C7-6 c7h14-2+o2=c7h13-23+ho2 1.400E+12 0.000 60700.0 !C7-6 c7h14-2+o2=c7h13-24+ho2 2.200e+12 0.000 37220.0 !C7-6 c7h14-2+o2=c7h13-25+ho2 4.000e+13 0.000 50160.0 !C7-6 c7h14-2+o2=c7h13-26+ho2 4.000e+13 0.000 50160.0 !C7-6 c7h14-2+o2=c7h13-27+ho2 6.000e+13 0.000 52800.0 !C7-6 ! c7h14-2+o=c7h13-13+oh 6.600e+05 2.430 01210.0 !C7-6 c7h14-2+o=c7h13-22+oh 6.030E+10 0.700 07632.0 !C7-6 c7h14-2+o=c7h13-23+oh 6.030E+10 0.700 07632.0 !C7-6 c7h14-2+o=c7h13-24+oh 6.600e+05 2.430 01210.0 !C7-6 c7h14-2+o=c7h13-25+oh 5.946e+05 2.440 02846.0 !C7-6 c7h14-2+o=c7h13-26+oh 5.946e+05 2.440 02846.0 !C7-6 c7h14-2+o=c7h13-27+oh 1.046e+06 2.420 04766.0 !C7-6 ! c7h14-2+ch3=c7h13-13+ch4 3.690e+00 3.310 04002.0 !C7-6 c7h14-2+ch3=c7h13-22+ch4 8.400E-01 3.500 11660.0 !C7-6 c7h14-2+ch3=c7h13-23+ch4 8.400E-01 3.500 11660.0 !C7-6 c7h14-2+ch3=c7h13-24+ch4 3.690e+00 3.310 04002.0 !C7-6 c7h14-2+ch3=c7h13-25+ch4 8.400e+04 2.130 07574.0 !C7-6 c7h14-2+ch3=c7h13-26+ch4 8.400e+04 2.130 07574.0 !C7-6 c7h14-2+ch3=c7h13-27+ch4 4.520e-01 3.650 07154.0 !C7-6 ! c7h14-2+ch3o=c7h13-13+ch3oh 4.000e+01 2.900 08609.0 !C7-6 !c7h14-2+ch3o=c7h13-22+ch3oh !c7h14-2+ch3o=c7h13-23+ch3oh c7h14-2+ch3o=c7h13-24+ch3oh 4.000e+01 2.900 08609.0 !C7-6 c7h14-2+ch3o=c7h13-25+ch3oh 1.100e+11 0.000 05000.0 !C7-6 c7h14-2+ch3o=c7h13-26+ch3oh 1.100e+11 0.000 05000.0 !C7-6 c7h14-2+ch3o=c7h13-27+ch3oh 1.500e+10 0.000 07000.0 !C7-6 ! c7h14-2+ch3o2=c7h13-13+ch3o2h 4.820e+03 2.550 10530.0 !C7-6 c7h14-2+ch3o2=c7h13-22+ch3o2h 3.000e+09 0.000 09930.0 !C7-6 c7h14-2+ch3o2=c7h13-23+ch3o2h 3.000e+09 0.000 09930.0 !C7-6 c7h14-2+ch3o2=c7h13-24+ch3o2h 4.820e+03 2.550 10530.0 !C7-6 c7h14-2+ch3o2=c7h13-25+ch3o2h 5.880e+04 2.500 14860.0 !C7-6 c7h14-2+ch3o2=c7h13-26+ch3o2h 5.880e+04 2.500 14860.0 !C7-6 c7h14-2+ch3o2=c7h13-27+ch3o2h 4.050e+04 2.500 16690.0 !C7-6 ! c7h14-2+c2h3=c7h13-13+c2h4 2.211E+00 3.500 04690.0 !C7-6 c7h14-2+c2h3=c7h13-22+c2h4 8.401e-01 3.500 09680.0 !C7-6 c7h14-2+c2h3=c7h13-23+c2h4 8.401e-01 3.500 09680.0 !C7-6 c7h14-2+c2h3=c7h13-24+c2h4 2.211E+00 3.500 04690.0 !C7-6 c7h14-2+c2h3=c7h13-25+c2h4 4.000e+11 0.000 16800.0 !C7-6 c7h14-2+c2h3=c7h13-26+c2h4 4.000e+11 0.000 16800.0 !C7-6 c7h14-2+c2h3=c7h13-27+c2h4 5.000e+11 0.000 18000.0 !C7-6 ! c7h14-2+c2h5=c7h13-13+c2h6 1.000e+11 0.000 09800.0 !C7-6 !c7h14-2+c2h5=c7h13-22+c2h6 !c7h14-2+c2h5=c7h13-23+c2h6 c7h14-2+c2h5=c7h13-24+c2h6 1.000e+11 0.000 09800.0 !C7-6 c7h14-2+c2h5=c7h13-25+c2h6 5.000e+10 0.000 10400.0 !C7-6 c7h14-2+c2h5=c7h13-26+c2h6 5.000e+10 0.000 10400.0 !C7-6 c7h14-2+c2h5=c7h13-27+c2h6 5.000e+10 0.000 13400.0 !C7-6 ! ! c7h14-3+h=c7h13-31+h2 9.400e+04 2.750 06280.0 !C7-6 c7h14-3+h=c7h13-24+h2 3.376e+05 2.360 00207.0 !C7-6 c7h14-3+h=c7h13-33+h2 4.050e+05 2.500 09794.0 !C7-6 c7h14-3+h=c7h13-34+h2 4.050e+05 2.500 09794.0 !C7-6 c7h14-3+h=c7h13-35+h2 3.376e+05 2.360 00207.0 !C7-6 c7h14-3+h=c7h13-36+h2 1.300e+06 2.400 04471.0 !C7-6 c7h14-3+h=c7h13-37+h2 9.400e+04 2.750 06280.0 !C7-6 ! c7h14-3+ho2=c7h13-31+h2o2 4.050e+04 2.500 16690.0 !C7-6 c7h14-3+ho2=c7h13-24+h2o2 4.820e+03 2.550 10530.0 !C7-6 c7h14-3+ho2=c7h13-33+h2o2 3.000e+09 0.000 09930.0 !C7-6 c7h14-3+ho2=c7h13-34+h2o2 3.000e+09 0.000 09930.0 !C7-6 c7h14-3+ho2=c7h13-35+h2o2 4.820e+03 2.550 10530.0 !C7-6 c7h14-3+ho2=c7h13-36+h2o2 5.880e+04 2.500 14860.0 !C7-6 c7h14-3+ho2=c7h13-37+h2o2 4.050e+04 2.500 16690.0 !C7-6 ! c7h14-3+oh=c7h13-31+h2o 5.270e+09 0.970 01590.0 !C7-6 c7h14-3+oh=c7h13-24+h2o 2.764e+04 2.640 -01919.0 !C7-6 c7h14-3+oh=c7h13-33+h2o 1.110e+06 2.000 01451.0 !C7-6 c7h14-3+oh=c7h13-34+h2o 1.110e+06 2.000 01451.0 !C7-6 c7h14-3+oh=c7h13-35+h2o 2.764e+04 2.640 -01919.0 !C7-6 c7h14-3+oh=c7h13-36+h2o 4.670e+07 1.610 -00035.0 !C7-6 c7h14-3+oh=c7h13-37+h2o 5.270e+09 0.970 01590.0 !C7-6 ! c7h14-3+o2=c7h13-31+ho2 6.000e+13 0.000 52800.0 !C7-6 c7h14-3+o2=c7h13-24+ho2 2.200e+12 0.000 37220.0 !C7-6 c7h14-3+o2=c7h13-33+ho2 1.400E+12 0.000 60700.0 !C7-6 c7h14-3+o2=c7h13-34+ho2 1.400E+12 0.000 60700.0 !C7-6 c7h14-3+o2=c7h13-35+ho2 2.200e+12 0.000 37220.0 !C7-6 c7h14-3+o2=c7h13-36+ho2 4.000e+13 0.000 50160.0 !C7-6 c7h14-3+o2=c7h13-37+ho2 6.000e+13 0.000 52800.0 !C7-6 ! c7h14-3+o=c7h13-31+oh 1.046e+06 2.420 04766.0 !C7-6 c7h14-3+o=c7h13-24+oh 6.600e+05 2.430 01210.0 !C7-6 c7h14-3+o=c7h13-33+oh 6.030E+10 0.700 07632.0 !C7-6 c7h14-3+o=c7h13-34+oh 6.030E+10 0.700 07632.0 !C7-6 c7h14-3+o=c7h13-35+oh 6.600e+05 2.430 01210.0 !C7-6 c7h14-3+o=c7h13-36+oh 5.946e+05 2.440 02846.0 !C7-6 c7h14-3+o=c7h13-37+oh 1.046e+06 2.420 04766.0 !C7-6 ! c7h14-3+ch3=c7h13-31+ch4 4.520e-01 3.650 07154.0 !C7-6 c7h14-3+ch3=c7h13-24+ch4 3.690e+00 3.310 04002.0 !C7-6 c7h14-3+ch3=c7h13-33+ch4 8.400E-01 3.500 11660.0 !C7-6 c7h14-3+ch3=c7h13-34+ch4 8.400E-01 3.500 11660.0 !C7-6 c7h14-3+ch3=c7h13-35+ch4 3.690e+00 3.310 04002.0 !C7-6 c7h14-3+ch3=c7h13-36+ch4 8.400e+04 2.130 07574.0 !C7-6 c7h14-3+ch3=c7h13-37+ch4 4.520e-01 3.650 07154.0 !C7-6 ! c7h14-3+ch3o=c7h13-31+ch3oh 1.500e+10 0.000 07000.0 !C7-6 c7h14-3+ch3o=c7h13-24+ch3oh 4.000e+01 2.900 08609.0 !C7-6 !c7h14-3+ch3o=c7h13-33+ch3oh !c7h14-3+ch3o=c7h13-34+ch3oh c7h14-3+ch3o=c7h13-35+ch3oh 4.000e+01 2.900 08609.0 !C7-6 c7h14-3+ch3o=c7h13-36+ch3oh 1.100e+11 0.000 05000.0 !C7-6 c7h14-3+ch3o=c7h13-37+ch3oh 1.500e+10 0.000 07000.0 !C7-6 ! c7h14-3+ch3o2=c7h13-31+ch3o2h 4.050e+04 2.500 16690.0 !C7-6 c7h14-3+ch3o2=c7h13-24+ch3o2h 4.820e+03 2.550 10530.0 !C7-6 c7h14-3+ch3o2=c7h13-33+ch3o2h 3.000e+09 0.000 09930.0 !C7-6 c7h14-3+ch3o2=c7h13-34+ch3o2h 3.000e+09 0.000 09930.0 !C7-6 c7h14-3+ch3o2=c7h13-35+ch3o2h 4.820e+03 2.550 10530.0 !C7-6 c7h14-3+ch3o2=c7h13-36+ch3o2h 5.880e+04 2.500 14860.0 !C7-6 c7h14-3+ch3o2=c7h13-37+ch3o2h 4.050e+04 2.500 16690.0 !C7-6 ! c7h14-3+c2h3=c7h13-31+c2h4 5.000e+11 0.000 18000.0 !C7-6 c7h14-3+c2h3=c7h13-24+c2h4 2.211E+00 3.500 04690.0 !C7-6 c7h14-3+c2h3=c7h13-33+c2h4 8.401e-01 3.500 09680.0 !C7-6 c7h14-3+c2h3=c7h13-34+c2h4 8.401e-01 3.500 09680.0 !C7-6 c7h14-3+c2h3=c7h13-35+c2h4 2.211E+00 3.500 04690.0 !C7-6 c7h14-3+c2h3=c7h13-36+c2h4 4.000e+11 0.000 16800.0 !C7-6 c7h14-3+c2h3=c7h13-37+c2h4 5.000e+11 0.000 18000.0 !C7-6 ! c7h14-3+c2h5=c7h13-31+c2h6 5.000e+10 0.000 13400.0 !C7-6 c7h14-3+c2h5=c7h13-24+c2h6 1.000e+11 0.000 09800.0 !C7-6 !c7h14-3+c2h5=c7h13-33+c2h6 !c7h14-3+c2h5=c7h13-34+c2h6 c7h14-3+c2h5=c7h13-35+c2h6 1.000e+11 0.000 09800.0 !C7-6 c7h14-3+c2h5=c7h13-36+c2h6 5.000e+10 0.000 10400.0 !C7-6 c7h14-3+c2h5=c7h13-37+c2h6 5.000e+10 0.000 13400.0 !C7-6 ! ! !C7-7/Additions c7h14-1+oh=c7h14oh2j1 1.129e+05 2.280 -1241.0 !C7-7 Zhu et al., 2005 c2h4+oh A/2 c7h14-1+oh=c7h14oh1j2 1.129e+05 2.280 -1241.0 !C7-7 Zhu et al., 2005 c2h4+oh A/2 c7h14-2+oh=c7h14oh2j3 1.129e+05 2.280 -1241.0 !C7-7 Zhu et al., 2005 c2h4+oh A/2 c7h14-2+oh=c7h14oh3j2 1.129e+05 2.280 -1241.0 !C7-7 Zhu et al., 2005 c2h4+oh A/2 c7h14-3+oh=c7h14oh3j4 1.129e+05 2.280 -1241.0 !C7-7 Zhu et al., 2005 c2h4+oh A/2 c7h14-3+oh=c7h14oh4j3 1.129e+05 2.280 -1241.0 !C7-7 Zhu et al., 2005 c2h4+oh A/2 ! c7h14oh1j2=c7h15o-1 3.695e+14 0.000 42070.0 !C7-5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 c7h14oh2j1=c7h15o-2 3.695e+14 0.000 42070.0 !C7-5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 c7h14oh2j3=c7h15o-2 3.695e+14 0.000 42070.0 !C7-5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 c7h14oh3j2=c7h15o-3 3.695e+14 0.000 42070.0 !C7-5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 c7h14oh3j4=c7h15o-3 3.695e+14 0.000 42070.0 !C7-5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 c7h14oh4j3=c7h15o-4 3.695e+14 0.000 42070.0 !C7-5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 ! c7h14-1+oh=c7h13oh1d1+h 3.041e+07 1.380 01615.0 !C7-3 Zhu et al., 2005 c2h4+oh A/2 c7h14-1+oh=c7h13oh2d1+h 3.041e+07 1.380 01615.0 !C7-3 Zhu et al., 2005 c2h4+oh A/2 c7h14-2+oh=c7h13oh2d2+h 3.041e+07 1.380 01615.0 !C7-3 Zhu et al., 2005 c2h4+oh A/2 c7h14-2+oh=c7h13oh3d2+h 3.041e+07 1.380 01615.0 !C7-3 Zhu et al., 2005 c2h4+oh A/2 c7h14-3+oh=c7h13oh3d3+h 3.041e+07 1.380 01615.0 !C7-3 Zhu et al., 2005 c2h4+oh A/2 c7h14-3+oh=c7h13oh4d3+h 3.041e+07 1.380 01615.0 !C7-3 Zhu et al., 2005 c2h4+oh A/2 ! c6h13-1+ch2o=c7h15o-1 5.000e+10 0.000 03457.0 !C7-3 Curran, 2006 nc3h7+ch2o c6h13cho+h=c7h15o-1 4.000e+12 0.000 06260.0 !C7-3 Curran, 2006 ch3cho+h ch3+c5h11cho=c7h15o-2 5.000e+10 0.000 09043.0 !C7-3 Curran, 2006 c2h5cho+ch3 c5h11-1+ch3cho=c7h15o-2 3.330e+10 0.000 06397.0 !C7-3 Curran, 2006 c2h5+ch3cho c5h11coch3+h=c7h15o-2 2.000e+12 0.000 07270.0 !C7-3 Curran, 2006 ch3coch3+h c2h5+c4h9cho=c7h15o-3 3.330e+10 0.000 06397.0 !C7-3 Curran, 2006 c2h5+ch3cho pc4h9+c2h5cho=c7h15o-3 3.330e+10 0.000 06397.0 !C7-3 Curran, 2006 c2h5+ch3cho h+c4h9coc2h5=c7h15o-3 2.000e+12 0.000 07270.0 !C7-3 Curran, 2006 ch3coch3+h nc3h7+c3h7cho=c7h15o-4 3.330e+10 0.000 06397.0 !C7-3 Curran, 2006 c2h5+ch3cho h+c3h7coc3h7=c7h15o-4 2.000e+12 0.000 07270.0 !C7-3 Curran, 2006 ch3coch3+h ! pc4h9+c3h5oh1d2=c7h14oh1j2 8.800e+03 2.480 06130.0 !C7-3 Curran, 2006 c3h6+c2h5=c5h11-2 c5h11-1+c2h3oh=c7h14oh2j1 8.800e+03 2.480 06130.0 !C7-3 Curran, 2006 c3h6+c2h5=c5h11-2 nc3h7+c2h3chohch3=c7h14oh2j3 8.800e+03 2.480 06130.0 !C7-3 Curran, 2006 c3h6+c2h5=c5h11-2 pc4h9+ch3c2h2oh=c7h14oh3j2 8.800e+03 2.480 06130.0 !C7-3 Curran, 2006 c3h6+c2h5=c5h11-2 c2h5+c2h3chohc2h5=c7h14oh3j4 8.800e+03 2.480 06130.0 !C7-3 Curran, 2006 c3h6+c2h5=c5h11-2 c2h5+c3h7c2h2oh=c7h14oh3j4 8.800e+03 2.480 06130.0 !C7-3 Curran, 2006 c3h6+c2h5=c5h11-2 nc3h7+c2h5c2h2oh=c7h14oh4j3 8.800e+03 2.480 06130.0 !C7-3 Curran, 2006 c3h6+c2h5=c5h11-2 ch3+c2h3chohc3h7=c7h14oh4j3 1.760E+04 2.480 06130.0 !C7-3 Curran, 2006 c3h6+ch3=sc4h9 ! ! !C7-8/Decomposiitons and isomerizations c2h2+c5h11-1=c7h13-11 8.800e+03 2.480 06130.0 !C7-8 h+c7h12-1=c7h13-11 2.500e+11 0.510 02620.0 !C7-8 c3h4-a+pc4h9=c7h13-12 8.800e+03 2.480 06130.0 !C7-8 h+c7h12-1=c7h13-12 4.240E+11 0.510 01230.0 !C7-8 h+c7h12-12=c7h13-12 2.500e+11 0.510 02620.0 !C7-8 h+c7h12-13=c7h13-13 2.500e+11 0.510 02620.0 !C7-8 nc3h7+c4h6=c7h13-13 1.760e+04 2.480 06130.0 !C7-8 A*2 h+c7h12-13=c7h13-14 2.500e+11 0.510 02620.0 !C7-8 h+c7h12-14=c7h13-14 2.500e+11 0.510 02620.0 !C7-8 c2h3+c5h10-1=c7h13-14 2.000E+11 0.000 02007.0 !C7-8 Weissman et Benson, 1984 c2h5+c5h8-14=c7h13-14 8.800e+03 2.480 06130.0 !C7-8 h+c7h12-14=c7h13-15 2.500e+11 0.510 02620.0 !C7-8 h+c7h12-15=c7h13-15 2.500e+11 0.510 02620.0 !C7-8 c7h13-15=c3h5-a+c4h8-1 3.310e+13 0.000 21460.0 !C7-8 gierczak et al., 1986 ch3+c6h10-15=c7h13-15 8.800e+03 2.480 06130.0 !C7-8 h+c7h12-15=c7h13-16 2.500e+11 0.510 02620.0 !C7-8 h+c7h12-16=c7h13-16 8.480e+11 0.510 01230.0 !C7-8 A*2 c4h7-14+c3h6=c7h13-16 8.800e+03 2.480 06130.0 !C7-8 h+c7h12-16=c7h13-17 5.000e+11 0.510 02620.0 !C7-8 A*2 c5h9-15+c2h4=c7h13-17 8.800e+03 2.480 06130.0 !C7-8 ! h+c7h12-12=c7h13-22 4.240E+11 0.510 01230.0 !C7-8 h+c7h12-2=c7h13-22 2.500e+11 0.510 02620.0 !C7-8 c3h4-p+pc4h9=c7h13-22 8.800e+03 2.480 06130.0 !C7-8 h+c7h12-2=c7h13-23 2.500e+11 0.510 02620.0 !C7-8 h+c7h12-23=c7h13-23 2.500e+11 0.510 02620.0 !C7-8 nc3h7+c4h6-12=c7h13-23 8.800e+03 2.480 06130.0 !C7-8 ch3+c6h10-1=c7h13-23 1.760E+04 2.480 06130.0 !C7-8 h+c7h12-23=c7h13-24 2.500e+11 0.510 02620.0 !C7-8 h+c7h12-24=c7h13-24 2.500e+11 0.510 02620.0 !C7-8 h+c7h12-13=c7h13-24 2.500e+11 0.510 02620.0 !C7-8 c2h5+c5h8-13=c7h13-24 8.800e+03 2.480 06130.0 !C7-8 h+c7h12-24=c7h13-25 2.500e+11 0.510 02620.0 !C7-8 h+c7h12-25=c7h13-25 5.000e+11 0.510 02620.0 !C7-8 A*2 c3h5-s+c4h8-1=c7h13-25 8.800e+03 2.480 06130.0 !C7-8 ch3+c6h10-14=c7h13-25 1.760E+04 2.480 06130.0 !C7-8 h+c7h12-25=c7h13-26 5.000e+11 0.510 02620.0 !C7-8 A*2 h+c7h12-15=c7h13-26 4.240E+11 0.510 01230.0 !C7-8 c3h6+c4h7-13=c7h13-26 8.800e+03 2.480 06130.0 !C7-8 h+c7h12-15=c7h13-27 2.500e+11 0.510 02620.0 !C7-8 c2h4+c5h9-25=c7h13-27 1.760e+04 2.480 06130.0 !C7-8 A*2 ! h+c7h12-13=c7h13-31 2.500e+11 0.510 02620.0 !C7-8 c2h4+c5h9-11=c7h13-31 1.760e+04 2.480 06130.0 !C7-8 A*2 h+c7h12-23=c7h13-33 2.500e+11 0.510 02620.0 !C7-8 h+c7h12-3=c7h13-33 2.500e+11 0.510 02620.0 !C7-8 ch3+c6h10-12=c7h13-33 1.760E+04 2.480 06130.0 !C7-8 c4h6-1+nc3h7=c7h13-33 8.800e+03 2.480 06130.0 !C7-8 h+c7h12-3=c7h13-34 2.500e+11 0.510 02620.0 !C7-8 h+c7h12-34=c7h13-34 5.000e+11 0.510 02620.0 !C7-8 A*2 c2h5+c5h8-1=c7h13-34 8.800e+03 2.480 06130.0 !C7-8 c2h5+c5h8-12=c7h13-34 8.800e+03 2.480 06130.0 !C7-8 h+c7h12-24=c7h13-35 2.500e+11 0.510 02620.0 !C7-8 h+c7h12-34=c7h13-35 5.000e+11 0.510 02620.0 !C7-8 A*2 ch3+c6h10-13=c7h13-35 1.760E+04 2.480 06130.0 !C7-8 h+c7h12-14=c7h13-36 4.240E+11 0.510 01230.0 !C7-8 h+c7h12-24=c7h13-36 2.500e+11 0.510 02620.0 !C7-8 c3h6+c4h7-11=c7h13-36 8.800e+03 2.480 06130.0 !C7-8 h+c7h12-14=c7h13-37 2.500e+11 0.510 02620.0 !C7-8 c2h4+c5h9-13=c7h13-37 1.760e+04 2.480 06130.0 !C7-8 A*2 ! !Isomerizations c7h13-11=c7h13-13 3.800E+10 0.670 38700.0 !C7-8 Matheu et al., 2002 c7h13-12=c7h13-13 3.560E+10 0.880 41000.0 !C7-8 correlation from 12pp, 13pp and 13va c7h13-14=c7h13-13 3.560e+10 0.880 31500.0 !C7-8 Matheu et al., 2003 1,2 h-shift s->a c7h13-15=c7h13-13 3.800e+10 0.670 30600.0 !C7-8 1,3 h-shift s->a correlation from 1,2 h-shift s->s & s->a c7h13-16=c7h13-13 7.850e+11 -0.120 15900.0 !C7-8 1,4 h-shift s->a correlation from 1,2 h-shift s->s & s->a c7h13-17=c7h13-13 3.670e+12 -0.600 04900.0 !C7-8 1,5 h-shift p->a correlation from 1,2 h-shift p->s & p->a c7h13-14=c7h13-15 3.560e+10 0.880 39100.0 !C7-8 Matheu et al., 2003 1,2 h-shift s->s c7h13-14=c7h13-16 3.800e+10 0.670 38200.0 !C7-8 Matheu et al., 2003 1,3 h-shift s->s c7h13-17=c7h13-14 7.850e+11 -0.120 20600.0 !C7-8 Matheu et al., 2003 1,4 h-shift p->s c7h13-15=c7h13-16 3.560e+10 0.880 39100.0 !C7-8 Matheu et al., 2003 1,2 h-shift s->s c7h13-17=c7h13-15 3.800e+10 0.670 36600.0 !C7-8 Matheu et al., 2003 1,3 h-shift p->s c7h13-17=c7h13-16 3.560e+10 0.880 37300.0 !C7-8 Matheu et al., 2003 1,2 h-shift p->s ! c7h13-22=c7h13-13 3.560E+10 0.880 41000.0 !C7-8 correlation from 12pp, 13pp and 13va c7h13-23=c7h13-13 3.800E+10 0.670 38700.0 !C7-8 Matheu et al., 2002 c7h13-22=c7h13-24 3.800E+10 0.670 38700.0 !C7-8 Matheu et al., 2002 c7h13-23=c7h13-24 3.560E+10 0.880 41000.0 !C7-8 correlation from 12pp, 13pp and 13va c7h13-25=c7h13-24 3.560e+10 0.880 31500.0 !C7-8 Matheu et al., 2003 1,2 h-shift s->a c7h13-26=c7h13-24 3.800e+10 0.670 30600.0 !C7-8 1,3 h-shift s->a correlation from 1,2 h-shift s->s & s->a c7h13-27=c7h13-24 3.670E+12 -0.600 15300.0 !C7-8 Matheu et al., 2002 c7h13-25=c7h13-26 3.560e+10 0.880 39100.0 !C7-8 Matheu et al., 2003 1,2 h-shift s->s c7h13-27=c7h13-25 3.800e+10 0.670 36600.0 !C7-8 Matheu et al., 2003 1,3 h-shift p->s c7h13-27=c7h13-26 3.560e+10 0.880 37300.0 !C7-8 Matheu et al., 2003 1,2 h-shift p->s ! c7h13-31=c7h13-24 3.560E+10 0.880 29600.0 !C7-8 Matheu et al., 2002 c7h13-33=c7h13-24 3.560E+10 0.880 41000.0 !C7-8 correlation from 12pp, 13pp and 13va c7h13-34=c7h13-24 3.800E+10 0.670 38700.0 !C7-8 Matheu et al., 2002 c7h13-33=c7h13-35 3.800E+10 0.670 38700.0 !C7-8 Matheu et al., 2002 c7h13-34=c7h13-35 3.560E+10 0.880 41000.0 !C7-8 correlation from 12pp, 13pp and 13va c7h13-36=c7h13-35 3.560e+10 0.880 31500.0 !C7-8 Matheu et al., 2003 1,2 h-shift s->a c7h13-37=c7h13-35 3.800E+10 0.670 28400.0 !C7-8 correlation c7h13-37=c7h13-36 3.560e+10 0.880 37300.0 !C7-8 Matheu et al., 2003 1,2 h-shift p->s ! ! !C7-9/Unimolecular Initiations and Molecular Decompositions c7h14-1=c3h5-a+pc4h9 2.500E+16 0.000 71000.0 !C7-9 Edelson et Allara, 1980 c7h13-13+h=c7h14-1 1.000E+14 0.000 00000.0 !C7-9 c7h14-2=c4h7-13+nc3h7 2.500E+16 0.000 71000.0 !C7-9 Edelson et Allara, 1980 c7h13-13+h=c7h14-2 1.000E+14 0.000 00000.0 !C7-9 c7h13-24+h=c7h14-2 1.000E+14 0.000 00000.0 !C7-9 c7h14-3=ch3+c6h11-13 2.500E+16 0.000 71000.0 !C7-9 Edelson et Allara, 1980 c7h14-3=c2h5+c5h9-13 2.500E+16 0.000 71000.0 !C7-9 Edelson et Allara, 1980 c7h13-35+h=c7h14-3 1.000E+14 0.000 00000.0 !C7-9 c7h13-24+h=c7h14-3 1.000E+14 0.000 00000.0 !C7-9 ! !Retroene c7h14-1=c3h6+c4h8-1 3.980e+12 0.000 57630.0 !C7-9 King, 1979 c7h14-2=c4h8-1+c3h6 3.980e+12 0.000 57630.0 !C7-9 King, 1979 ! ! !C7-10/First Addition to o2 c7h15-1+o2=c7h15o2-1 4.520e+12 0.000 00000.0 !C7-10 c7h15-2+o2=c7h15o2-2 7.540e+12 0.000 00000.0 !C7-10 c7h15-3+o2=c7h15o2-3 7.540e+12 0.000 00000.0 !C7-10 c7h15-4+o2=c7h15o2-4 7.540e+12 0.000 00000.0 !C7-10 ! ! !C7-11/R+R'O2=RO+R'O md10o2+c7h15-2=md10o+c7h15o-2 7.000E+12 0.000 -01000.0 !C7-11 md9o2+c7h15-2=md9o+c7h15o-2 7.000E+12 0.000 -01000.0 !C7-11 md8o2+c7h15-2=md8o+c7h15o-2 7.000E+12 0.000 -01000.0 !C7-11 md7o2+c7h15-2=md7o+c7h15o-2 7.000E+12 0.000 -01000.0 !C7-11 md6o2+c7h15-2=md6o+c7h15o-2 7.000E+12 0.000 -01000.0 !C7-11 md5o2+c7h15-2=md5o+c7h15o-2 7.000E+12 0.000 -01000.0 !C7-11 md4o2+c7h15-2=md4o+c7h15o-2 7.000E+12 0.000 -01000.0 !C7-11 md3o2+c7h15-2=md3o+c7h15o-2 7.000E+12 0.000 -01000.0 !C7-11 md2o2+c7h15-2=md2o+c7h15o-2 7.000E+12 0.000 -01000.0 !C7-11 mdmo2+c7h15-2=mdmo+c7h15o-2 7.000E+12 0.000 -01000.0 !C7-11 ! md10o2+c7h15-3=md10o+c7h15o-3 7.000E+12 0.000 -01000.0 !C7-11 md9o2+c7h15-3=md9o+c7h15o-3 7.000E+12 0.000 -01000.0 !C7-11 md8o2+c7h15-3=md8o+c7h15o-3 7.000E+12 0.000 -01000.0 !C7-11 md7o2+c7h15-3=md7o+c7h15o-3 7.000E+12 0.000 -01000.0 !C7-11 md6o2+c7h15-3=md6o+c7h15o-3 7.000E+12 0.000 -01000.0 !C7-11 md5o2+c7h15-3=md5o+c7h15o-3 7.000E+12 0.000 -01000.0 !C7-11 md4o2+c7h15-3=md4o+c7h15o-3 7.000E+12 0.000 -01000.0 !C7-11 md3o2+c7h15-3=md3o+c7h15o-3 7.000E+12 0.000 -01000.0 !C7-11 md2o2+c7h15-3=md2o+c7h15o-3 7.000E+12 0.000 -01000.0 !C7-11 mdmo2+c7h15-3=mdmo+c7h15o-3 7.000E+12 0.000 -01000.0 !C7-11 ! md10o2+c7h15-4=md10o+c7h15o-4 7.000E+12 0.000 -01000.0 !C7-11 md9o2+c7h15-4=md9o+c7h15o-4 7.000E+12 0.000 -01000.0 !C7-11 md8o2+c7h15-4=md8o+c7h15o-4 7.000E+12 0.000 -01000.0 !C7-11 md7o2+c7h15-4=md7o+c7h15o-4 7.000E+12 0.000 -01000.0 !C7-11 md6o2+c7h15-4=md6o+c7h15o-4 7.000E+12 0.000 -01000.0 !C7-11 md5o2+c7h15-4=md5o+c7h15o-4 7.000E+12 0.000 -01000.0 !C7-11 md4o2+c7h15-4=md4o+c7h15o-4 7.000E+12 0.000 -01000.0 !C7-11 md3o2+c7h15-4=md3o+c7h15o-4 7.000E+12 0.000 -01000.0 !C7-11 md2o2+c7h15-4=md2o+c7h15o-4 7.000E+12 0.000 -01000.0 !C7-11 mdmo2+c7h15-4=mdmo+c7h15o-4 7.000E+12 0.000 -01000.0 !C7-11 ! c7h15o2-1+md10j=c7h15o-1+md10o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-1+md9j=c7h15o-1+md9o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-1+md8j=c7h15o-1+md8o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-1+md7j=c7h15o-1+md7o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-1+md6j=c7h15o-1+md6o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-1+md5j=c7h15o-1+md5o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-1+md4j=c7h15o-1+md4o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-1+md3j=c7h15o-1+md3o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-1+md2j=c7h15o-1+md2o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-1+mdmj=c7h15o-1+mdmo 7.000E+12 0.000 -01000.0 !C7-11 ! c7h15o2-2+md10j=c7h15o-2+md10o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-2+md9j=c7h15o-2+md9o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-2+md8j=c7h15o-2+md8o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-2+md7j=c7h15o-2+md7o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-2+md6j=c7h15o-2+md6o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-2+md5j=c7h15o-2+md5o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-2+md4j=c7h15o-2+md4o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-2+md3j=c7h15o-2+md3o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-2+md2j=c7h15o-2+md2o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-2+mdmj=c7h15o-2+mdmo 7.000E+12 0.000 -01000.0 !C7-11 ! c7h15o2-3+md10j=c7h15o-3+md10o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-3+md9j=c7h15o-3+md9o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-3+md8j=c7h15o-3+md8o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-3+md7j=c7h15o-3+md7o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-3+md6j=c7h15o-3+md6o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-3+md5j=c7h15o-3+md5o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-3+md4j=c7h15o-3+md4o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-3+md3j=c7h15o-3+md3o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-3+md2j=c7h15o-3+md2o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-3+mdmj=c7h15o-3+mdmo 7.000E+12 0.000 -01000.0 !C7-11 ! c7h15o2-4+md10j=c7h15o-4+md10o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-4+md9j=c7h15o-4+md9o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-4+md8j=c7h15o-4+md8o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-4+md7j=c7h15o-4+md7o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-4+md6j=c7h15o-4+md6o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-4+md5j=c7h15o-4+md5o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-4+md4j=c7h15o-4+md4o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-4+md3j=c7h15o-4+md3o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-4+md2j=c7h15o-4+md2o 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-4+mdmj=c7h15o-4+mdmo 7.000E+12 0.000 -01000.0 !C7-11 ! c7h15o2-1+c7h15-1=c7h15o-1+c7h15o-1 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-1+c7h15-2=c7h15o-1+c7h15o-2 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-1+c7h15-3=c7h15o-1+c7h15o-3 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-1+c7h15-4=c7h15o-1+c7h15o-4 7.000E+12 0.000 -01000.0 !C7-11 ! c7h15o2-2+c7h15-1=c7h15o-2+c7h15o-1 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-2+c7h15-2=c7h15o-2+c7h15o-2 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-2+c7h15-3=c7h15o-2+c7h15o-3 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-2+c7h15-4=c7h15o-2+c7h15o-4 7.000E+12 0.000 -01000.0 !C7-11 ! c7h15o2-3+c7h15-1=c7h15o-3+c7h15o-1 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-3+c7h15-2=c7h15o-3+c7h15o-2 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-3+c7h15-3=c7h15o-3+c7h15o-3 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-3+c7h15-4=c7h15o-3+c7h15o-4 7.000E+12 0.000 -01000.0 !C7-11 ! c7h15o2-4+c7h15-1=c7h15o-4+c7h15o-1 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-4+c7h15-2=c7h15o-4+c7h15o-2 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-4+c7h15-3=c7h15o-4+c7h15o-3 7.000E+12 0.000 -01000.0 !C7-11 c7h15o2-4+c7h15-4=c7h15o-4+c7h15o-4 7.000E+12 0.000 -01000.0 !C7-11 ! ! !C7-11b/RO2+H=ROOH c7h15o2-1+h=c7h15o2h1 1.000E+14 0.000 00000.0 !C7-11b c7h15o2-2+h=c7h15o2h2 1.000E+14 0.000 00000.0 !C7-11b c7h15o2-3+h=c7h15o2h3 1.000E+14 0.000 00000.0 !C7-11b c7h15o2-4+h=c7h15o2h4 1.000E+14 0.000 00000.0 !C7-11b ! ! !C7-12-I/Isomerization to QOOH c7h15o2-1=c7h14ooh1-2 2.000e+11 0.000 26850.0 !C7-12-I 5s c7h15o2-1=c7h14ooh1-3 2.500e+10 0.000 20850.0 !C7-12-I 6s c7h15o2-1=c7h14ooh1-4 3.125e+09 0.000 19050.0 !C7-12-I 7s c7h15o2-1=c7h14ooh1-5 3.912e+08 0.000 22050.0 !C7-12-I 8s c7h15o2-2=c7h14ooh2-1 3.000e+11 0.000 29400.0 !C7-12-I 5p c7h15o2-2=c7h14ooh2-3 2.000e+11 0.000 26850.0 !C7-12-I 5s c7h15o2-2=c7h14ooh2-4 2.500e+10 0.000 20850.0 !C7-12-I 6s c7h15o2-2=c7h14ooh2-5 3.125e+09 0.000 19050.0 !C7-12-I 7s c7h15o2-2=c7h14ooh2-6 3.912e+08 0.000 22050.0 !C7-12-I 8s c7h15o2-3=c7h14ooh3-1 3.750e+10 0.000 24400.0 !C7-12-I 6p c7h15o2-3=c7h14ooh3-2 2.000e+11 0.000 26850.0 !C7-12-I 5s c7h15o2-3=c7h14ooh3-4 2.000e+11 0.000 26850.0 !C7-12-I 5s c7h15o2-3=c7h14ooh3-5 2.500e+10 0.000 20850.0 !C7-12-I 6s c7h15o2-3=c7h14ooh3-6 3.125e+09 0.000 19050.0 !C7-12-I 7s c7h15o2-3=c7h14ooh3-7 5.860e+08 0.000 25550.0 !C7-12-I 8p c7h15o2-4=c7h14ooh4-1 9.376e+09 0.000 22350.0 !C7-12-I 7p c7h15o2-4=c7h14ooh4-2 5.000e+10 0.000 20850.0 !C7-12-I 6s c7h15o2-4=c7h14ooh4-3 4.000e+11 0.000 26850.0 !C7-12-I 5s ! ! !C7-12-II/RO2=olefin+HO2 c7h15o2-1=c7h14-1+ho2 3.780e+07 1.510 29640.0 !C7-12-II c7h15o2-2=c7h14-1+ho2 4.680e+09 1.160 30870.0 !C7-12-II c7h15o2-2=c7h14-2+ho2 3.780e+07 1.510 29640.0 !C7-12-II c7h15o2-3=c7h14-2+ho2 3.780e+07 1.510 29640.0 !C7-12-II c7h15o2-3=c7h14-3+ho2 3.780e+07 1.510 29640.0 !C7-12-II c7h15o2-4=c7h14-3+ho2 7.560e+07 1.510 29640.0 !C7-12-II ! ! !C7-12-III/RO2=aldehyde+OH c7h15o2-1=c6h13cho+oh 1.320e+09 1.370 41590.0 !C7-12-III Sheng et al., 2002 c7h15o2-2=c5h11coch3+oh 1.320e+09 1.370 41590.0 !C7-12-III Sheng et al., 2002 c7h15o2-3=c4h9coc2h5+oh 1.320e+09 1.370 41590.0 !C7-12-III Sheng et al., 2002 c7h15o2-4=c3h7coc3h7+oh 1.320e+09 1.370 41590.0 !C7-12-III Sheng et al., 2002 ! ! !C7-13/RO2+HO2=ROOH+O2 c7h15o2-1+ho2=c7h15ooh-1+o2 1.750E+11 0.000 01710.0 !C7-13 !Lightfoot et al., 1991 c7h15o2-2+ho2=c7h15ooh-2+o2 1.750E+11 0.000 01710.0 !C7-13 !Lightfoot et al., 1991 c7h15o2-3+ho2=c7h15ooh-3+o2 1.750E+11 0.000 01710.0 !C7-13 !Lightfoot et al., 1991 c7h15o2-4+ho2=c7h15ooh-4+o2 1.750E+11 0.000 01710.0 !C7-13 !Lightfoot et al., 1991 ! ! !C7-14/RO2+H2O2=ROOH+HO2 c7h15o2-1+h2o2=c7h15ooh-1+ho2 2.410E+12 0.000 09940.0 !C7-14 !Tsang and Hampson, 1986 c7h15o2-2+h2o2=c7h15ooh-2+ho2 2.410E+12 0.000 09940.0 !C7-14 !Tsang and Hampson, 1986 c7h15o2-3+h2o2=c7h15ooh-3+ho2 2.410E+12 0.000 09940.0 !C7-14 !Tsang and Hampson, 1986 c7h15o2-4+h2o2=c7h15ooh-4+ho2 2.410E+12 0.000 09940.0 !C7-14 !Tsang and Hampson, 1986 ! ! !C7-15/RO2+CH3O2=RO+CH3O+O2 c7h15o2-1+ch3o2=c7h15o-1+ch3o+o2 1.400E+16 -1.610 01860.0 !C7-15 c7h15o2-2+ch3o2=c7h15o-2+ch3o+o2 1.400E+16 -1.610 01860.0 !C7-15 c7h15o2-3+ch3o2=c7h15o-3+ch3o+o2 1.400E+16 -1.610 01860.0 !C7-15 c7h15o2-4+ch3o2=c7h15o-4+ch3o+o2 1.400E+16 -1.610 01860.0 !C7-15 ! ! !C7-16/RO2+R'O2=RO+R'O+O2 !c7h15o2-1+md10o2=c7h15o-1+md10o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-2+md10o2=c7h15o-2+md10o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-3+md10o2=c7h15o-2+md10o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-4+md10o2=c7h15o-2+md10o+o2 1.400E+16 -1.610 01860.0 !C7-16 !c7h15o2-1+md9o2=c7h15o-1+md9o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-2+md9o2=c7h15o-2+md9o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-3+md9o2=c7h15o-2+md9o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-4+md9o2=c7h15o-2+md9o+o2 1.400E+16 -1.610 01860.0 !C7-16 !c7h15o2-1+md8o2=c7h15o-1+md8o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-2+md8o2=c7h15o-2+md8o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-3+md8o2=c7h15o-2+md8o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-4+md8o2=c7h15o-2+md8o+o2 1.400E+16 -1.610 01860.0 !C7-16 !c7h15o2-1+md7o2=c7h15o-1+md7o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-2+md7o2=c7h15o-2+md7o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-3+md7o2=c7h15o-2+md7o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-4+md7o2=c7h15o-2+md7o+o2 1.400E+16 -1.610 01860.0 !C7-16 !c7h15o2-1+md6o2=c7h15o-1+md6o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-2+md6o2=c7h15o-2+md6o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-3+md6o2=c7h15o-2+md6o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-4+md6o2=c7h15o-2+md6o+o2 1.400E+16 -1.610 01860.0 !C7-16 !c7h15o2-1+md5o2=c7h15o-1+md5o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-2+md5o2=c7h15o-2+md5o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-3+md5o2=c7h15o-2+md5o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-4+md5o2=c7h15o-2+md5o+o2 1.400E+16 -1.610 01860.0 !C7-16 !c7h15o2-1+md4o2=c7h15o-1+md4o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-2+md4o2=c7h15o-2+md4o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-3+md4o2=c7h15o-2+md4o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-4+md4o2=c7h15o-2+md4o+o2 1.400E+16 -1.610 01860.0 !C7-16 !c7h15o2-1+md3o2=c7h15o-1+md3o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-2+md3o2=c7h15o-2+md3o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-3+md3o2=c7h15o-2+md3o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-4+md3o2=c7h15o-2+md3o+o2 1.400E+16 -1.610 01860.0 !C7-16 !c7h15o2-1+md2o2=c7h15o-1+md2o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-2+md2o2=c7h15o-2+md2o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-3+md2o2=c7h15o-2+md2o+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-4+md2o2=c7h15o-2+md2o+o2 1.400E+16 -1.610 01860.0 !C7-16 !c7h15o2-1+mdmo2=c7h15o-1+mdmo+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-2+mdmo2=c7h15o-2+mdmo+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-3+mdmo2=c7h15o-2+mdmo+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-4+mdmo2=c7h15o-2+mdmo+o2 1.400E+16 -1.610 01860.0 !C7-16 c7h15o2-1+c7h15o2-1=c7h15o-1+c7h15o-1+o2 1.400E+16 -1.610 01860.0 !C7-0b16 c7h15o2-1+c7h15o2-2=c7h15o-1+c7h15o-2+o2 1.400E+16 -1.610 01860.0 !C7-0b16 c7h15o2-1+c7h15o2-3=c7h15o-1+c7h15o-3+o2 1.400E+16 -1.610 01860.0 !C7-0b16 c7h15o2-1+c7h15o2-4=c7h15o-1+c7h15o-4+o2 1.400E+16 -1.610 01860.0 !C7-0b16 c7h15o2-2+c7h15o2-2=c7h15o-2+c7h15o-2+o2 1.400E+16 -1.610 01860.0 !C7-0b16 c7h15o2-2+c7h15o2-3=c7h15o-2+c7h15o-3+o2 1.400E+16 -1.610 01860.0 !C7-0b16 c7h15o2-2+c7h15o2-4=c7h15o-2+c7h15o-4+o2 1.400E+16 -1.610 01860.0 !C7-0b16 c7h15o2-3+c7h15o2-3=c7h15o-3+c7h15o-3+o2 1.400E+16 -1.610 01860.0 !C7-0b16 c7h15o2-3+c7h15o2-4=c7h15o-3+c7h15o-4+o2 1.400E+16 -1.610 01860.0 !C7-0b16 c7h15o2-4+c7h15o2-4=c7h15o-4+c7h15o-4+o2 1.400E+16 -1.610 01860.0 !C7-0b16 ! ! !C7-17/ROOH=RO+OH c7h15ooh-1=oh+c7h15o-1 6.310E+14 0.000 42330.0 !C7-17 Lightfoot et al., 1991 c7h15ooh-2=oh+c7h15o-2 6.310E+14 0.000 42330.0 !C7-17 Lightfoot et al., 1991 c7h15ooh-3=oh+c7h15o-3 6.310E+14 0.000 42330.0 !C7-17 Lightfoot et al., 1991 c7h15ooh-4=oh+c7h15o-4 6.310E+14 0.000 42330.0 !C7-17 Lightfoot et al., 1991 ! ! !C7-18/RO decomposition !c2h5+c4h9cho=c7h15o-3 3.330E+10 0.000 06397.0 !C7-18 Curran, 2006 c2h5+ch3cho !h+c4h9coc2h5=c7h15o-3 2.000E+12 0.000 07270.0 !C7-18 Curran, 2006 ch3coch3+h !pc4h9+c2h5cho=c7h15o-3 3.330E+10 0.000 06397.0 !C7-18 Curran, 2006 c2h5+ch3cho !nc3h7+c3h7cho=c7h15o-4 6.660E+10 0.000 06397.0 !C7-18 Curran, 2006 c2h5+ch3cho !h+c3h7coc3h7=c7h15o-4 2.000E+12 0.000 07270.0 !C7-18 Curran, 2006 ch3coch3+h ! ! !C7-19/Decomposiiton to Cyclic Ethers c7h14ooh1-2=c7h14o1-2+oh 6.000e+11 0.000 22000.0 !C7-19 oxirane c7h14ooh1-3=c7h14o1-3+oh 7.500e+10 0.000 15250.0 !C7-19 oxetane c7h14ooh1-4=c7h14o1-4+oh 9.375e+09 0.000 07000.0 !C7-19 oxalane c7h14ooh1-5=c7h14o1-5+oh 1.172e+09 0.000 01800.0 !C7-19 oxane c7h14ooh2-1=c7h14o1-2+oh 6.000e+11 0.000 22000.0 !C7-19 oxirane c7h14ooh2-3=c7h14o2-3+oh 6.000e+11 0.000 22000.0 !C7-19 oxirane c7h14ooh2-4=c7h14o2-4+oh 7.500e+10 0.000 15250.0 !C7-19 oxetane c7h14ooh2-5=c7h14o2-5+oh 9.375e+09 0.000 07000.0 !C7-19 oxalane c7h14ooh2-6=c7h14o2-6+oh 1.172e+09 0.000 01800.0 !C7-19 oxane c7h14ooh3-1=c7h14o1-3+oh 7.500e+10 0.000 15250.0 !C7-19 oxetane c7h14ooh3-2=c7h14o2-3+oh 6.000e+11 0.000 22000.0 !C7-19 oxirane c7h14ooh3-4=c7h14o3-4+oh 6.000e+11 0.000 22000.0 !C7-19 oxirane c7h14ooh3-5=c7h14o3-5+oh 7.500e+10 0.000 15250.0 !C7-19 oxetane c7h14ooh3-6=c7h14o2-5+oh 9.375e+09 0.000 07000.0 !C7-19 oxalane c7h14ooh3-7=c7h14o1-5+oh 1.172e+09 0.000 01800.0 !C7-19 oxane c7h14ooh4-1=c7h14o1-4+oh 9.375e+09 0.000 07000.0 !C7-19 oxalane c7h14ooh4-2=c7h14o2-4+oh 7.500e+10 0.000 15250.0 !C7-19 oxetane c7h14ooh4-3=c7h14o3-4+oh 6.000e+11 0.000 22000.0 !C7-19 oxirane ! ! !C7-20-I/qooh = olefin + ho2 c7h14-1+ho2=c7h14ooh1-2 1.000e+11 0.000 10750.0 !C7-20-I c7h14-1+ho2=c7h14ooh2-1 1.000e+11 0.000 11750.0 !C7-20-I c7h14-2+ho2=c7h14ooh2-3 1.000e+11 0.000 11750.0 !C7-20-I c7h14-2+ho2=c7h14ooh3-2 1.000e+11 0.000 11750.0 !C7-20-I c7h14-3+ho2=c7h14ooh3-4 1.000e+11 0.000 11750.0 !C7-20-I c7h14-3+ho2=c7h14ooh4-3 2.000e+11 0.000 11750.0 !C7-20-I ! ! !C7-21/qooh=olefin+carbonyl+oh c7h14ooh1-3=c6h12-1+ch2o+oh 8.120E+13 -0.140 31090.0 !C7-21 rev/ 0.000e+00 0.000 00000.0 / c7h14ooh2-4=c5h10-1+ch3cho+oh 5.364E+17 -1.400 26750.0 !C7-21 rev/ 0.000e+00 0.000 00000.0 / c7h14ooh3-5=c4h8-1+c2h5cho+oh 2.470E+18 -1.550 27020.0 !C7-21 rev/ 0.000e+00 0.000 00000.0 / c7h14ooh3-1=c2h4+c4h9cho+oh 2.212E+19 -1.670 26980.0 !C7-21 rev/ 0.000e+00 0.000 00000.0 / c7h14ooh4-2=c3h6+c3h7cho+oh 1.300E+18 -1.490 26800.0 !C7-21 rev/ 0.000e+00 0.000 00000.0 / ! ! !C7-22-QOOH+O2=OOQOOH c7h14ooh1-2+o2=c7h14ooh1-2o2 7.540E+12 0.000 00000.0 !C7-22 c7h14ooh1-3+o2=c7h14ooh1-3o2 7.540E+12 0.000 00000.0 !C7-22 c7h14ooh1-4+o2=c7h14ooh1-4o2 7.540E+12 0.000 00000.0 !C7-22 c7h14ooh1-5+o2=c7h14ooh1-5o2 7.540E+12 0.000 00000.0 !C7-22 c7h14ooh2-1+o2=c7h14ooh2-1o2 4.520E+12 0.000 00000.0 !C7-22 c7h14ooh2-3+o2=c7h14ooh2-3o2 7.540E+12 0.000 00000.0 !C7-22 c7h14ooh2-4+o2=c7h14ooh2-4o2 7.540E+12 0.000 00000.0 !C7-22 c7h14ooh2-5+o2=c7h14ooh2-5o2 7.540E+12 0.000 00000.0 !C7-22 c7h14ooh2-6+o2=c7h14ooh2-6o2 7.540E+12 0.000 00000.0 !C7-22 c7h14ooh3-1+o2=c7h14ooh3-1o2 4.520E+12 0.000 00000.0 !C7-22 c7h14ooh3-2+o2=c7h14ooh3-2o2 7.540E+12 0.000 00000.0 !C7-22 c7h14ooh3-4+o2=c7h14ooh3-4o2 7.540E+12 0.000 00000.0 !C7-22 c7h14ooh3-5+o2=c7h14ooh3-5o2 7.540E+12 0.000 00000.0 !C7-22 c7h14ooh3-6+o2=c7h14ooh3-6o2 7.540E+12 0.000 00000.0 !C7-22 c7h14ooh3-7+o2=c7h14ooh3-7o2 4.520E+12 0.000 00000.0 !C7-22 c7h14ooh4-1+o2=c7h14ooh4-1o2 4.520E+12 0.000 00000.0 !C7-22 c7h14ooh4-2+o2=c7h14ooh4-2o2 7.540E+12 0.000 00000.0 !C7-22 c7h14ooh4-3+o2=c7h14ooh4-3o2 7.540E+12 0.000 00000.0 !C7-22 ! ! !C7-23/OOQOOH isomerization to ketohydroperoxyde + oh c7h14ooh1-2o2=nc7ket12+oh 2.000E+11 0.000 26400.0 !C7-23 c7h14ooh1-3o2=nc7ket13+oh 2.500E+10 0.000 21400.0 !C7-23 c7h14ooh1-4o2=nc7ket14+oh 3.125E+09 0.000 19350.0 !C7-23 c7h14ooh1-5o2=nc7ket15+oh 3.906E+08 0.000 22550.0 !C7-23 c7h14ooh2-1o2=nc7ket21+oh 1.000E+11 0.000 23850.0 !C7-23 c7h14ooh2-3o2=nc7ket23+oh 1.000E+11 0.000 23850.0 !C7-23 c7h14ooh2-4o2=nc7ket24+oh 1.250E+10 0.000 17850.0 !C7-23 c7h14ooh2-5o2=nc7ket25+oh 1.563E+09 0.000 16050.0 !C7-23 c7h14ooh2-6o2=nc7ket26+oh 1.953E+08 0.000 19050.0 !C7-23 c7h14ooh3-1o2=nc7ket31+oh 1.250E+10 0.000 17850.0 !C7-23 c7h14ooh3-2o2=nc7ket32+oh 1.000E+11 0.000 23850.0 !C7-23 c7h14ooh3-4o2=nc7ket34+oh 1.000E+11 0.000 23850.0 !C7-23 c7h14ooh3-5o2=nc7ket35+oh 1.250E+10 0.000 17850.0 !C7-23 c7h14ooh3-6o2=nc7ket36+oh 1.563E+09 0.000 16050.0 !C7-23 c7h14ooh3-7o2=nc7ket37+oh 1.953E+08 0.000 19050.0 !C7-23 c7h14ooh4-1o2=nc7ket41+oh 1.563E+09 0.000 16050.0 !C7-23 c7h14ooh4-2o2=nc7ket42+oh 1.250E+10 0.000 17850.0 !C7-23 c7h14ooh4-3o2=nc7ket43+oh 1.000E+11 0.000 23850.0 !C7-23 ! ! !C7-23a/OOQOOH to alkeneooh + ho2 c7h14ooh1-2o2=c7h13ooh1-1+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh1-2o2=c7h13ooh1-2+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh1-3o2=c7h13ooh1-2+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh1-3o2=c7h13ooh1-3+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh1-4o2=c7h13ooh1-3+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh1-4o2=c7h13ooh1-4+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh1-5o2=c7h13ooh1-4+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh1-5o2=c7h13ooh1-5+ho2 4.680E+09 1.160 30870.0 !23a ! c7h14ooh2-1o2=c7h13ooh2-1+ho2 3.780E+07 1.510 29640.0 !23a c7h14ooh2-3o2=c7h13ooh2-2+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh2-3o2=c7h13ooh2-3+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh2-4o2=c7h13ooh2-3+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh2-4o2=c7h13ooh2-4+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh2-5o2=c7h13ooh2-4+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh2-5o2=c7h13ooh2-5+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh2-6o2=c7h13ooh2-5+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh2-6o2=c7h13ooh2-6+ho2 4.680E+09 1.160 30870.0 !23a ! c7h14ooh3-1o2=c7h13ooh3-1+ho2 3.780E+07 1.510 29640.0 !23a c7h14ooh3-2o2=c7h13ooh3-1+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh3-2o2=c7h13ooh3-2+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh3-4o2=c7h13ooh3-3+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh3-4o2=c7h13ooh3-4+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh3-5o2=c7h13ooh3-4+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh3-5o2=c7h13ooh3-5+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh3-6o2=c7h13ooh3-5+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh3-6o2=c7h13ooh3-6+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh3-7o2=c7h13ooh3-6+ho2 3.780E+07 1.510 29640.0 !23a ! c7h14ooh4-1o2=c7h13ooh4-1+ho2 3.780E+07 1.510 29640.0 !23a c7h14ooh4-2o2=c7h13ooh4-1+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh4-2o2=c7h13ooh4-2+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh4-3o2=c7h13ooh4-2+ho2 4.680E+09 1.160 30870.0 !23a c7h14ooh4-3o2=c7h13ooh4-3+ho2 4.680E+09 1.160 30870.0 !23a ! ! !C7-23b/OOQOOH to HOOQOOH !except when HOOQOOH leads to a keto compounds + oh (see reaction type 23) c7h14ooh1-2o2=c7h13dipx12j3 2.000E+11 0.000 23850.0 !23b 5s -3000 c7h14ooh1-2o2=c7h13dipx12j4 2.500E+10 0.000 17850.0 !23b 6s -3000 c7h14ooh1-2o2=c7h13dipx12j5 6.250E+09 0.000 16050.0 !23b 7s -3000 c7h14ooh1-2o2=c7h13dipx12j6 3.907E+08 0.000 19050.0 !23b 8s -3000 c7h14ooh1-3o2=c7h13dipx13j2 2.000E+11 0.000 23850.0 !23b 5s -3000 c7h14ooh1-3o2=c7h13dipx13j4 2.000E+11 0.000 23850.0 !23b 5s -3000 c7h14ooh1-3o2=c7h13dipx13j5 2.500E+10 0.000 17850.0 !23b 6s -3000 c7h14ooh1-3o2=c7h13dipx13j6 6.250E+09 0.000 16050.0 !23b 7s -3000 c7h14ooh1-3o2=c7h13dipx13j7 5.860E+08 0.000 22550.0 !23b 8p -3000 c7h14ooh1-4o2=c7h13dipx14j2 2.500E+10 0.000 17850.0 !23b 6s -3000 c7h14ooh1-4o2=c7h13dipx14j3 2.000E+11 0.000 23850.0 !23b 5s -3000 c7h14ooh1-4o2=c7h13dipx14j5 2.000E+11 0.000 23850.0 !23b 5s -3000 c7h14ooh1-4o2=c7h13dipx14j6 2.500E+10 0.000 17850.0 !23b 6s -3000 c7h14ooh1-4o2=c7h13dipx14j7 9.375E+09 0.000 19350.0 !23b 7p -3000 c7h14ooh1-5o2=c7h13dipx15j2 6.250E+09 0.000 16050.0 !23b 7s -3000 c7h14ooh1-5o2=c7h13dipx15j3 2.500E+10 0.000 17850.0 !23b 6s -3000 c7h14ooh1-5o2=c7h13dipx15j4 2.000E+11 0.000 23850.0 !23b 5s -3000 c7h14ooh1-5o2=c7h13dipx15j6 2.000E+11 0.000 23850.0 !23b 5s -3000 c7h14ooh1-5o2=c7h13dipx15j7 3.750E+10 0.000 21400.0 !23b 6p -3000 ! c7h14ooh2-1o2=c7h13dipx12j3 2.500E+10 0.000 17850.0 !23b 6s -3000 c7h14ooh2-1o2=c7h13dipx12j4 6.250E+09 0.000 16050.0 !23b 7s -3000 c7h14ooh2-1o2=c7h13dipx12j5 3.907E+08 0.000 19050.0 !23b 8s -3000 c7h14ooh2-3o2=c7h13dipx23j1 3.750E+10 0.000 21400.0 !23b 6p -3000 c7h14ooh2-3o2=c7h13dipx23j4 2.000E+11 0.000 23850.0 !23b 5s -3000 c7h14ooh2-3o2=c7h13dipx23j5 2.500E+10 0.000 17850.0 !23b 6s -3000 c7h14ooh2-3o2=c7h13dipx23j6 6.250E+09 0.000 16050.0 !23b 7s -3000 c7h14ooh2-3o2=c7h13dipx23j7 5.860E+08 0.000 22550.0 !23b 8p -3000 c7h14ooh2-4o2=c7h13dipx24j1 9.375E+09 0.000 19350.0 !23b 7p -3000 c7h14ooh2-4o2=c7h13dipx24j3 2.000E+11 0.000 23850.0 !23b 5s -3000 c7h14ooh2-4o2=c7h13dipx24j5 2.000E+11 0.000 23850.0 !23b 5s -3000 c7h14ooh2-4o2=c7h13dipx24j6 2.500E+10 0.000 17850.0 !23b 6s -3000 c7h14ooh2-4o2=c7h13dipx24j7 9.375E+09 0.000 19350.0 !23b 7p -3000 c7h14ooh2-5o2=c7h13dipx25j1 5.860E+08 0.000 22550.0 !23b 8p -3000 c7h14ooh2-5o2=c7h13dipx25j3 2.500E+10 0.000 17850.0 !23b 6s -3000 c7h14ooh2-5o2=c7h13dipx25j4 2.000E+11 0.000 23850.0 !23b 5s -3000 c7h14ooh2-5o2=c7h13dipx25j6 2.000E+11 0.000 23850.0 !23b 5s -3000 c7h14ooh2-5o2=c7h13dipx25j7 3.750E+10 0.000 21400.0 !23b 6p -3000 c7h14ooh2-6o2=c7h13dipx26j1 3.000E+11 0.000 26400.0 !23b 5p -3000 c7h14ooh2-6o2=c7h13dipx26j3 2.000E+11 0.000 23850.0 !23b 5s -3000 duplicate c7h14ooh2-6o2=c7h13dipx26j4 2.500E+10 0.000 17850.0 !23b 6s -3000 c7h14ooh2-6o2=c7h13dipx26j3 6.250E+09 0.000 16050.0 !23b 7s -3000 duplicate ! c7h14ooh3-1o2=c7h13dipx13j2 2.000E+11 0.000 23850.0 !23b 5s -3000 c7h14ooh3-1o2=c7h13dipx13j4 6.250E+09 0.000 16050.0 !23b 7s -3000 c7h14ooh3-1o2=c7h13dipx13j5 3.907E+08 0.000 19050.0 !23b 8s -3000 c7h14ooh3-2o2=c7h13dipx23j1 3.000E+11 0.000 26400.0 !23b 5p -3000 c7h14ooh3-2o2=c7h13dipx23j4 2.500E+10 0.000 17850.0 !23b 6s -3000 c7h14ooh3-2o2=c7h13dipx23j5 6.250E+09 0.000 16050.0 !23b 7s -3000 c7h14ooh3-2o2=c7h13dipx23j6 3.907E+08 0.000 19050.0 !23b 8s -3000 c7h14ooh3-4o2=c7h13dipx34j1 9.375E+09 0.000 19350.0 !23b 7p -3000 c7h14ooh3-4o2=c7h13dipx34j2 2.500E+10 0.000 17850.0 !23b 6s -3000 c7h14ooh3-4o2=c7h13dipx34j5 2.000E+11 0.000 23850.0 !23b 5s -3000 c7h14ooh3-4o2=c7h13dipx34j6 2.500E+10 0.000 17850.0 !23b 6s -3000 c7h14ooh3-4o2=c7h13dipx34j7 9.375E+09 0.000 19350.0 !23b 7p -3000 c7h14ooh3-5o2=c7h13dipx35j1 5.860E+08 0.000 22550.0 !23b 8p -3000 duplicate c7h14ooh3-5o2=c7h13dipx35j2 6.250E+09 0.000 16050.0 !23b 7s -3000 duplicate c7h14ooh3-5o2=c7h13dipx35j4 2.000E+11 0.000 23850.0 !23b 5s -3000 c7h14ooh3-5o2=c7h13dipx35j2 2.000E+11 0.000 23850.0 !23b 5s -3000 duplicate c7h14ooh3-5o2=c7h13dipx35j1 3.750E+10 0.000 21400.0 !23b 6p -3000 duplicate c7h14ooh3-6o2=c7h13dipx25j1 3.000E+11 0.000 26400.0 !23b 5p -3000 c7h14ooh3-6o2=c7h13dipx25j3 2.000E+11 0.000 23850.0 !23b 5s -3000 c7h14ooh3-6o2=c7h13dipx25j4 2.500E+10 0.000 17850.0 !23b 6s -3000 c7h14ooh3-6o2=c7h13dipx25j6 3.907E+08 0.000 19050.0 !23b 8s -3000 c7h14ooh3-7o2=c7h13dipx15j2 2.000E+11 0.000 23850.0 !23b 5s -3000 c7h14ooh3-7o2=c7h13dipx15j3 2.500E+10 0.000 17850.0 !23b 6s -3000 c7h14ooh3-7o2=c7h13dipx15j4 6.250E+09 0.000 16050.0 !23b 7s -3000 ! c7h14ooh4-1o2=c7h13dipx14j2 2.000E+11 0.000 23850.0 !23b 5s -3000 c7h14ooh4-1o2=c7h13dipx14j3 2.500E+10 0.000 17850.0 !23b 6s -3000 c7h14ooh4-1o2=c7h13dipx14j5 3.907E+08 0.000 19050.0 !23b 8s -3000 c7h14ooh4-2o2=c7h13dipx24j1 3.000E+11 0.000 26400.0 !23b 5p -3000 c7h14ooh4-2o2=c7h13dipx24j3 2.000E+11 0.000 23850.0 !23b 5s -3000 c7h14ooh4-2o2=c7h13dipx24j5 6.250E+09 0.000 16050.0 !23b 7s -3000 c7h14ooh4-2o2=c7h13dipx24j6 3.907E+08 0.000 19050.0 !23b 8s -3000 c7h14ooh4-3o2=c7h13dipx34j1 3.750E+10 0.000 21400.0 !23b 6p -3000 c7h14ooh4-3o2=c7h13dipx34j2 2.000E+11 0.000 23850.0 !23b 5s -3000 c7h14ooh4-3o2=c7h13dipx34j5 2.500E+10 0.000 17850.0 !23b 6s -3000 c7h14ooh4-3o2=c7h13dipx34j6 6.250E+09 0.000 16050.0 !23b 7s -3000 c7h14ooh4-3o2=c7h13dipx34j7 5.860E+08 0.000 22550.0 !23b 8p -3000 ! ! !C7-23c/HOOQOOH to olefinHP + ho2 c7h13ooh1-2+ho2=c7h13dipx12j3 1.000E+11 0.000 11750.0 !23c c7h13ooh3-1+ho2=c7h13dipx13j2 1.000E+11 0.000 10750.0 !23c c7h13ooh1-2+ho2=c7h13dipx13j2 1.000E+11 0.000 11750.0 !23c c7h13ooh1-3+ho2=c7h13dipx13j4 1.000E+11 0.000 11750.0 !23c c7h13ooh4-1+ho2=c7h13dipx14j2 1.000E+11 0.000 10750.0 !23c c7h13ooh1-3+ho2=c7h13dipx14j3 1.000E+11 0.000 11750.0 !23c c7h13ooh1-4+ho2=c7h13dipx14j5 1.000E+11 0.000 11750.0 !23c c7h13ooh3-6+ho2=c7h13dipx15j2 1.000E+11 0.000 10750.0 !23c c7h13ooh1-4+ho2=c7h13dipx15j4 1.000E+11 0.000 11750.0 !23c c7h13ooh1-5+ho2=c7h13dipx15j6 1.000E+11 0.000 11750.0 !23c ! c7h13ooh3-1+ho2=c7h13dipx23j1 1.000E+11 0.000 11750.0 !23c c7h13ooh2-3+ho2=c7h13dipx23j4 1.000E+11 0.000 11750.0 !23c c7h13ooh4-1+ho2=c7h13dipx24j1 1.000E+11 0.000 11750.0 !23c c7h13ooh4-2+ho2=c7h13dipx24j3 1.000E+11 0.000 11750.0 !23c c7h13ooh2-3+ho2=c7h13dipx24j3 1.000E+11 0.000 11750.0 !23c c7h13ooh2-4+ho2=c7h13dipx24j5 1.000E+11 0.000 11750.0 !23c c7h13ooh3-6+ho2=c7h13dipx25j1 1.000E+11 0.000 11750.0 !23c c7h13ooh3-5+ho2=c7h13dipx25j3 1.000E+11 0.000 11750.0 !23c c7h13ooh2-4+ho2=c7h13dipx25j4 1.000E+11 0.000 11750.0 !23c c7h13ooh2-5+ho2=c7h13dipx25j6 1.000E+11 0.000 11750.0 !23c c7h13ooh2-6+ho2=c7h13dipx26j1 1.000E+11 0.000 11750.0 !23c c7h13ooh2-5+ho2=c7h13dipx26j3 1.000E+11 0.000 11750.0 !23c ! c7h13ooh4-2+ho2=c7h13dipx34j2 1.000E+11 0.000 11750.0 !23c c7h13ooh3-4+ho2=c7h13dipx34j5 1.000E+11 0.000 11750.0 !23c c7h13ooh3-5+ho2=c7h13dipx35j2 1.000E+11 0.000 11750.0 !23c c7h13ooh3-4+ho2=c7h13dipx35j4 1.000E+11 0.000 11750.0 !23c ! ! !C7-23d/HOOQOOH to HP cyclic ether + OH ! ! c7h13dipx12j3=oh+c7cy132 7.500E+10 0.000 15250.0 !23d oxetane c7h13dipx12j3=oh+c7cy231 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx12j4=oh+c7cy142 9.375E+09 0.000 07000.0 !23d oxalane c7h13dipx12j4=oh+c7cy241 7.500E+10 0.000 15250.0 !23d oxetane c7h13dipx12j5=oh+c7cy152 1.172E+09 0.000 01800.0 !23d oxane c7h13dipx12j5=oh+c7cy251 9.375E+09 0.000 07000.0 !23d oxalane c7h13dipx12j6=oh+c7cy261 1.172E+09 0.000 01800.0 !23d oxane ! c7h13dipx13j2=oh+c7cy123 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx13j2=oh+c7cy231 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx13j4=oh+c7cy143 9.375E+09 0.000 07000.0 !23d oxalane c7h13dipx13j4=oh+c7cy341 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx13j5=oh+c7cy153 1.172E+09 0.000 01800.0 !23d oxane c7h13dipx13j5=oh+c7cy351 7.500E+10 0.000 15250.0 !23d oxetane c7h13dipx13j6=oh+c7cy257 9.375E+09 0.000 07000.0 !23d oxalane c7h13dipx13j7=oh+c7cy157 1.172E+09 0.000 01800.0 !23d oxane ! c7h13dipx14j2=oh+c7cy124 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx14j2=oh+c7cy241 7.500E+10 0.000 15250.0 !23d oxetane c7h13dipx14j3=oh+c7cy134 7.500E+10 0.000 15250.0 !23d oxetane c7h13dipx14j3=oh+c7cy341 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx14j5=oh+c7cy154 1.172E+09 0.000 01800.0 !23d oxane c7h13dipx14j5=oh+c7cy347 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx14j6=oh+c7cy247 7.500E+10 0.000 15250.0 !23d oxetane c7h13dipx14j7=oh+c7cy147 9.375E+09 0.000 07000.0 !23d oxalane ! c7h13dipx15j2=oh+c7cy125 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx15j2=oh+c7cy251 9.375E+09 0.000 07000.0 !23d oxalane c7h13dipx15j3=oh+c7cy135 7.500E+10 0.000 15250.0 !23d oxetane c7h13dipx15j3=oh+c7cy351 7.500E+10 0.000 15250.0 !23d oxetane c7h13dipx15j4=oh+c7cy145 9.375E+09 0.000 07000.0 !23d oxalane c7h13dipx15j4=oh+c7cy347 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx15j6=oh+c7cy237 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx15j7=oh+c7cy137 7.500E+10 0.000 15250.0 !23d oxetane ! c7h13dipx23j1=oh+c7cy123 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx23j1=oh+c7cy132 7.500E+10 0.000 15250.0 !23d oxetane c7h13dipx23j4=oh+c7cy243 7.500E+10 0.000 15250.0 !23d oxetane c7h13dipx23j4=oh+c7cy342 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx23j5=oh+c7cy253 9.375E+09 0.000 07000.0 !23d oxalane c7h13dipx23j5=oh+c7cy352 7.500E+10 0.000 15250.0 !23d oxetane c7h13dipx23j6=oh+c7cy263 1.172E+09 0.000 01800.0 !23d oxane c7h13dipx23j6=oh+c7cy256 9.375E+09 0.000 07000.0 !23d oxalane c7h13dipx23j7=oh+c7cy156 1.172E+09 0.000 01800.0 !23d oxane ! c7h13dipx24j1=oh+c7cy124 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx24j1=oh+c7cy142 9.375E+09 0.000 07000.0 !23d oxalane c7h13dipx24j3=oh+c7cy234 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx24j3=oh+c7cy342 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx24j5=oh+c7cy254 9.375E+09 0.000 07000.0 !23d oxalane c7h13dipx24j5=oh+c7cy346 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx24j6=oh+c7cy264 1.172E+09 0.000 01800.0 !23d oxane c7h13dipx24j6=oh+c7cy246 7.500E+10 0.000 15250.0 !23d oxetane c7h13dipx24j7=oh+c7cy146 9.375E+09 0.000 07000.0 !23d oxalane ! c7h13dipx25j1=oh+c7cy125 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx25j1=oh+c7cy152 1.172E+09 0.000 01800.0 !23d oxane c7h13dipx25j3=oh+c7cy235 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx25j3=oh+c7cy352 7.500E+10 0.000 15250.0 !23d oxetane c7h13dipx25j4=oh+c7cy245 7.500E+10 0.000 15250.0 !23d oxetane c7h13dipx25j4=oh+c7cy346 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx25j6=oh+c7cy263 1.172E+09 0.000 01800.0 !23d oxane c7h13dipx25j6=oh+c7cy236 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx25j7=oh+c7cy136 7.500E+10 0.000 15250.0 !23d oxetane ! c7h13dipx26j1=oh+c7cy126 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx26j3=oh+c7cy236 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx26j3=oh+c7cy256 9.375E+09 0.000 07000.0 !23d oxalane c7h13dipx26j4=oh+c7cy246 1.500E+11 0.000 15250.0 !23d oxetane ! c7h13dipx34j1=oh+c7cy134 7.500E+10 0.000 15250.0 !23d oxetane c7h13dipx34j1=oh+c7cy143 9.375E+09 0.000 07000.0 !23d oxalane c7h13dipx34j2=oh+c7cy234 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx34j2=oh+c7cy243 7.500E+10 0.000 15250.0 !23d oxetane c7h13dipx34j5=oh+c7cy354 7.500E+10 0.000 15250.0 !23d oxetane c7h13dipx34j5=oh+c7cy345 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx34j6=oh+c7cy254 9.375E+09 0.000 07000.0 !23d oxalane c7h13dipx34j6=oh+c7cy245 7.500E+10 0.000 15250.0 !23d oxetane c7h13dipx34j7=oh+c7cy154 1.172E+09 0.000 01800.0 !23d oxane c7h13dipx34j7=oh+c7cy145 9.375E+09 0.000 07000.0 !23d oxalane ! c7h13dipx35j1=oh+c7cy135 7.500E+10 0.000 15250.0 !23d oxetane c7h13dipx35j1=oh+c7cy153 1.172E+09 0.000 01800.0 !23d oxane c7h13dipx35j2=oh+c7cy235 6.000E+11 0.000 22000.0 !23d oxirane c7h13dipx35j2=oh+c7cy253 9.375E+09 0.000 07000.0 !23d oxalane c7h13dipx35j4=oh+c7cy345 1.200E+12 0.000 22000.0 !23d oxirane ! ! ! !C7-24/hydroperoxyketone decomposition nc7ket12=oh+nc7ket12o 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" nc7ket13=oh+nc7ket13o 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" nc7ket14=oh+nc7ket14o 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" nc7ket15=oh+nc7ket15o 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" nc7ket21=oh+nc7ket21o 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" nc7ket23=oh+nc7ket23o 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" nc7ket24=oh+nc7ket24o 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" nc7ket25=oh+nc7ket25o 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" nc7ket26=oh+nc7ket26o 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" nc7ket31=oh+nc7ket31o 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" nc7ket32=oh+nc7ket32o 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" nc7ket34=oh+nc7ket34o 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" nc7ket35=oh+nc7ket35o 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" nc7ket36=oh+nc7ket36o 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" nc7ket37=oh+nc7ket37o 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" nc7ket41=oh+nc7ket41o 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" nc7ket42=oh+nc7ket42o 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" nc7ket43=oh+nc7ket43o 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" ! ! ! !C7-24b/Decomposition of the radicals from reaction type 24 hco+c5h11cho=nc7ket12o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho chocho+c5h11-1=nc7ket12o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+c5h11cocho=nc7ket12o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ch2cho+c4h9cho=nc7ket13o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho choch2cho+pc4h9=nc7ket13o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+c4h9coch2cho=nc7ket13o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c2h4cho+c3h7cho=nc7ket14o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho choc2h4cho+nc3h7=nc7ket14o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+c3h7coc2h4cho=nc7ket14o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c3h6cho+c2h5cho=nc7ket15o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho choc3h6cho+c2h5=nc7ket15o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+c2h5coc3h6cho=nc7ket15o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ! ch2o+c5h11co=nc7ket21o 5.000e+10 0.000 03457.0 !24b Curran, 2006 ch2o+nc3h7 h+c5h11cocho=nc7ket21o 4.000e+12 0.000 06260.0 !24b Curran, 2006 c2h5cho+h ch3co+c4h9cho=nc7ket23o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ch3cocho+pc4h9=nc7ket23o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+c4h9cococh3=nc7ket23o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ch3coch2+c3h7cho=nc7ket24o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ch3coch2cho+nc3h7=nc7ket24o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+c3h7coch2coch3=nc7ket24o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c2h4coch3+c2h5cho=nc7ket25o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ch3coc2h4cho+c2h5=nc7ket25o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+c2h5coc2h4coch3=nc7ket25o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ch3cho+ch3coc3h6=nc7ket26o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ch3coc3h6cho+ch3=nc7ket26o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+ch3coc3h6coch3=nc7ket26o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ! ch2o+c4h9coch2=nc7ket31o 5.000e+10 0.000 03457.0 !24b Curran, 2006 ch2o+nc3h7 h+c4h9coch2cho=nc7ket31o 4.000e+12 0.000 06260.0 !24b Curran, 2006 c2h5cho+h ch3+c4h9cocho=nc7ket32o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ch3cho+c4h9co=nc7ket32o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+c4h9cococh3=nc7ket32o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c2h5co+c3h7cho=nc7ket34o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho nc3h7+c2h5cocho=nc7ket34o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+c3h7cococ2h5=nc7ket34o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c2h5+c2h5coch2cho=nc7ket35o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c2h5cho+c2h5coch2=nc7ket35o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+c2h5coch2coc2h5=nc7ket35o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ch3cho+c2h5coc2h4=nc7ket36o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ch3+c2h5coc2h4cho=nc7ket36o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+c2h5coc2h4coch3=nc7ket36o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ch2o+c2h5coc3h6=nc7ket37o 5.000e+10 0.000 03457.0 !24b Curran, 2006 ch2o+nc3h7 h+c2h5coc3h6cho=nc7ket37o 4.000e+12 0.000 06260.0 !24b Curran, 2006 c2h5cho+h ! ch2o+c3h7coc2h4=nc7ket41o 5.000e+10 0.000 03457.0 !24b Curran, 2006 ch2o+nc3h7 h+c3h7coc2h4cho=nc7ket41o 4.000e+12 0.000 06260.0 !24b Curran, 2006 c2h5cho+h ch3+c3h7coch2cho=nc7ket42o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ch3cho+c3h7coch2=nc7ket42o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+c3h7coch2coch3=nc7ket42o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c2h5+c3h7cocho=nc7ket43o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c2h5cho+c3h7co=nc7ket43o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+c3h7cococ2h5=nc7ket43o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ! ! !C7-25/Decomposition of cyclic ethers !Metathesis and first b-scission globalized c7h14o1-2+oh=h2o+c5h11chjcho 1.900E+08 1.610 -00035.0 !C7-25 c7h14o1-2+oh=h2o+c5h11coch2 8.840E+09 1.000 -00149.0 !C7-25 c7h14o1-3+oh=h2o+c4h9chjch2cho 1.900E+08 1.610 -00035.0 !C7-25 c7h14o1-3+oh=h2o+c4h9coc2h4 8.840E+09 1.000 -00149.0 !C7-25 c7h14o1-4+oh=h2o+c3h7chjc2h4cho 1.900E+08 1.610 -00035.0 !C7-25 c7h14o1-4+oh=h2o+c3h7coc3h6 8.840E+09 1.000 -00149.0 !C7-25 c7h14o1-5+oh=h2o+c2h5chjc3h6cho 1.900E+08 1.610 -00035.0 !C7-25 c7h14o1-5+oh=h2o+c2h5coc4h8 8.840E+09 1.000 -00149.0 !C7-25 c7h14o2-3+oh=h2o+c4h9chjcoch3 8.840E+09 1.000 -00149.0 !C7-25 c7h14o2-3+oh=h2o+ch3chjcoc4h9 8.840E+09 1.000 -00149.0 !C7-25 c7h14o2-4+oh=h2o+c3h7chjch2coch3 8.840E+09 1.000 -00149.0 !C7-25 c7h14o2-4+oh=h2o+ch3chjch2coc3h7 8.840E+09 1.000 -00149.0 !C7-25 c7h14o2-5+oh=h2o+c2h5chjc2h4coch3 8.840E+09 1.000 -00149.0 !C7-25 c7h14o2-5+oh=h2o+ch3chjc2h4coc2h5 8.840E+09 1.000 -00149.0 !C7-25 c7h14o2-6+oh=h2o+ch3chjc3h6coch3 1.768E+10 1.000 -00149.0 !C7-25 c7h14o3-4+oh=h2o+c3h7chjcoc2h5 8.840E+09 1.000 -00149.0 !C7-25 c7h14o3-4+oh=h2o+c2h5chjcoc3h7 8.840E+09 1.000 -00149.0 !C7-25 c7h14o3-5+oh=h2o+c2h5chjch2coc2h5 1.768E+10 1.000 -00149.0 !C7-25 ! c7h14o1-2+ho2=h2o2+c5h11chjcho 6.000E+04 2.600 13910.0 !C7-25 c7h14o1-2+ho2=h2o2+c5h11coch2 1.080E+04 2.550 10532.0 !C7-25 c7h14o1-3+ho2=h2o2+c4h9chjch2cho 6.000E+04 2.600 13910.0 !C7-25 c7h14o1-3+ho2=h2o2+c4h9coc2h4 1.080E+04 2.550 10532.0 !C7-25 c7h14o1-4+ho2=h2o2+c3h7chjc2h4cho 6.000E+04 2.600 13910.0 !C7-25 c7h14o1-4+ho2=h2o2+c3h7coc3h6 1.080E+04 2.550 10532.0 !C7-25 c7h14o1-5+ho2=h2o2+c2h5chjc3h6cho 6.000E+04 2.600 13910.0 !C7-25 c7h14o1-5+ho2=h2o2+c2h5coc4h8 1.080E+04 2.550 10532.0 !C7-25 c7h14o2-3+ho2=h2o2+c4h9chjcoch3 1.080E+04 2.550 10532.0 !C7-25 c7h14o2-3+ho2=h2o2+ch3chjcoc4h9 1.080E+04 2.550 10532.0 !C7-25 c7h14o2-4+ho2=h2o2+c3h7chjch2coch3 1.080E+04 2.550 10532.0 !C7-25 c7h14o2-4+ho2=h2o2+ch3chjch2coc3h7 1.080E+04 2.550 10532.0 !C7-25 c7h14o2-5+ho2=h2o2+c2h5chjc2h4coch3 1.080E+04 2.550 10532.0 !C7-25 c7h14o2-5+ho2=h2o2+ch3chjc2h4coc2h5 1.080E+04 2.550 10532.0 !C7-25 c7h14o2-6+ho2=h2o2+ch3chjc3h6coch3 2.160E+04 2.550 10532.0 !C7-25 c7h14o3-4+ho2=h2o2+c3h7chjcoc2h5 1.080E+04 2.550 10532.0 !C7-25 c7h14o3-4+ho2=h2o2+c2h5chjcoc3h7 1.080E+04 2.550 10532.0 !C7-25 c7h14o3-5+ho2=h2o2+c2h5chjch2coc2h5 2.160E+04 2.550 10532.0 !C7-25 ! ! !C7-25b/decomposition of radicals from reaction type 25 c2h3cho+pc4h9=c5h11chjcho 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C ch2co+c5h11-1=c5h11coch2 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C c6h12-1+hco=c4h9chjch2cho 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C c3h5cho+nc3h7=c4h9chjch2cho 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C c2h4+c4h9co=c4h9coc2h4 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C c4h7cho+c2h5=c3h7chjc2h4cho 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C c5h10-1+ch2cho=c3h7chjc2h4cho 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C c2h4+c3h7coch2=c3h7coc3h6 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C c5h9cho+ch3=c2h5chjc3h6cho 1.760E+04 2.480 06130.0 !C7-25b addition of CH3 to C=C c4h8-1+c2h4cho=c2h5chjc3h6cho 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C c2h4+c2h5coc2h4=c2h5coc4h8 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C c4h9chco+ch3=c4h9chjcoch3 1.760E+04 2.480 06130.0 !C7-25b addition of CH3 to C=C c2h3coch3+nc3h7=c4h9chjcoch3 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C ch3chco+pc4h9=ch3chjcoc4h9 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C c3h5coch3+c2h5=c3h7chjch2coch3 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C c5h10-1+ch3co=c3h7chjch2coch3 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C c3h6+c3h7co=ch3chjch2coc3h7 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C c4h7coch3+ch3=c2h5chjc2h4coch3 1.760E+04 2.480 06130.0 !C7-25b addition of CH3 to C=C c4h8-1+ch3coch2=c2h5chjc2h4coch3 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C c3h6+c2h5coch2=ch3chjc2h4coc2h5 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C c3h6+c2h4coch3=ch3chjc3h6coch3 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C c2h3coc2h5+c2h5=c3h7chjcoc2h5 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C c3h7chco+c2h5=c3h7chjcoc2h5 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C c2h3coc3h7+ch3=c2h5chjcoc3h7 1.760E+04 2.480 06130.0 !C7-25b addition of CH3 to C=C c2h5chco+nc3h7=c2h5chjcoc3h7 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C c3h5coc2h5+ch3=c2h5chjch2coc2h5 1.760E+04 2.480 06130.0 !C7-25b addition of CH3 to C=C c4h8-1+c2h5co=c2h5chjch2coc2h5 8.800E+03 2.480 06130.0 !C7-25b addition of R. to C=C ! ! !C7-26/mdxdyooh decomposition to mdxdyo + OH c7h13ooh1-1=oh+c7h13o1-1 6.310E+14 0.000 42330.0 !C7-26 "Lightfoot et al., 1991" c7h13ooh1-2=oh+c7h13o1-2 6.310E+14 0.000 42330.0 !C7-26 "Lightfoot et al., 1991" c7h13ooh1-3=oh+c7h13o1-3 6.310E+14 0.000 42330.0 !C7-26 "Lightfoot et al., 1991" c7h13ooh1-4=oh+c7h13o1-4 6.310E+14 0.000 42330.0 !C7-26 "Lightfoot et al., 1991" c7h13ooh1-5=oh+c7h13o1-5 6.310E+14 0.000 42330.0 !C7-26 "Lightfoot et al., 1991" ! c7h13ooh2-1=oh+c7h13o2-1 6.310E+14 0.000 42330.0 !C7-26 "Lightfoot et al., 1991" c7h13ooh2-2=oh+c7h13o2-2 6.310E+14 0.000 42330.0 !C7-26 "Lightfoot et al., 1991" c7h13ooh2-3=oh+c7h13o2-3 6.310E+14 0.000 42330.0 !C7-26 "Lightfoot et al., 1991" c7h13ooh2-4=oh+c7h13o2-4 6.310E+14 0.000 42330.0 !C7-26 "Lightfoot et al., 1991" c7h13ooh2-5=oh+c7h13o2-5 6.310E+14 0.000 42330.0 !C7-26 "Lightfoot et al., 1991" c7h13ooh2-6=oh+c7h13o2-6 6.310E+14 0.000 42330.0 !C7-26 "Lightfoot et al., 1991" ! c7h13ooh3-1=oh+c7h13o3-1 6.310E+14 0.000 42330.0 !C7-26 "Lightfoot et al., 1991" c7h13ooh3-2=oh+c7h13o3-2 6.310E+14 0.000 42330.0 !C7-26 "Lightfoot et al., 1991" c7h13ooh3-3=oh+c7h13o3-3 6.310E+14 0.000 42330.0 !C7-26 "Lightfoot et al., 1991" c7h13ooh3-4=oh+c7h13o3-4 6.310E+14 0.000 42330.0 !C7-26 "Lightfoot et al., 1991" c7h13ooh3-5=oh+c7h13o3-5 6.310E+14 0.000 42330.0 !C7-26 "Lightfoot et al., 1991" c7h13ooh3-6=oh+c7h13o3-6 6.310E+14 0.000 42330.0 !C7-26 "Lightfoot et al., 1991" ! c7h13ooh4-1=oh+c7h13o4-1 6.310E+14 0.000 42330.0 !C7-26 "Lightfoot et al., 1991" c7h13ooh4-2=oh+c7h13o4-2 6.310E+14 0.000 42330.0 !C7-26 "Lightfoot et al., 1991" c7h13ooh4-3=oh+c7h13o4-3 6.310E+14 0.000 42330.0 !C7-26 "Lightfoot et al., 1991" ! ! !C7-26b/Decomposition of the radicals from reaction type 26 c2h3cho+pc4h9=c7h13o1-1 8.800e+03 0.000 06130.0 !C7-26b Curran, 2006 c3h6+c2h5 c5h11chco+h=c7h13o1-1 4.000e+12 0.000 06260.0 !C7-26b Curran, 2006 c2h5cho+h ch2o+c6h11-11=c7h13o1-2 5.000e+10 0.000 03457.0 !C7-26b Curran, 2006 ch2o+nc3h7 c4h9c2h2cho+h=c7h13o1-2 4.000e+12 0.000 06260.0 !C7-26b Curran, 2006 c2h5cho+h ch2o+c6h11-13=c7h13o1-3 5.000e+10 0.000 03457.0 !C7-26b Curran, 2006 ch2o+nc3h7 h+c3h7c2h2ch2cho=c7h13o1-3 4.000e+12 0.000 06260.0 !C7-26b Curran, 2006 c2h5cho+h ch2o+c6h11-31=c7h13o1-4 5.000e+10 0.000 03457.0 !C7-26b Curran, 2006 ch2o+nc3h7 h+c2h5c2h2c2h4cho=c7h13o1-4 4.000e+12 0.000 06260.0 !C7-26b Curran, 2006 c2h5cho+h ch2o+c6h11-26=c7h13o1-5 5.000e+10 0.000 03457.0 !C7-26b Curran, 2006 ch2o+nc3h7 ch3c2h2c3h6cho+h=c7h13o1-5 4.000e+12 0.000 06260.0 !C7-26b Curran, 2006 c2h5cho+h ! ch2co+c5h11-1=c7h13o2-1 3.330E+10 0.000 06397.0 !C7-26b Curran, 2006 c2h5+ch3cho ch3+c4h9chco=c7h13o2-2 1.000e+11 0.000 09256.0 !C7-26b Curran, 2006 ch3cho+ch3 nc3h7+c2h3coch3=c7h13o2-2 8.800e+03 0.000 06130.0 !C7-26b Curran, 2006 c3h6+c2h5 ch3+c3h7c2h2cho=c7h13o2-3 1.000e+11 0.000 09256.0 !C7-26b Curran, 2006 ch3cho+ch3 ch3cho+c5h9-11=c7h13o2-3 3.330E+10 0.000 06397.0 !C7-26b Curran, 2006 c2h5+ch3cho h+c3h7c2h2coch3=c7h13o2-3 2.000E+12 0.000 07270.0 !C7-26b Curran, 2006 ch3coch3+h ch3+c2h5c2h2ch2cho=c7h13o2-4 1.000e+11 0.000 09256.0 !C7-26b Curran, 2006 ch3cho+ch3 ch3cho+c5h9-13=c7h13o2-4 3.330E+10 0.000 06397.0 !C7-26b Curran, 2006 c2h5+ch3cho c2h5c2h2ch2coch3+h=c7h13o2-4 2.000E+12 0.000 07270.0 !C7-26b Curran, 2006 ch3coch3+h ch3+ch3c2h2c2h4cho=c7h13o2-5 1.000e+11 0.000 09256.0 !C7-26b Curran, 2006 ch3cho+ch3 ch3cho+c5h9-25=c7h13o2-5 3.330E+10 0.000 06397.0 !C7-26b Curran, 2006 c2h5+ch3cho h+ch3c2h2c2h4coch3=c7h13o2-5 2.000E+12 0.000 07270.0 !C7-26b Curran, 2006 ch3coch3+h ch3+c5h9cho=c7h13o2-6 1.000e+11 0.000 09256.0 !C7-26b Curran, 2006 ch3cho+ch3 ch3cho+c5h9-15=c7h13o2-6 3.330E+10 0.000 06397.0 !C7-26b Curran, 2006 c2h5+ch3cho h+c5h9coch3=c7h13o2-6 2.000E+12 0.000 07270.0 !C7-26b Curran, 2006 ch3coch3+h ! c2h3+c4h9cho=c7h13o3-1 3.330E+10 0.000 06397.0 !C7-26b Curran, 2006 c2h5+ch3cho ch3chco+pc4h9=c7h13o3-1 3.330E+10 0.000 06397.0 !C7-26b Curran, 2006 c2h5+ch3cho h+c2h3coc4h9=c7h13o3-1 2.000E+12 0.000 07270.0 !C7-26b Curran, 2006 ch3coch3+h ch3chco+pc4h9=c7h13o3-2 3.330E+10 0.000 06397.0 !C7-26b Curran, 2006 c2h5+ch3cho c2h5+c3h7chco=c7h13o3-3 3.330E+10 0.000 06397.0 !C7-26b Curran, 2006 c2h5+ch3cho c2h5+c2h3coc2h5=c7h13o3-3 8.800e+03 0.000 06130.0 !C7-26b Curran, 2006 c3h6+c2h5 c2h5+c2h5c2h2cho=c7h13o3-4 3.330E+10 0.000 06397.0 !C7-26b Curran, 2006 c2h5+ch3cho c2h5cho+c4h7-11=c7h13o3-4 3.330E+10 0.000 06397.0 !C7-26b Curran, 2006 c2h5+ch3cho c2h5c2h2coc2h5+h=c7h13o3-4 2.000E+12 0.000 07270.0 !C7-26b Curran, 2006 ch3coch3+h c2h5+ch3c2h2ch2cho=c7h13o3-5 3.330E+10 0.000 06397.0 !C7-26b Curran, 2006 c2h5+ch3cho c2h5cho+c4h7-13=c7h13o3-5 3.330E+10 0.000 06397.0 !C7-26b Curran, 2006 c2h5+ch3cho h+ch3c2h2ch2coc2h5=c7h13o3-5 2.000E+12 0.000 07270.0 !C7-26b Curran, 2006 ch3coch3+h c2h5+c2h3c2h4cho=c7h13o3-6 3.330E+10 0.000 06397.0 !C7-26b Curran, 2006 c2h5+ch3cho c2h5cho+c4h7-14=c7h13o3-6 3.330E+10 0.000 06397.0 !C7-26b Curran, 2006 c2h5+ch3cho h+c4h7coc2h5=c7h13o3-6 2.000E+12 0.000 07270.0 !C7-26b Curran, 2006 ch3coch3+h ! c3h5-a+c3h7cho=c7h13o4-1 3.330E+10 0.000 06397.0 !C7-26b Curran, 2006 c2h5+ch3cho nc3h7+c3h5cho=c7h13o4-1 3.330E+10 0.000 06397.0 !C7-26b Curran, 2006 c2h5+ch3cho h+c3h5coc3h7=c7h13o4-1 2.000E+12 0.000 07270.0 !C7-26b Curran, 2006 ch3coch3+h c3h5-s+c3h7cho=c7h13o4-2 3.330E+10 0.000 06397.0 !C7-26b Curran, 2006 c2h5+ch3cho nc3h7+ch3c2h2cho=c7h13o4-2 3.330E+10 0.000 06397.0 !C7-26b Curran, 2006 c2h5+ch3cho h+ch3c2h2coc3h7=c7h13o4-2 2.000E+12 0.000 07270.0 !C7-26b Curran, 2006 ch3coch3+h c2h5chco+nc3h7=c7h13o4-3 3.330E+10 0.000 06397.0 !C7-26b Curran, 2006 c2h5+ch3cho ch3+c2h3coc3h7=c7h13o4-3 1.760e+04 2.480 06130.0 !C7-26b Curran, 2006 c3h6+ch3 ! ! !C7-27/hydroperoxy cyclic ether to alkoxy cyclic ether c7cy123=>c7cy12o3+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy124=>c7cy12o4+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy125=>c7cy12o5+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy126=>c7cy12o6+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy132=>c7cy13o2+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy134=>c7cy13o4+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy135=>c7cy13o5+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy136=>c7cy13o6+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy137=>c7cy13o7+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy142=>c7cy14o2+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy143=>c7cy14o3+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy145=>c7cy14o5+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy146=>c7cy14o6+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy147=>c7cy14o7+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy152=>c7cy15o2+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy153=>c7cy15o3+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy154=>c7cy15o4+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy156=>c7cy15o6+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy157=>c7cy15o7+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy231=>c7cy23o1+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy234=>c7cy23o4+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy235=>c7cy23o5+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy236=>c7cy23o6+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy237=>c7cy23o7+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy241=>c7cy24o1+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy243=>c7cy24o3+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy245=>c7cy24o5+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy246=>c7cy24o6+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy247=>c7cy24o7+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy251=>c7cy25o1+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy253=>c7cy25o3+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy254=>c7cy25o4+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy256=>c7cy25o6+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy257=>c7cy25o7+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy261=>c7cy26o1+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy263=>c7cy26o3+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy264=>c7cy26o4+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy341=>c7cy34o1+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy342=>c7cy34o2+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy345=>c7cy34o5+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy346=>c7cy34o6+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy347=>c7cy34o7+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy351=>c7cy35o1+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy352=>c7cy35o2+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" c7cy354=>c7cy35o4+oh 6.310E+14 0.000 42330.0 !C7-27 "Lightfoot et al., 1991" ! ! !C7-27b/decomposition reactions of radicals from reaction type 27 c7cy12o3=>pc4h9+cy1008 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy12o3=>c4h9cho+ch2cho 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy12o4=>nc3h7+cy1007 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy12o4=>c3h7cho+cy1005j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy12o5=>c2h5+cy1006 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy12o5=>c2h5cho+c2h4+ch2cho 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy12o6=>ch3+cy1005 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy12o6=>ch3cho+c2h4+cy1005j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 ! c7cy13o2=>ch2cho+c4h9cho 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy13o2=>ch2o+c2h3cho+nc3h7 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy13o4=>c3h7cho+cy905j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy13o4=>nc3h7+cy907 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy13o5=>c2h5+cy906 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy13o5=>c2h5cho+cy904j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy13o6=>ch3+cy905 4.380e+16 -0.890 16530.0 !C7-27b sc4h9o=c2h5cho+ch3 c7cy13o6=>ch3cho+c2h4+cy905j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy13o7=>ch2o+c2h4+cy904j 2.720e+21 -2.450 16970.0 !C7-27b nc3h7o=ch2o+c2h5 ! c7cy14o2=>ch2o+cy475jc 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy14o2=>c7cy142j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy142j=>nc3h7+cy809 1.220E+12 0.640 29370.0 !C7-27b 2c5h11=c3h6+c2h5 c7cy142j=>ch2o+hco+c5h10-1 4.384E+19 -2.010 25190.0 !C7-27b Huge Mechanism ch3och2o=ch3o+ch2 c7cy14o3=>c7cy143j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy143j=>hco+c2h4+c3h7cho 4.384E+19 -2.010 25190.0 !C7-27b Huge Mechanism ch3och2o=ch3o+ch2 c7cy143j=>c2h5+cy808 1.220E+12 0.640 29370.0 !C7-27b 2c5h11=c3h6+c2h5 c7cy14o3=>c2h4+cy476jd 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy14o5=>c2h5+cy806 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy14o5=>c2h5cho+cy804j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy14o6=>ch3+cy805 4.380e+16 -0.890 16530.0 !C7-27b sc4h9o=c2h5cho+ch3 c7cy14o6=>ch3cho+cy803j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy14o7=>ch2o+c2h4+cy804j 2.720e+21 -2.450 16970.0 !C7-27b nc3h7o=ch2o+c2h5 ! c7cy15o2=>c2h4+c7cy152j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy152j=>cy809+ch3 4.790e+10 1.040 30360.0 !C7-27b sc4h9=c3h6+ch3 c7cy152j=>ch2cho+c2h5cho 4.384E+19 -2.010 25190.0 !C7-27b Huge Mechanism ch3och2o=ch3o+ch2 c7cy15o2=>ch2o+cy485jc 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy15o3=>c7cy153j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy153j=>c2h5+cy808 4.790e+10 1.040 30360.0 !C7-27b sc4h9=c3h6+ch3 c7cy153j=>c4h8-1+ch2o+ch2cho 4.384E+19 -2.010 25190.0 !C7-27b Huge Mechanism ch3och2o=ch3o+ch2 c7cy15o3=>c2h4+cy486jd 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy15o4=>c7cy154j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy154j=>ch3+cy707 4.790e+10 1.040 30360.0 !C7-27b sc4h9=c3h6+ch3 c7cy154j=>c2h4+ch2cho+c2h5cho 4.384E+19 -2.010 25190.0 !C7-27b Huge Mechanism ch3och2o=ch3o+ch2 c7cy15o4=>c2h4+ch2o+ch3+c2h3cho 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy15o6=>ch3+cy705 4.380e+16 -0.890 16530.0 !C7-27b sc4h9o=c2h5cho+ch3 c7cy15o6=>ch3cho+cy703j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy15o7=>ch2o+cy702j 2.720e+21 -2.450 16970.0 !C7-27b nc3h7o=ch2o+c2h5 ! c7cy23o1=>ch2o+cy562j 2.720e+21 -2.450 16970.0 !C7-27b nc3h7o=ch2o+c2h5 c7cy23o4=>nc3h7+cy897 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy23o4=>c3h7cho+cy895j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy23o5=>c2h5+cy896 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy23o5=>c2h5cho+cy894j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy23o6=>ch3+cy895 4.380e+16 -0.890 16530.0 !C7-27b sc4h9o=c2h5cho+ch3 c7cy23o6=>ch3cho+c2h4+cy895j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy23o7=>ch2o+c2h4+cy894j 2.720e+21 -2.450 16970.0 !C7-27b nc3h7o=ch2o+c2h5 ! c7cy24o1=>ch2o+cy572j 2.720e+21 -2.450 16970.0 !C7-27b nc3h7o=ch2o+c2h5 c7cy24o3=>ch3cho+c2h5+c2h3cho 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy24o3=>c7cy243j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy243j=>c2h3cho+h+c3h7cho 4.384E+19 -2.010 25190.0 !C7-27b Huge Mechanism ch3och2o=ch3o+ch2 c7cy243j=>c2h5+cy798 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy24o5=>c2h5+cy796 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy24o5=>c2h5cho+cy794j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy24o6=>ch3+cy795 4.380e+16 -0.890 16530.0 !C7-27b sc4h9o=c2h5cho+ch3 c7cy24o6=>ch3cho+cy793j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy24o7=>ch2o+c2h4+cy794j 2.720e+21 -2.450 16970.0 !C7-27b nc3h7o=ch2o+c2h5 ! c7cy25o1=>ch2o+cy582j 2.720e+21 -2.450 16970.0 !C7-27b nc3h7o=ch2o+c2h5 c7cy25o3=>ch3cho+cy586jd 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy25o3=>c7cy253j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy253j=>c4h8-1+cy698jd 4.384E+19 -2.010 25190.0 !C7-27b Huge Mechanism ch3och2o=ch3o+ch2 c7cy253j=>c2h5+cy698 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy25o4=>c7cy254ja 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy254ja=>ch3+cy587a 4.380e+16 -0.890 16530.0 !C7-27b sc4h9o=c2h5cho+ch3 c7cy254ja=>c3h6+cy587jc 4.384E+19 -2.010 25190.0 !C7-27b Huge Mechanism ch3och2o=ch3o+ch2 c7cy25o4=>c7cy254jb 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy254jb=>ch3+cy697b 4.380e+16 -0.890 16530.0 !C7-27b sc4h9o=c2h5cho+ch3 c7cy254jb=>c2h5cho+hco+c3h6 4.384E+19 -2.010 25190.0 !C7-27b Huge Mechanism ch3och2o=ch3o+ch2 c7cy25o6=>ch3+cy695 4.380e+16 -0.890 16530.0 !C7-27b sc4h9o=c2h5cho+ch3 c7cy25o6=>ch3cho+cy693j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy25o7=>ch2o+cy692j 2.720e+21 -2.450 16970.0 !C7-27b nc3h7o=ch2o+c2h5 ! c7cy26o1=>ch2o+cy592j 2.720e+21 -2.450 16970.0 !C7-27b nc3h7o=ch2o+c2h5 c7cy26o3=>ch3cho+c3h6+ch2cho 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy26o3=>c2h4+ch3cho+c2h3cho+h 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy26o4=>ch3+cy597b 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy26o4=>c3h6+cy597jd 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 ! c7cy34o1=>ch2o+cy672j 2.720e+21 -2.450 16970.0 !C7-27b nc3h7o=ch2o+c2h5 c7cy34o2=>ch3+cy675 4.380e+16 -0.890 16530.0 !C7-27b sc4h9o=c2h5cho+ch3 c7cy34o2=>ch3cho+cy673j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy34o5=>c2h5cho+cy784j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy34o5=>c2h5+cy786 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy34o6=>ch3cho+cy783j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy34o6=>ch3+cy785 4.380e+16 -0.890 16530.0 !C7-27b sc4h9o=c2h5cho+ch3 c7cy34o7=>ch2o+c2h4+cy784j 2.720e+21 -2.450 16970.0 !C7-27b nc3h7o=ch2o+c2h5 ! c7cy35o1=>ch2o+cy682j 2.720e+21 -2.450 16970.0 !C7-27b nc3h7o=ch2o+c2h5 c7cy35o2=>ch3+cy685 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy35o2=>ch3cho+cy683j 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy35o4=>ch3+cy687b 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 c7cy35o4=>c2h5cho+c2h3cho+ch3 5.510e+22 -2.760 13980.0 !C7-27b sc4h9o=ch3cho+c2h5 ! ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !! Reactions of methyl-decanoate !! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! ! ! High temperature mechanism ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 1/Unimolecular initiations ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! md2j+h=md 1.000e+14 0.000 00000.0 !1 md3j+h=md 1.000e+14 0.000 00000.0 !1 md4j+h=md 1.000e+14 0.000 00000.0 !1 md5j+h=md 1.000e+14 0.000 00000.0 !1 md6j+h=md 1.000e+14 0.000 00000.0 !1 md7j+h=md 1.000e+14 0.000 00000.0 !1 md8j+h=md 1.000e+14 0.000 00000.0 !1 md9j+h=md 1.000e+14 0.000 00000.0 !1 md10j+h=md 1.000e+14 0.000 00000.0 !1 mdmj+h=md 1.000e+14 0.000 00000.0 !1 mn9j+ch3=md 1.000e+13 0.000 00000.0 !1 mo8j+c2h5=md 8.000e+12 0.000 00000.0 !1 ms7j+nc3h7=md 8.000e+12 0.000 00000.0 !1 mh6j+pc4h9=md 8.000e+12 0.000 00000.0 !1 mf5j+c5h11-1=md 8.000e+12 0.000 00000.0 !1 mb4j+c6h13-1=md 8.000e+12 0.000 00000.0 !1 mp3j+c7h15-1=md 8.000e+12 0.000 00000.0 !1 me2j+c8h17-1=md 8.000e+12 0.000 00000.0 !1 ch3oco+c9h19-1=md 1.810e+13 0.000 00000.0 !1 ch3o+c9h19co=md 3.000e+13 0.000 00000.0 !1 daoj+ch3=md 3.000e+13 0.000 00000.0 !1 ! !molecular elimination from md md=me+c8h16-1 3.980e+12 0.000 68000.0 !1b A from retroene of olefin and Ea from Metcalfe et al., 2007 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!! ! 2/H-abstractions ! !!!!!!!!!!!!!!!!!!!!!!!! ! !primary h atoms md+h=mdmj+h2 9.400e+04 2.750 06280.0 !2 md+ho2=mdmj+h2o2 4.050e+04 2.500 16690.0 !2 md+oh=mdmj+h2o 5.270e+09 0.970 01590.0 !2 md+o2=mdmj+ho2 6.000e+13 0.000 52800.0 !2 md+o=mdmj+oh 1.046e+06 2.420 04766.0 !2 md+ch3=mdmj+ch4 4.520e-01 3.650 07154.0 !2 md+ch3o=mdmj+ch3oh 1.500e+10 0.000 07000.0 !2 md+ch3o2=mdmj+ch3o2h 4.050e+04 2.500 16690.0 !2 md+c2h3=mdmj+c2h4 5.000e+11 0.000 18000.0 !2 md+c2h5=mdmj+c2h6 5.000e+10 0.000 13400.0 !2 ! !tertiary h atoms assumed for md2j. Kinetic parameters from abstractions with ic4h10 md+h=md2j+h2 3.620e+06 2.540 06756.0 !2 md+ho2=md2j+h2o2 7.220e+03 2.550 10530.0 !2 md+oh=md2j+h2o 1.146e+11 0.510 00063.0 !2 md+o2=md2j+ho2 4.080e+13 0.000 41350.0 !2 md+o=md2j+oh 3.936e+05 2.400 01150.0 !2 md+ch3=md2j+ch4 2.720e+00 3.650 07154.0 !2 md+ch3o=md2j+ch3oh 3.800e+10 0.000 02800.0 !2 md+ch3o2=md2j+ch3o2h 7.220e+03 2.550 10530.0 !2 md+c2h3=md2j+c2h4 4.000e+11 0.000 14300.0 !2 from mb mechanism md+c2h5=md2j+c2h6 2.000E+11 0.000 07900.0 !2 ! !secondary h atoms md+h=md3j+h2 1.300e+06 2.400 04471.0 !2 md+ho2=md3j+h2o2 5.880e+04 2.500 14860.0 !2 md+oh=md3j+h2o 4.670e+07 1.610 -00035.0 !2 md+o2=md3j+ho2 4.000e+13 0.000 50160.0 !2 md+o=md3j+oh 5.946e+05 2.440 02846.0 !2 md+ch3=md3j+ch4 8.400e+04 2.130 07574.0 !2 md+ch3o=md3j+ch3oh 1.100e+11 0.000 05000.0 !2 md+ch3o2=md3j+ch3o2h 5.880e+04 2.500 14860.0 !2 md+c2h3=md3j+c2h4 4.000e+11 0.000 16800.0 !2 md+c2h5=md3j+c2h6 5.000e+10 0.000 10400.0 !2 ! md+h=md4j+h2 1.300e+06 2.400 04471.0 !2 md+ho2=md4j+h2o2 5.880e+04 2.500 14860.0 !2 md+oh=md4j+h2o 4.670e+07 1.610 -00035.0 !2 md+o2=md4j+ho2 4.000e+13 0.000 50160.0 !2 md+o=md4j+oh 5.946e+05 2.440 02846.0 !2 md+ch3=md4j+ch4 8.400e+04 2.130 07574.0 !2 md+ch3o=md4j+ch3oh 1.100e+11 0.000 05000.0 !2 md+ch3o2=md4j+ch3o2h 5.880e+04 2.500 14860.0 !2 md+c2h3=md4j+c2h4 4.000e+11 0.000 16800.0 !2 md+c2h5=md4j+c2h6 5.000e+10 0.000 10400.0 !2 ! md+h=md5j+h2 1.300e+06 2.400 04471.0 !2 md+ho2=md5j+h2o2 5.880e+04 2.500 14860.0 !2 md+oh=md5j+h2o 4.670e+07 1.610 -00035.0 !2 md+o2=md5j+ho2 4.000e+13 0.000 50160.0 !2 md+o=md5j+oh 5.946e+05 2.440 02846.0 !2 md+ch3=md5j+ch4 8.400e+04 2.130 07574.0 !2 md+ch3o=md5j+ch3oh 1.100e+11 0.000 05000.0 !2 md+ch3o2=md5j+ch3o2h 5.880e+04 2.500 14860.0 !2 md+c2h3=md5j+c2h4 4.000e+11 0.000 16800.0 !2 md+c2h5=md5j+c2h6 5.000e+10 0.000 10400.0 !2 ! md+h=md6j+h2 1.300e+06 2.400 04471.0 !2 md+ho2=md6j+h2o2 5.880e+04 2.500 14860.0 !2 md+oh=md6j+h2o 4.670e+07 1.610 -00035.0 !2 md+o2=md6j+ho2 4.000e+13 0.000 50160.0 !2 md+o=md6j+oh 5.946e+05 2.440 02846.0 !2 md+ch3=md6j+ch4 8.400e+04 2.130 07574.0 !2 md+ch3o=md6j+ch3oh 1.100e+11 0.000 05000.0 !2 md+ch3o2=md6j+ch3o2h 5.880e+04 2.500 14860.0 !2 md+c2h3=md6j+c2h4 4.000e+11 0.000 16800.0 !2 md+c2h5=md6j+c2h6 5.000e+10 0.000 10400.0 !2 ! md+h=md7j+h2 1.300e+06 2.400 04471.0 !2 md+ho2=md7j+h2o2 5.880e+04 2.500 14860.0 !2 md+oh=md7j+h2o 4.670e+07 1.610 -00035.0 !2 md+o2=md7j+ho2 4.000e+13 0.000 50160.0 !2 md+o=md7j+oh 5.946e+05 2.440 02846.0 !2 md+ch3=md7j+ch4 8.400e+04 2.130 07574.0 !2 md+ch3o=md7j+ch3oh 1.100e+11 0.000 05000.0 !2 md+ch3o2=md7j+ch3o2h 5.880e+04 2.500 14860.0 !2 md+c2h3=md7j+c2h4 4.000e+11 0.000 16800.0 !2 md+c2h5=md7j+c2h6 5.000e+10 0.000 10400.0 !2 ! md+h=md8j+h2 1.300e+06 2.400 04471.0 !2 md+ho2=md8j+h2o2 5.880e+04 2.500 14860.0 !2 md+oh=md8j+h2o 4.670e+07 1.610 -00035.0 !2 md+o2=md8j+ho2 4.000e+13 0.000 50160.0 !2 md+o=md8j+oh 5.946e+05 2.440 02846.0 !2 md+ch3=md8j+ch4 8.400e+04 2.130 07574.0 !2 md+ch3o=md8j+ch3oh 1.100e+11 0.000 05000.0 !2 md+ch3o2=md8j+ch3o2h 5.880e+04 2.500 14860.0 !2 md+c2h3=md8j+c2h4 4.000e+11 0.000 16800.0 !2 md+c2h5=md8j+c2h6 5.000e+10 0.000 10400.0 !2 ! md+h=md9j+h2 1.300e+06 2.400 04471.0 !2 md+ho2=md9j+h2o2 5.880e+04 2.500 14860.0 !2 md+oh=md9j+h2o 4.670e+07 1.610 -00035.0 !2 md+o2=md9j+ho2 4.000e+13 0.000 50160.0 !2 md+o=md9j+oh 5.946e+05 2.440 02846.0 !2 md+ch3=md9j+ch4 8.400e+04 2.130 07574.0 !2 md+ch3o=md9j+ch3oh 1.100e+11 0.000 05000.0 !2 md+ch3o2=md9j+ch3o2h 5.880e+04 2.500 14860.0 !2 md+c2h3=md9j+c2h4 4.000e+11 0.000 16800.0 !2 md+c2h5=md9j+c2h6 5.000e+10 0.000 10400.0 !2 ! !primary h atoms md+h=md10j+h2 9.400e+04 2.750 06280.0 !2 md+ho2=md10j+h2o2 4.050e+04 2.500 16690.0 !2 md+oh=md10j+h2o 5.270e+09 0.970 01590.0 !2 md+o2=md10j+ho2 6.000e+13 0.000 52800.0 !2 md+o=md10j+oh 1.046e+06 2.420 04766.0 !2 md+ch3=md10j+ch4 4.520e-01 3.650 07154.0 !2 md+ch3o=md10j+ch3oh 1.500e+10 0.000 07000.0 !2 md+ch3o2=md10j+ch3o2h 4.050e+04 2.500 16690.0 !2 md+c2h3=md10j+c2h4 5.000e+11 0.000 18000.0 !2 md+c2h5=md10j+c2h6 5.000e+10 0.000 13400.0 !2 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!! ! 3/decompositions ! !!!!!!!!!!!!!!!!!!!!!!!! ! !3a/Radicals from unimolecular initiations c2h4+mo8j=md10j 8.800e+03 2.480 06130.0 !3 md9d+h=md10j 2.500e+11 0.510 02620.0 !3 ms7j+c3h6=md9j 8.800e+03 2.480 06130.0 !3 md9d+h=md9j 4.240e+11 0.510 01230.0 !3 md8d+h=md9j 2.500e+11 0.510 02620.0 !3 mn8d+ch3=md8j 1.760e+04 2.480 06130.0 !3 c4h8-1+mh6j=md8j 8.800e+03 2.480 06130.0 !3 md8d+h=md8j 2.500e+11 0.510 02620.0 !3 md7d+h=md8j 2.500e+11 0.510 02620.0 !3 mo7d+c2h5=md7j 8.800e+03 2.480 06130.0 !3 c5h10-1+mf5j=md7j 8.800e+03 2.480 06130.0 !3 md7d+h=md7j 2.500e+11 0.510 02620.0 !3 md6d+h=md7j 2.500e+11 0.510 02620.0 !3 nc3h7+ms6d=md6j 8.800e+03 2.480 06130.0 !3 c6h12-1+mb4j=md6j 8.800e+03 2.480 06130.0 !3 md6d+h=md6j 2.500e+11 0.510 02620.0 !3 md5d+h=md6j 2.500e+11 0.510 02620.0 !3 pc4h9+mh5d=md5j 8.800e+03 2.480 06130.0 !3 c7h14-1+mp3j=md5j 8.800e+03 2.480 06130.0 !3 md5d+h=md5j 2.500e+11 0.510 02620.0 !3 md4d+h=md5j 2.500e+11 0.510 02620.0 !3 c5h11-1+mf4d=md4j 8.800e+03 2.480 06130.0 !3 c8h16-1+me2j=md4j 2.000e+11 0.000 07600.0 !3 from mb mechanism md4d+h=md4j 2.500e+11 0.510 02620.0 !3 md3d+h=md4j 2.500e+11 0.510 02620.0 !3 c6h13-1+mb3d=md3j 8.800e+03 2.480 06130.0 !3 c9h18-1+ch3oco=md3j 1.055e+11 0.000 07350.0 !3 from mb mechanism md3d+h=md3j 2.500e+11 0.510 02620.0 !3 md2d+h=md3j 1.000e+13 0.000 02900.0 !3 from mb mechanism c7h15-1+mp2d=md2j 1.000e+11 0.000 07600.0 !3 from mb mechanism but c7h15-1 instead of ch3! md2d+h=md2j 1.000e+13 0.000 02900.0 !3 from mb mechanism ch3o+c8h17chco=md2j 5.000e+11 0.000 -01000.0 !3 from mb mechanism ch2o+c9h19co=mdmj 2.000e+11 0.000 20090.0 !3 henry et all., 2003 adition of ch3 to o of ch2o c2h4+ms7j=mn9j 8.800e+03 2.480 06130.0 !3 mn8d+h=mn9j 2.500e+11 0.510 02620.0 !3 c2h4+mh6j=mo8j 8.800e+03 2.480 06130.0 !3 mo7d+h=mo8j 2.500e+11 0.510 02620.0 !3 c2h4+mf5j=ms7j 8.800e+03 2.480 06130.0 !3 ms6d+h=ms7j 2.500e+11 0.510 02620.0 !3 c2h4+mb4j=mh6j 8.800e+03 2.480 06130.0 !3 mh5d+h=mh6j 2.500e+11 0.510 02620.0 !3 c2h4+mp3j=mf5j 8.800e+03 2.480 06130.0 !3 mf4d+h=mf5j 2.500e+11 0.510 02620.0 !3 c2h4+me2j=mb4j 2.000e+11 0.000 07600.0 !3 from mb mechanism mb3d+h=mb4j 2.500e+11 0.510 02620.0 !3 c2h4+ch3oco=mp3j 1.055e+11 0.000 07350.0 !3 from mb mechanism mp2d+h=mp3j 1.000e+13 0.000 02900.0 !3 from mb mechanism ch2co+ch3o=me2j 5.000e+11 0.000 -01000.0 !3 from mb mechanism c2h4+c7h15-1=c9h19-1 8.800e+03 2.480 06130.0 !3 c9h18-1+h=c9h19-1 2.500e+11 0.510 02620.0 !3 c2h4+c6h13-1=c8h17-1 8.800e+03 2.480 06130.0 !3 c8h16-1+h=c8h17-1 2.500e+11 0.510 02620.0 !3 !c2h4+c5h11-1=c7h15-1 8.800e+03 2.480 06130.0 !3 !c7h14-1+h=c7h15-1 2.500e+11 0.510 02620.0 !3 !c2h4+pc4h9=c6h13-1 8.800e+03 2.480 06130.0 !3 !c6h12-1+h=c6h13-1 2.500e+11 0.510 02620.0 !3 !nc3h7+c2h4=c5h11-1 8.800e+03 2.480 06130.0 !3 !c5h10-1+h=c5h11-1 2.500e+11 0.510 02620.0 !3 !c2h4+c2h5=pc4h9 1.320e+04 2.480 06130.0 !3 !c4h8-1+h=pc4h9 2.500e+11 0.510 02620.0 !3 co2+c9h19-1=daoj 1.000e+11 0.000 39360.0 !3 from mb mechanism c8h17chco+h=c9h19co 1.000e+13 0.000 02900.0 !3 from mb mechanism ch2co+c8h17-1=c9h19co 1.000e+11 0.000 07600.0 !3 from mb mechanism c9h19-1+co=c9h19co 1.510e+11 0.000 04810.0 !3 ! ! !3b/Radicals from isomerizations c3h6+mh6j=mn8j 8.800e+03 2.480 06130.0 !3 mn8d+h=mn8j 4.240e+11 0.510 01230.0 !3 mn7d+h=mn8j 2.500e+11 0.510 02620.0 !3 c4h8-1+mf5j=mn7j 1.760e+04 2.480 06130.0 !3 ch3+mo7d=mn7j 8.800e+03 2.480 06130.0 !3 mn7d+h=mn7j 2.500e+11 0.510 02620.0 !3 mn6d+h=mn7j 2.500e+11 0.510 02620.0 !3 c5h10-1+mb4j=mn6j 8.800e+03 2.480 06130.0 !3 c2h5+ms6d=mn6j 8.800e+03 2.480 06130.0 !3 mn6d+h=mn6j 2.500e+11 0.510 02620.0 !3 mn5d+h=mn6j 2.500e+11 0.510 02620.0 !3 c6h12-1+mp3j=mn5j 8.800e+03 2.480 06130.0 !3 nc3h7+mh5d=mn5j 8.800e+03 2.480 06130.0 !3 mn5d+h=mn5j 2.500e+11 0.510 02620.0 !3 mn4d+h=mn5j 2.500e+11 0.510 02620.0 !3 c7h14-1+me2j=mn4j 2.000e+11 0.000 07600.0 !3 from mb mechanism pc4h9+mf4d=mn4j 8.800e+03 2.480 06130.0 !3 mn4d+h=mn4j 2.500e+11 0.510 02620.0 !3 mn3d+h=mn4j 2.500e+11 0.510 02620.0 !3 c8h16-1+ch3oco=mn3j 1.055e+11 0.000 07350.0 !3 from mb mechanism c5h11-1+mb3d=mn3j 8.800e+03 2.480 06130.0 !3 mn3d+h=mn3j 2.500e+11 0.510 02620.0 !3 mn2d+h=mn3j 1.000e+13 0.000 02900.0 !3 from mb mechanism c6h13-1+mp2d=mn2j 1.000e+11 0.000 07600.0 !3 from mb mechanism but c6h13-1 instead of ch3! mn2d+h=mn2j 1.000e+13 0.000 02900.0 !3 from mb mechanism ch3o+c7h15chco=mn2j 5.000e+11 0.000 -01000.0 !3 from mb mechanism ch2o+c8h17co=mnmj 2.000e+11 0.000 20090.0 !3 henry et all., 2003 adition of ch3 to o of ch2o ! c3h6+mf5j=mo7j 8.800e+03 2.480 06130.0 !3 mo7d+h=mo7j 4.240e+11 0.510 01230.0 !3 mo6d+h=mo7j 2.500e+11 0.510 02620.0 !3 c4h8-1+mb4j=mo6j 1.760e+04 2.480 06130.0 !3 ch3+ms6d=mo6j 8.800e+03 2.480 06130.0 !3 mo6d+h=mo6j 2.500e+11 0.510 02620.0 !3 mo5d+h=mo6j 2.500e+11 0.510 02620.0 !3 c5h10-1+mp3j=mo5j 8.800e+03 2.480 06130.0 !3 c2h5+mh5d=mo5j 8.800e+03 2.480 06130.0 !3 mo5d+h=mo5j 2.500e+11 0.510 02620.0 !3 mo4d+h=mo5j 2.500e+11 0.510 02620.0 !3 c6h12-1+me2j=mo4j 2.000e+11 0.000 07600.0 !3 from mb mechanism nc3h7+mf4d =mo4j 8.800e+03 2.480 06130.0 !3 mo4d+h=mo4j 2.500e+11 0.510 02620.0 !3 mo3d+h=mo4j 2.500e+11 0.510 02620.0 !3 c7h14-1+ch3oco=mo3j 1.055e+11 0.000 07350.0 !3 from mb mechanism pc4h9+mb3d=mo3j 8.800e+03 2.480 06130.0 !3 mo3d+h=mo3j 2.500e+11 0.510 02620.0 !3 mo2d+h=mo3j 1.000e+13 0.000 02900.0 !3 from mb mechanism c5h11-1+mp2d=mo2j 1.000e+11 0.000 07600.0 !3 from mb mechanism but c5h11-1 instead of ch3! mo2d+h=mo2j 1.000e+13 0.000 02900.0 !3 from mb mechanism ch3o+c6h13chco=mo2j 5.000e+11 0.000 -01000.0 !3 from mb mechanism ch2o+c7h15co=mojm 2.000e+11 0.000 20090.0 !3 henry et all., 2003 adition of ch3 to o of ch2o c3h6+mb4j=ms6j 8.800e+03 2.480 06130.0 !3 ms6d+h=ms6j 4.240e+11 0.510 01230.0 !3 ms5d+h=ms6j 2.500e+11 0.510 02620.0 !3 c4h8-1+mp3j=ms5j 1.760e+04 2.480 06130.0 !3 ch3+mh5d=ms5j 8.800e+03 2.480 06130.0 !3 ms5d+h=ms5j 2.500e+11 0.510 02620.0 !3 ms4d+h=ms5j 2.500e+11 0.510 02620.0 !3 c5h10-1+me2j=ms4j 2.000e+11 0.000 07600.0 !3 from mb mechanism c2h5+mf4d=ms4j 8.800e+03 2.480 06130.0 !3 ms4d+h=ms4j 2.500e+11 0.510 02620.0 !3 ms3d+h=ms4j 2.500e+11 0.510 02620.0 !3 c6h12-1+ch3oco=ms3j 1.055e+11 0.000 07350.0 !3 from mb mechanism nc3h7+mb3d=ms3j 8.800e+03 2.480 06130.0 !3 ms3d+h=ms3j 2.500e+11 0.510 02620.0 !3 ms2d+h=ms3j 1.000e+13 0.000 02900.0 !3 from mb mechanism pc4h9+mp2d=ms2j 1.000e+11 0.000 07600.0 !3 from mb mechanism but pc4h9 instead of ch3! ms2d+h=ms2j 1.000e+13 0.000 02900.0 !3 from mb mechanism ch3o+c5h11chco=ms2j 5.000e+11 0.000 -01000.0 !3 from mb mechanism ch2o+c6h13co=msmj 2.000e+11 0.000 20090.0 !3 henry et all., 2003 adition of ch3 to o of ch2o ! c3h6+mp3j=mh5j 8.800e+03 2.480 06130.0 !3 mh5d+h=mh5j 4.240e+11 0.510 01230.0 !3 mh4d+h=mh5j 2.500e+11 0.510 02620.0 !3 c4h8-1+me2j=mh4j 2.000e+11 0.000 07600.0 !3 from mb mechanism ch3+mf4d=mh4j 8.800e+03 2.480 06130.0 !3 mh4d+h=mh4j 2.500e+11 0.510 02620.0 !3 mh3d+h=mh4j 2.500e+11 0.510 02620.0 !3 c5h10-1+ch3oco=mh3j 1.055e+11 0.000 07350.0 !3 from mb mechanism c2h5+mb3d=mh3j 8.800e+03 2.480 06130.0 !3 mh3d+h=mh3j 2.500e+11 0.510 02620.0 !3 mh2d+h=mh3j 1.000e+13 0.000 02900.0 !3 from mb mechanism nc3h7+mp2d=mh2j 1.000e+11 0.000 07600.0 !3 from mb mechanism but nc3h7 instead of ch3! mh2d+h=mh2j 1.000e+13 0.000 02900.0 !3 from mb mechanism ch3o+c4h9chco=mh2j 5.000e+11 0.000 -01000.0 !3 from mb mechanism ch2o+c5h11co=mhmj 2.000e+11 0.000 20090.0 !3 henry et all., 2003 adition of ch3 to o of ch2o ! c3h6+me2j=mf4j 2.000e+11 0.000 07600.0 !3 from mb mechanism mf4d+h=mf4j 4.240e+11 0.510 01230.0 !3 mf3d+h=mf4j 2.500e+11 0.510 02620.0 !3 c4h8-1+ch3oco=mf3j 1.055e+11 0.000 07350.0 !3 from mb mechanism ch3+mb3d=mf3j 8.800e+03 2.480 06130.0 !3 mf3d+h=mf3j 2.500e+11 0.510 02620.0 !3 mf2d+h=mf3j 1.000e+13 0.000 02900.0 !3 from mb mechanism c2h5+mp2d=mf2j 1.000e+11 0.000 07600.0 !3 from mb mechanism but c2h5 instead of ch3! mf2d+h=mf2j 1.000e+13 0.000 02900.0 !3 from mb mechanism ch3o+c3h7chco=mf2j 5.000e+11 0.000 -01000.0 !3 from mb mechanism ch2o+c4h9co=mfmj 2.000e+11 0.000 20090.0 !3 henry et all., 2003 adition of ch3 to o of ch2o ! c3h6+ch3oco=mb3j 1.055e+11 0.000 07350.0 !3 from mb mechanism mb3d+h=mb3j 2.500e+11 0.510 02620.0 !3 mb2d+h=mb3j 1.000e+13 0.000 02900.0 !3 from mb mechanism ch3+mp2d=mb2j 1.000e+11 0.000 07600.0 !3 from mb mechanism mb2d+h=mb2j 1.000e+13 0.000 02900.0 !3 from mb mechanism ch3o+c2h5chco=mb2j 5.000e+11 0.000 -01000.0 !3 from mb mechanism ch2o+c3h7co=mbmj 2.000e+11 0.000 20090.0 !3 henry et all., 2003 adition of ch3 to o of ch2o ! mp2d+h=mp2j 1.000e+13 0.000 02900.0 !3 from mb mechanism ch3o+ch3chco=mp2j 5.000e+11 0.000 -01000.0 !3 from mb mechanism ch2o+c2h5co=mpmj 2.000e+11 0.000 20090.0 !3 henry et all., 2003 adition of ch3 to o of ch2o ! ch2o+ch3co=memj 2.000e+11 0.000 20090.0 !3 henry et all., 2003 adition of ch3 to o of ch2o ! c6h13-1+c3h6=c9h19-2 8.800e+03 2.480 06130.0 !3 c9h18-1+h=c9h19-2 4.240e+11 0.510 01230.0 !3 c9h18-2+h=c9h19-2 2.500e+11 0.510 02620.0 !3 c5h11-1+c4h8-1=c9h19-3 8.800e+03 2.480 06130.0 !3 ch3+c8h16-1=c9h19-3 8.800e+03 2.480 06130.0 !3 c9h18-2+h=c9h19-3 2.500e+11 0.510 02620.0 !3 c9h18-3+h=c9h19-3 2.500e+11 0.510 02620.0 !3 pc4h9+c5h10-1=c9h19-4 8.800e+03 2.480 06130.0 !3 c2h5+c7h14-1=c9h19-4 8.800e+03 2.480 06130.0 !3 c9h18-3+h=c9h19-4 2.500e+11 0.510 02620.0 !3 c9h18-4+h=c9h19-4 2.500e+11 0.510 02620.0 !3 nc3h7+c6h12-1=c9h19-5 1.760e+04 2.480 06130.0 !3 c9h18-4+h=c9h19-5 5.000e+11 0.510 02620.0 !3 ! c5h11-1+c3h6=c8h17-2 8.800e+03 2.480 06130.0 !3 c8h16-1+h=c8h17-2 4.240e+11 0.510 01230.0 !3 c8h16-2+h=c8h17-2 2.500e+11 0.510 02620.0 !3 pc4h9+c4h8-1=c8h17-3 8.800e+03 2.480 06130.0 !3 ch3+c7h14-1=c8h17-3 8.800e+03 2.480 06130.0 !3 c8h16-2+h=c8h17-3 2.500e+11 0.510 02620.0 !3 c8h16-3+h=c8h17-3 2.500e+11 0.510 02620.0 !3 nc3h7+c5h10-1=c8h17-4 8.800e+03 2.480 06130.0 !3 c2h5+c6h12-1=c8h17-4 8.800e+03 2.480 06130.0 !3 c8h16-3+h=c8h17-4 2.500e+11 0.510 02620.0 !3 c8h16-4+h=c8h17-4 2.500e+11 0.510 02620.0 !3 ! !pc4h9+c3h6=c7h15-2 8.800e+03 2.480 06130.0 !3 !c7h14-1+h=c7h15-2 4.240e+11 0.510 01230.0 !3 !c7h14-2+h=c7h15-2 2.500e+11 0.510 02620.0 !3 !nc3h7+c4h8-1=c7h15-3 8.800e+03 2.480 06130.0 !3 !ch3+c6h12-1=c7h15-3 8.800e+03 2.480 06130.0 !3 !c7h14-2+h=c7h15-3 2.500e+11 0.510 02620.0 !3 !c7h14-3+h=c7h15-3 2.500e+11 0.510 02620.0 !3 !c2h5+c5h10-1=c7h15-4 1.760e+04 2.480 06130.0 !3 !c7h14-3+h=c7h15-4 5.000e+11 0.510 02620.0 !3 ! !nc3h7+c3h6=c6h13-2 8.800e+03 2.480 06130.0 !3 !c6h12-1+h=c6h13-2 4.240e+11 0.510 01230.0 !3 !c6h12-2+h=c6h13-2 2.500e+11 0.510 02620.0 !3 !c2h5+c4h8-1=c6h13-3 8.800e+03 2.480 06130.0 !3 !ch3+c5h10-1=c6h13-3 8.800e+03 2.480 06130.0 !3 !c6h12-2+h=c6h13-3 2.500e+11 0.510 02620.0 !3 !c6h12-3+h=c6h13-3 2.500e+11 0.510 02620.0 !3 ! !c2h5+c3h6=c5h11-2 8.800e+03 2.480 06130.0 !3 !c5h10-1+h=c5h11-2 4.240e+11 0.510 01230.0 !3 !c5h10-2+h=c5h11-2 2.500e+11 0.510 02620.0 !3 !c4h8-1+ch3=c5h11-3 1.760e+04 2.480 06130.0 !3 !c5h10-2+h=c5h11-3 5.000e+11 0.510 02620.0 !3 ! !c3h6+ch3=sc4h9 1.760e+04 2.480 06130.0 !3 !c4h8-1+h=sc4h9 4.240e+11 0.510 01230.0 !3 !c4h8-2+h=sc4h9 2.500e+11 0.510 02620.0 !3 ! c7h15chco+h=c8h17co 1.000e+13 0.000 02900.0 !3 from mb mechanism ch2co+c7h15-1=c8h17co 1.000e+11 0.000 07600.0 !3 from mb mechanism c8h17-1+co=c8h17co 1.510e+11 0.000 04810.0 !3 ! c6h13chco+h=c7h15co 1.000e+13 0.000 02900.0 !3 from mb mechanism ch2co+c6h13-1=c7h15co 1.000e+11 0.000 07600.0 !3 from mb mechanism c7h15-1+co=c7h15co 1.510e+11 0.000 04810.0 !3 ! c5h11chco+h=c6h13co 1.000e+13 0.000 02900.0 !3 from mb mechanism ch2co+c5h11-1=c6h13co 1.000e+11 0.000 07600.0 !3 from mb mechanism c6h13-1+co=c6h13co 1.510e+11 0.000 04810.0 !3 ! c4h9chco+h=c5h11co 1.000e+13 0.000 02900.0 !3 from mb mechanism ch2co+pc4h9=c5h11co 1.000e+11 0.000 07600.0 !3 from mb mechanism c5h11-1+co=c5h11co 1.510e+11 0.000 04810.0 !3 ! c3h7chco+h=c4h9co 1.000e+13 0.000 02900.0 !3 from mb mechanism ch2co+nc3h7=c4h9co 1.000e+11 0.000 07600.0 !3 from mb mechanism pc4h9+co=c4h9co 1.510e+11 0.000 04810.0 !3 ! c2h5chco+h=c3h7co 1.000e+13 0.000 02900.0 !3 from mb mechanism ch2co+c2h5=c3h7co 1.000e+11 0.000 07600.0 !3 from mb mechanism nc3h7+co=c3h7co 1.510e+11 0.000 04810.0 !3 ! ch3chco+h=c2h5co 1.000e+13 0.000 02900.0 !3 from mb mechanism ch2co+ch3=c2h5co 1.000e+11 0.000 07600.0 !3 from mb mechanism !c2h5+co=c2h5co already in reactions of c2 species ! ! !3c/Radicals from additions ! !Radicals from olefins + ch3 c4h8-1+c6h13-1=c10h21-3 8.800e+03 2.480 06130.0 !3 c3h6+c7h15-1=c9h181ch32 8.800e+03 2.480 06130.0 !3 c3h6+c6h13-1=c8h161ch32 8.800e+03 2.480 06130.0 !3 c3h6+c5h11-1=c7h141ch32 8.800e+03 2.480 06130.0 !3 c3h6+pc4h9=c6h121ch32 8.800e+03 2.480 06130.0 !3 c3h6+nc3h7=c5h101ch32 8.800e+03 2.480 06130.0 !3 c3h6+c2h5=c4h81ch32 8.800e+03 2.480 06130.0 !3 h+ic4h8=ic4h9 1.811e+31 -5.840 08935.0 !3 ! ! !Radicals from olefins + oh and from isomerizations c3h6+oh=c3h5oh2d1+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 c3h6+oh=c3h5oh1d1+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 !c4h8-1+oh=c4h7oh2d1+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 !c4h8-1+oh=c4h7oh1d1+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 !c5h10-1+oh=c5h9oh2d1+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 !c5h10-1+oh=c5h9oh1d1+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 !c6h12-1+oh=c6h11oh2d1+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 !c6h12-1+oh=c6h11oh1d1+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 !c7h14-1+oh=c7h13oh2d1+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 !c7h14-1+oh=c7h13oh1d1+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 c8h16-1+oh=c8h15oh2d1+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 c8h16-1+oh=c8h15oh1d1+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 c9h18-1+oh=c9h17oh2d1+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 c9h18-1+oh=c9h17oh1d1+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 ! ch3+c2h3oh=c3h6oh2j1 1.890e+03 2.670 06850.0 !3 Curran, 2006 c3h6+ch3=ic4h9 !nc3h7+ch2o=pc4h9o 5.000e+10 0.000 03457.0 !3 Curran, 2006 !c3h7cho+h=pc4h9o 4.000e+12 0.000 06260.0 !3 Curran, 2006 ch3cho+h !ch3+c3h5oh1d2=c4h8oh1j2 1.760e+04 2.480 06130.0 !3 Curran, 2006 ch3+c3h6=sc4h9 !ch3+c2h5cho=sc4h9o 5.000e+10 0.000 09043.0 !3 Curran, 2006 !c2h5+ch3cho=sc4h9o 3.330e+10 0.000 06397.0 !3 Curran, 2006 !c2h5coch3+h=sc4h9o 2.000e+12 0.000 07270.0 !3 Curran, 2006 ch3coch3+h !c2h5+c2h3oh=c4h8oh2j1 1.890e+03 2.670 06850.0 !3 Curran, 2006 c3h6+ch3=ic4h9 !pc4h9+ch2o=c5h11o-1 5.000e+10 0.000 03457.0 !3 Curran, 2006 nc3h7+ch2o !c4h9cho+h=c5h11o-1 4.000e+12 0.000 06260.0 !3 Curran, 2006 ch3cho+h !c2h5+c3h5oh1d2=c5h10oh1j2 8.800e+03 2.480 06130.0 !3 Curran, 2006 c3h6+c2h5=c5h11-2 !ch3+c3h7cho=c5h11o-2 5.000e+10 0.000 09043.0 !3 Curran, 2006 c2h5cho+ch3 !nc3h7+ch3cho=c5h11o-2 3.330e+10 0.000 06397.0 !3 Curran, 2006 c2h5+ch3cho !c3h7coch3+h=c5h11o-2 2.000e+12 0.000 07270.0 !3 Curran, 2006 ch3coch3+h !nc3h7+c2h3oh=c5h10oh2j1 1.890e+03 2.670 06850.0 !3 Curran, 2006 c3h6+ch3=ic4h9 !c5h11-1+ch2o=c6h13o-1 5.000e+10 0.000 03457.0 !3 Curran, 2006 nc3h7+ch2o !c5h11cho+h=c6h13o-1 4.000e+12 0.000 06260.0 !3 Curran, 2006 ch3cho+h !nc3h7+c3h5oh1d2=c6h12oh1j2 8.800e+03 2.480 06130.0 !3 Curran, 2006 c3h6+c2h5=c5h11-2 !ch3+c4h9cho=c6h13o-2 5.000e+10 0.000 09043.0 !3 Curran, 2006 c2h5cho+ch3 !pc4h9+ch3cho=c6h13o-2 3.330e+10 0.000 06397.0 !3 Curran, 2006 c2h5+ch3cho !c4h9coch3+h=c6h13o-2 2.000e+12 0.000 07270.0 !3 Curran, 2006 ch3coch3+h !pc4h9+c2h3oh=c6h12oh2j1 1.890e+03 2.670 06850.0 !3 Curran, 2006 c3h6+ch3=ic4h9 !c6h13-1+ch2o=c7h15o-1 5.000e+10 0.000 03457.0 !3 Curran, 2006 nc3h7+ch2o !c6h13cho+h=c7h15o-1 4.000e+12 0.000 06260.0 !3 Curran, 2006 ch3cho+h !pc4h9+c3h5oh1d2=c7h14oh1j2 8.800e+03 2.480 06130.0 !3 Curran, 2006 c3h6+c2h5=c5h11-2 !ch3+c5h11cho=c7h15o-2 5.000e+10 0.000 09043.0 !3 Curran, 2006 c2h5cho+ch3 !c5h11-1+ch3cho=c7h15o-2 3.330e+10 0.000 06397.0 !3 Curran, 2006 c2h5+ch3cho !c5h11coch3+h=c7h15o-2 2.000e+12 0.000 07270.0 !3 Curran, 2006 ch3coch3+h !c5h11-1+c2h3oh=c7h14oh2j1 1.890e+03 2.670 06850.0 !3 Curran, 2006 c3h6+ch3=ic4h9 c7h15-1+ch2o=c8h17o-1 5.000e+10 0.000 03457.0 !3 Curran, 2006 nc3h7+ch2o c7h15cho+h=c8h17o-1 4.000e+12 0.000 06260.0 !3 Curran, 2006 ch3cho+h c5h11-1+c3h5oh1d2=c8h16oh1j2 8.800e+03 2.480 06130.0 !3 Curran, 2006 c3h6+c2h5=c5h11-2 ch3+c6h13cho=c8h17o-2 5.000e+10 0.000 09043.0 !3 Curran, 2006 c2h5cho+ch3 c6h13-1+ch3cho=c8h17o-2 3.330e+10 0.000 06397.0 !3 Curran, 2006 c2h5+ch3cho c6h13coch3+h=c8h17o-2 2.000e+12 0.000 07270.0 !3 Curran, 2006 ch3coch3+h c6h13-1+c2h3oh=c8h16oh2j1 1.890e+03 2.670 06850.0 !3 Curran, 2006 c3h6+ch3=ic4h9 c8h17-1+ch2o=c9h19o-1 5.000e+10 0.000 03457.0 !3 Curran, 2006 nc3h7+ch2o c8h17cho+h=c9h19o-1 4.000e+12 0.000 06260.0 !3 Curran, 2006 ch3cho+h c6h13-1+c3h5oh1d2=c9h18oh1j2 8.800e+03 2.480 06130.0 !3 Curran, 2006 c3h6+c2h5=c5h11-2 ch3+c7h15cho=c9h19o-2 5.000e+10 0.000 09043.0 !3 Curran, 2006 c2h5cho+ch3 c7h15-1+ch3cho=c9h19o-2 3.330e+10 0.000 06397.0 !3 Curran, 2006 c2h5+ch3cho c7h15coch3+h=c9h19o-2 2.000e+12 0.000 07270.0 !3 Curran, 2006 ch3coch3+h c7h15-1+c2h3oh=c9h18oh2j1 1.890e+03 2.670 06850.0 !3 Curran, 2006 c3h6+ch3=ic4h9 ! mp2d+oh=mp2doh2+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 mp2d+oh=mp2doh3+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 mb3d+oh=mb3doh3+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 mb3d+oh=mb3doh4+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 mf4d+oh=mf4doh4+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 mf4d+oh=mf4doh5+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 mh5d+oh=mh5doh5+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 mh5d+oh=mh5doh6+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 ms6d+oh=ms6doh6+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 ms6d+oh=ms6doh7+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 mo7d+oh=mo7doh7+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 mo7d+oh=mo7doh8+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 mn8d+oh=mn8doh8+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 mn8d+oh=mn8doh9+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 md9d+oh=md9doh9+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 md9d+oh=md9doh10+h 3.041e+07 1.380 01615.0 !3 Zhu et al., 2005 c2h4+oh A/2 ! ch3o+ch2ohchco=mp2joh3 5.000e+11 0.000 -01000.0 !3 from mb mechanism ch3oco+c2h3oh=mp3joh2 1.055e+11 0.000 07350.0 !3 from mb mechanism c3h6+ch3oco ch3oco+c3h5oh1d2=mb3joh4 1.055e+11 0.000 07350.0 !3 from mb mechanism c3h6+ch3oco me2j+c2h3oh=mb4joh3 1.760e+04 2.480 06130.0 !3 Curran, 2006 ch3+c3h6=sc4h9 me2j+c3h5oh1d2=mf4joh5 1.760e+04 2.480 06130.0 !3 Curran, 2006 ch3+c3h6=sc4h9 mp3j+c2h3oh=mf5joh4 1.760e+04 2.480 06130.0 !3 Curran, 2006 ch3+c3h6=sc4h9 mp3j+c3h5oh1d2=mh5joh6 1.760e+04 2.480 06130.0 !3 Curran, 2006 ch3+c3h6=sc4h9 mb4j+c2h3oh=mh6joh5 1.760e+04 2.480 06130.0 !3 Curran, 2006 ch3+c3h6=sc4h9 mb4j+c3h5oh1d2=ms6joh7 1.760e+04 2.480 06130.0 !3 Curran, 2006 ch3+c3h6=sc4h9 mf5j+c2h3oh=ms7joh6 1.760e+04 2.480 06130.0 !3 Curran, 2006 ch3+c3h6=sc4h9 mf5j+c3h5oh1d2=mo7joh8 1.760e+04 2.480 06130.0 !3 Curran, 2006 ch3+c3h6=sc4h9 mh6j+c2h3oh=mo8joh7 1.760e+04 2.480 06130.0 !3 Curran, 2006 ch3+c3h6=sc4h9 mh6j+c3h5oh1d2=mn8joh9 1.760e+04 2.480 06130.0 !3 Curran, 2006 ch3+c3h6=sc4h9 ms7j+c2h3oh=mn9joh8 1.760e+04 2.480 06130.0 !3 Curran, 2006 ch3+c3h6=sc4h9 ms7j+c3h5oh1d2=md9joh10 1.760e+04 2.480 06130.0 !3 Curran, 2006 ch3+c3h6=sc4h9 mo8j+c2h3oh=md10joh9 1.760e+04 2.480 06130.0 !3 Curran, 2006 ch3+c3h6=sc4h9 ! ch3+me2oxo=mp2o 5.000e+10 0.000 09043.0 !3 Curran, 2006 c2h5cho+ch3 h+mp2oxo=mp2o 2.000e+12 0.000 07270.0 !3 Curran, 2006 ch3coch3+h ch3cho+ch3oco=mp2o 3.330e+10 0.000 06397.0 !3 Curran, 2006 c2h5+ch3cho h+mp3oxo=mp3o 4.000e+12 0.000 06260.0 !3 Curran, 2006 ch3cho+h ch2o+me2j=mp3o 5.000e+10 0.000 03457.0 !3 Curran, 2006 nc3h7+ch2o ch3+mp3oxo=mb3o 5.000e+10 0.000 09043.0 !3 Curran, 2006 c2h5cho+ch3 h+mb3oxo=mb3o 2.000e+12 0.000 07270.0 !3 Curran, 2006 ch3coch3+h ch3cho+me2j=mb3o 3.330e+10 0.000 06397.0 !3 Curran, 2006 c2h5+ch3cho h+mb4oxo=mb4o 4.000e+12 0.000 06260.0 !3 Curran, 2006 ch3cho+h ch2o+mp3j=mb4o 5.000e+10 0.000 03457.0 !3 Curran, 2006 nc3h7+ch2o ch3+mb4oxo=mf4o 5.000e+10 0.000 09043.0 !3 Curran, 2006 c2h5cho+ch3 h+mf4oxo=mf4o 2.000e+12 0.000 07270.0 !3 Curran, 2006 ch3coch3+h ch3cho+mp3j=mf4o 3.330e+10 0.000 06397.0 !3 Curran, 2006 c2h5+ch3cho h+mf5oxo=mf5o 4.000e+12 0.000 06260.0 !3 Curran, 2006 ch3cho+h ch2o+mb4j=mf5o 5.000e+10 0.000 03457.0 !3 Curran, 2006 nc3h7+ch2o ch3+mf5oxo=mh5o 5.000e+10 0.000 09043.0 !3 Curran, 2006 c2h5cho+ch3 h+mh5oxo=mh5o 2.000e+12 0.000 07270.0 !3 Curran, 2006 ch3coch3+h ch3cho+mb4j=mh5o 3.330e+10 0.000 06397.0 !3 Curran, 2006 c2h5+ch3cho h+mh6oxo=mh6o 4.000e+12 0.000 06260.0 !3 Curran, 2006 ch3cho+h ch2o+mf5j=mh6o 5.000e+10 0.000 03457.0 !3 Curran, 2006 nc3h7+ch2o ch3+mh6oxo=ms6o 5.000e+10 0.000 09043.0 !3 Curran, 2006 c2h5cho+ch3 h+ms6oxo=ms6o 2.000e+12 0.000 07270.0 !3 Curran, 2006 ch3coch3+h ch3cho+mf5j=ms6o 3.330e+10 0.000 06397.0 !3 Curran, 2006 c2h5+ch3cho h+ms7oxo=ms7o 4.000e+12 0.000 06260.0 !3 Curran, 2006 ch3cho+h ch2o+mh6j=ms7o 5.000e+10 0.000 03457.0 !3 Curran, 2006 nc3h7+ch2o ch3+ms7oxo=mo7o 5.000e+10 0.000 09043.0 !3 Curran, 2006 c2h5cho+ch3 h+mo7oxo=mo7o 2.000e+12 0.000 07270.0 !3 Curran, 2006 ch3coch3+h ch3cho+mh6j=mo7o 3.330e+10 0.000 06397.0 !3 Curran, 2006 c2h5+ch3cho h+mo8oxo=mo8o 4.000e+12 0.000 06260.0 !3 Curran, 2006 ch3cho+h ch2o+ms7j=mo8o 5.000e+10 0.000 03457.0 !3 Curran, 2006 nc3h7+ch2o ch3+mo8oxo=mn8o 5.000e+10 0.000 09043.0 !3 Curran, 2006 c2h5cho+ch3 h+mn8oxo=mn8o 2.000e+12 0.000 07270.0 !3 Curran, 2006 ch3coch3+h ch3cho+ms7j=mn8o 3.330e+10 0.000 06397.0 !3 Curran, 2006 c2h5+ch3cho h+mn9oxo=mn9o 4.000e+12 0.000 06260.0 !3 Curran, 2006 ch3cho+h ch2o+mo8j=mn9o 5.000e+10 0.000 03457.0 !3 Curran, 2006 nc3h7+ch2o ch3+mn9oxo=md9o 5.000e+10 0.000 09043.0 !3 Curran, 2006 c2h5cho+ch3 h+md9oxo=md9o 2.000e+12 0.000 07270.0 !3 Curran, 2006 ch3coch3+h ch3cho+mo8j=md9o 3.330e+10 0.000 06397.0 !3 Curran, 2006 c2h5+ch3cho h+md10oxo=md10o 4.000e+12 0.000 06260.0 !3 Curran, 2006 ch3cho+h ch2o+mn9j=md10o 5.000e+10 0.000 03457.0 !3 Curran, 2006 nc3h7+ch2o ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 4/alkyl radical + o2 = olefin + ho2 ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! c2h5+o2=c2h4+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas nc3h7+o2=c3h6+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas !pc4h9+o2=c4h8-1+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas !c5h11-1+o2=c5h10-1+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas !c6h13-1+o2=c6h12-1+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas !c7h15-1+o2=c7h14-1+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas c8h17-1+o2=c8h16-1+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas c9h19-1+o2=c9h18-1+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas ! md2j+o2=md2d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas md3j+o2=md2d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas md3j+o2=md3d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas md4j+o2=md3d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas md4j+o2=md4d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas md5j+o2=md4d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas md5j+o2=md5d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas md6j+o2=md5d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas md6j+o2=md6d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas md7j+o2=md6d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas md7j+o2=md7d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas md8j+o2=md7d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas md8j+o2=md8d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas md9j+o2=md8d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas md9j+o2=md9d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas md10j+o2=md9d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas ! mn9j+o2=mn8d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas mo8j+o2=mo7d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas ms7j+o2=ms6d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas mh6j+o2=mh5d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas mf5j+o2=mf4d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas mb4j+o2=mb3d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas mp3j+o2=mp2d+ho2 1.600e+12 0.000 05000.0 !4 Nancy, Exgas ! ! ! !!!!!!!!!!!!!!!!!!!!!!!! ! 5/Isomerizations ! !!!!!!!!!!!!!!!!!!!!!!!! ! c9h19-1=c9h19-2 3.560e+10 0.880 37300.0 !5 matheu, 2003 1,2 h-shift p->s c9h19-1=c9h19-3 3.800e+10 0.670 36600.0 !5 matheu, 2003 1,3 h-shift p->s c9h19-1=c9h19-4 7.850e+11 -0.120 20600.0 !5 matheu, 2003 1,4 h-shift p->s c9h19-1=c9h19-5 1.830e+02 2.550 10960.0 !5 tsang, 2006 1,5 h-shift p->s (hexenyl radical) c9h19-2=c9h19-3 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s c9h19-2=c9h19-4 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s duplicate c9h19-2=c9h19-5 7.850e+11 -0.120 23500.0 !5 matheu, 2003 1,4 h-shift s->s c9h19-2=c9h19-4 3.67e+12 -0.600 14700.0 !5 1,5 h-shift s->s correlation from 1,4 h-shift s->s % p->p duplicate c9h19-3=c9h19-4 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s duplicate c9h19-3=c9h19-5 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s c9h19-3=c9h19-4 7.850e+11 -0.120 20600.0 !5 matheu, 2003 1,4 h-shift p->s duplicate c9h19-4=c9h19-5 3.67e+12 -0.600 14700.0 !5 1,5 h-shift s->s correlation from 1,4 h-shift s->s % p->p ! c8h17-1=c8h17-2 3.560e+10 0.880 37300.0 !5 matheu, 2003 1,2 h-shift p->s c8h17-1=c8h17-3 3.800e+10 0.670 36600.0 !5 matheu, 2003 1,3 h-shift p->s c8h17-1=c8h17-4 7.850e+11 -0.120 20600.0 !5 matheu, 2003 1,4 h-shift p->s duplicate c8h17-1=c8h17-4 1.830e+02 2.550 10960.0 !5 tsang, 2006 1,5 h-shift p->s (hexenyl radical) duplicate c8h17-2=c8h17-3 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s duplicate c8h17-2=c8h17-4 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s duplicate c8h17-2=c8h17-4 7.850e+11 -0.120 23500.0 !5 matheu, 2003 1,4 h-shift s->s duplicate c8h17-2=c8h17-3 3.67e+12 -0.600 14700.0 !5 1,5 h-shift s->s correlation from 1,4 h-shift s->s & p->p duplicate c8h17-3=c8h17-4 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s duplicate c8h17-3=c8h17-4 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s duplicate ! !c7h15-1=c7h15-2 3.560e+10 0.880 37300.0 !5 matheu, 2003 1,2 h-shift p->s !c7h15-1=c7h15-3 3.800e+10 0.670 36600.0 !5 matheu, 2003 1,3 h-shift p->s ! duplicate !c7h15-1=c7h15-4 7.850e+11 -0.120 20600.0 !5 matheu, 2003 1,4 h-shift p->s !c7h15-1=c7h15-3 1.830e+02 2.550 10960.0 !5 tsang, 2006 1,5 h-shift p->s (hexenyl radical) ! duplicate !c7h15-2=c7h15-3 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s ! duplicate !c7h15-2=c7h15-4 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s !c7h15-2=c7h15-3 7.850e+11 -0.120 23500.0 !5 matheu, 2003 1,4 h-shift s->s ! duplicate !c7h15-3=c7h15-4 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s ! !c6h13-1=c6h13-2 3.560e+10 0.880 37300.0 !5 matheu, 2003 1,2 h-shift p->s ! duplicate !c6h13-1=c6h13-3 3.800e+10 0.670 36600.0 !5 matheu, 2003 1,3 h-shift p->s ! duplicate !c6h13-1=c6h13-3 6.980e+00 3.200 16560.0 !5 tsang, 2006 1,4 h-shift p->s (hexenyl radical) ! duplicate !c6h13-1=c6h13-2 1.830e+02 2.550 10960.0 !5 tsang, 2006 1,5 h-shift p->s (hexenyl radical) ! duplicate !c6h13-2=c6h13-3 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s ! duplicate !c6h13-2=c6h13-3 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s ! duplicate ! !c5h11-1=c5h11-2 3.560e+10 0.880 37300.0 !5 matheu, 2003 1,2 h-shift p->s ! duplicate !c5h11-1=c5h11-3 3.800e+10 0.670 36600.0 !5 matheu, 2003 1,3 h-shift p->s !c5h11-1=c5h11-2 7.850e+11 -0.120 20600.0 !5 matheu, 2003 1,4 h-shift p->s ! duplicate !c5h11-2=c5h11-3 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s ! !pc4h9=sc4h9 3.560e+10 0.880 37300.0 !5 matheu, 2003 1,2 h-shift p->s ! duplicate !pc4h9=sc4h9 3.800e+10 0.670 36600.0 !5 matheu, 2003 1,3 h-shift p->s ! duplicate ! nc3h7=ic3h7 3.560e+10 0.880 37300.0 !5 matheu, 2003 1,2 h-shift p->s ! md10j=md9j 3.560e+10 0.880 37300.0 !5 matheu, 2003 1,2 h-shift p->s md10j=md8j 3.800e+10 0.670 36600.0 !5 matheu, 2003 1,3 h-shift p->s md10j=md7j 7.850e+11 -0.120 20600.0 !5 matheu, 2003 1,4 h-shift p->s md10j=md6j 1.830e+02 2.550 10960.0 !5 tsang, 2006 1,5 h-shift p->s (hexenyl radical) md9j=md8j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s md9j=md7j 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s md9j=md6j 7.850e+11 -0.120 23500.0 !5 matheu, 2003 1,4 h-shift s->s md9j=md5j 3.67e+12 -0.600 14700.0 !5 1,5 h-shift s->s correlation from 1,4 h-shift s->s & p->p md8j=md7j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s md8j=md6j 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s md8j=md5j 7.850e+11 -0.120 23500.0 !5 matheu, 2003 1,4 h-shift s->s md8j=md4j 3.670e+12 -0.600 14700.0 !5 1,5 h-shift s->s correlation from 1,4 h-shift s->s & p->p md7j=md6j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s md7j=md5j 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s md7j=md4j 7.850e+11 -0.120 23500.0 !5 matheu, 2003 1,4 h-shift s->s md7j=md3j 3.67e+12 -0.600 14700.0 !5 1,5 h-shift s->s correlation from 1,4 h-shift s->s & p->p md6j=md5j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s md6j=md4j 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s md6j=md3j 7.850e+11 -0.120 23500.0 !5 matheu, 2003 1,4 h-shift s->s md6j=md2j 3.670e+12 -0.600 13800.0 !5 1,5 h-shift s->t correlation from 1,4 h-shift s->t & p->p md5j=md4j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s md5j=md3j 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s md5j=md2j 7.850e+11 -0.120 20600.0 !5 matheu, 2003 1,4 h-shift assumed like s->t md4j=md3j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s md4j=md2j 3.800e+10 0.670 36100.0 !5 matheu, 2003 1,3 h-shift assumed like s->t md3j=md2j 3.560e+10 0.880 37700.0 !5 matheu, 2003 1,2 h-shift assumed like s->t mdmj=md3j 1.830e+02 2.550 10960.0 !5 tsang, 2006 1,5 h-shift p->s (hexenyl radical) mdmj=md2j 7.850e+11 -0.120 18300.0 !5 matheu, 2003 1,4 h-shift assumed like p->t ! mn9j=mn8j 3.560e+10 0.880 37300.0 !5 matheu, 2003 1,2 h-shift p->s mn9j=mn7j 3.800e+10 0.670 36600.0 !5 matheu, 2003 1,3 h-shift p->s mn9j=mn6j 7.850e+11 -0.120 20600.0 !5 matheu, 2003 1,4 h-shift p->s mn9j=mn5j 1.830e+02 2.550 10960.0 !5 tsang, 2006 1,5 h-shift p->s (hexenyl radical) mn8j=mn7j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s mn8j=mn6j 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s mn8j=mn8j 7.850e+11 -0.120 23500.0 !5 matheu, 2003 1,4 h-shift s->s mn8j=mn4j 3.670e+12 -0.600 14700.0 !5 1,5 h-shift s->s correlation from 1,4 h-shift s->s & p->p mn7j=mn6j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s mn7j=mn5j 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s mn7j=mn4j 7.850e+11 -0.120 23500.0 !5 matheu, 2003 1,4 h-shift s->s mn7j=mn3j 3.67e+12 -0.600 14700.0 !5 1,5 h-shift s->s correlation from 1,4 h-shift s->s & p->p mn6j=mn5j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s mn6j=mn4j 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s mn6j=mn3j 7.850e+11 -0.120 23500.0 !5 matheu, 2003 1,4 h-shift s->s mn6j=mn2j 3.670e+12 -0.600 13800.0 !5 1,5 h-shift s->t correlation from 1,4 h-shift s->t & p->p mn5j=mn4j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s mn5j=mn3j 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s mn5j=mn2j 7.850e+11 -0.120 20600.0 !5 matheu, 2003 1,4 h-shift assumed like s->t mn4j=mn3j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s mn4j=mn2j 3.800e+10 0.670 36100.0 !5 matheu, 2003 1,3 h-shift assumed like s->t mn3j=mn2j 3.560e+10 0.880 37700.0 !5 matheu, 2003 1,2 h-shift assumed like s->t mnmj=mn3j 1.830e+02 2.550 10960.0 !5 tsang, 2006 1,5 h-shift p->s (hexenyl radical) mnmj=mn2j 7.850e+11 -0.120 18300.0 !5 matheu, 2003 1,4 h-shift assumed like p->t ! mo8j=mo7j 3.560e+10 0.880 37300.0 !5 matheu, 2003 1,2 h-shift p->s mo8j=mo6j 3.800e+10 0.670 36600.0 !5 matheu, 2003 1,3 h-shift p->s mo8j=mo5j 7.850e+11 -0.120 20600.0 !5 matheu, 2003 1,4 h-shift p->s mo8j=mo4j 1.830e+02 2.550 10960.0 !5 tsang, 2006 1,5 h-shift p->s (hexenyl radical) mo7j=mo6j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s mo7j=mo5j 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s mo7j=mo4j 7.850e+11 -0.120 23500.0 !5 matheu, 2003 1,4 h-shift s->s mo7j=mo3j 3.670e+12 -0.600 14700.0 !5 1,5 h-shift s->s correlation from 1,4 h-shift s->s & p->p mo6j=mo5j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s mo6j=mo4j 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s mo6j=mo3j 7.850e+11 -0.120 23500.0 !5 matheu, 2003 1,4 h-shift s->s mo6j=mo2j 3.670e+12 -0.600 13800.0 !5 1,5 h-shift s->t correlation from 1,4 h-shift s->t & p->p mo5j=mo4j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s mo5j=mo3j 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s mo5j=mo2j 7.850e+11 -0.120 20600.0 !5 matheu, 2003 1,4 h-shift assumed like s->t mo4j=mo3j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s mo4j=mo2j 3.800e+10 0.670 36100.0 !5 matheu, 2003 1,3 h-shift assumed like s->t mo3j=mo2j 3.560e+10 0.880 37700.0 !5 matheu, 2003 1,2 h-shift assumed like s->t mojm=mo3j 1.830e+02 2.550 10960.0 !5 tsang, 2006 1,5 h-shift p->s (hexenyl radical) mojm=mo2j 7.850e+11 -0.120 18300.0 !5 matheu, 2003 1,4 h-shift assumed like p->t ! ms7j=ms6j 3.560e+10 0.880 37300.0 !5 matheu, 2003 1,2 h-shift p->s ms7j=ms5j 3.800e+10 0.670 36600.0 !5 matheu, 2003 1,3 h-shift p->s ms7j=ms4j 7.850e+11 -0.120 20600.0 !5 matheu, 2003 1,4 h-shift p->s ms7j=ms3j 1.830e+02 2.550 10960.0 !5 tsang, 2006 1,5 h-shift p->s (hexenyl radical) ms6j=ms5j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s ms6j=ms4j 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s ms6j=ms3j 7.850e+11 -0.120 23500.0 !5 matheu, 2003 1,4 h-shift s->s ms6j=ms2j 3.670e+12 -0.600 13800.0 !5 1,5 h-shift s->t correlation from 1,4 h-shift s->t & p->p ms5j=ms4j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s ms5j=ms3j 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s ms5j=ms2j 7.850e+11 -0.120 20600.0 !5 matheu, 2003 1,4 h-shift assumed like s->t ms4j=ms3j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s ms4j=ms2j 3.800e+10 0.670 36100.0 !5 matheu, 2003 1,3 h-shift assumed like s->t ms3j=ms2j 3.560e+10 0.880 37700.0 !5 matheu, 2003 1,2 h-shift assumed like s->t msmj=ms3j 1.830e+02 2.550 10960.0 !5 tsang, 2006 1,5 h-shift p->s (hexenyl radical) msmj=ms2j 7.850e+11 -0.120 18300.0 !5 matheu, 2003 1,4 h-shift assumed like p->t ! mh6j=mh5j 3.560e+10 0.880 37300.0 !5 matheu, 2003 1,2 h-shift p->s mh6j=mh4j 3.800e+10 0.670 36600.0 !5 matheu, 2003 1,3 h-shift p->s mh6j=mh3j 7.850e+11 -0.120 20600.0 !5 matheu, 2003 1,4 h-shift p->s mh6j=mh2j 3.670e+12 -0.600 10500.0 !5 1,5 h-shift p->t correlation from 1,4 h-shift p->t & p->p mh5j=mh4j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s mh5j=mh3j 3.800e+10 0.670 38200.0 !5 matheu, 2003 1,3 h-shift s->s mh5j=mh2j 7.850e+11 -0.120 20600.0 !5 matheu, 2003 1,4 h-shift assumed like s->t mh4j=mh3j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s mh4j=mh2j 3.800e+10 0.670 36100.0 !5 matheu, 2003 1,3 h-shift assumed like s->t mh3j=mh2j 3.560e+10 0.880 37700.0 !5 matheu, 2003 1,2 h-shift assumed like s->t mhmj=mh3j 1.830e+02 2.550 10960.0 !5 tsang, 2006 1,5 h-shift p->s (hexenyl radical) mhmj=mh2j 7.850e+11 -0.120 18300.0 !5 matheu, 2003 1,4 h-shift assumed like p->t ! mf5j=mf4j 3.560e+10 0.880 37300.0 !5 matheu, 2003 1,2 h-shift p->s mf5j=mf3j 3.800e+10 0.670 36600.0 !5 matheu, 2003 1,3 h-shift p->s mf5j=mf2j 7.850e+11 -0.120 18300.0 !5 matheu, 2003 1,4 h-shift assumed like p->t mf4j=mf3j 3.560e+10 0.880 39100.0 !5 matheu, 2003 1,2 h-shift s->s mf4j=mf2j 3.800e+10 0.670 36100.0 !5 matheu, 2003 1,3 h-shift assumed like s->t mf3j=mf2j 3.560e+10 0.880 37700.0 !5 matheu, 2003 1,2 h-shift assumed like s->t mfmj=mf3j 1.830e+02 2.550 10960.0 !5 tsang, 2006 1,5 h-shift p->s (hexenyl radical) mfmj=mf2j 7.850e+11 -0.120 18300.0 !5 matheu, 2003 1,4 h-shift assumed like p->t ! mb4j=mb3j 3.560e+10 0.880 37300.0 !5 matheu, 2003 1,2 h-shift p->s mb4j=mb2j 3.800e+10 0.670 34300.0 !5 matheu, 2003 1,3 h-shift assumed like p->t mb3j=mb2j 3.560e+10 0.880 37700.0 !5 matheu, 2003 1,2 h-shift assumed like s->t mbmj=mb3j 1.830e+02 2.550 10960.0 !5 tsang, 2006 1,5 h-shift p->s (hexenyl radical) mbmj=mb2j 7.850e+11 -0.120 18300.0 !5 matheu, 2003 1,4 h-shift assumed like p->t ! mp3j=mp2j 3.560e+10 0.880 34600.0 !5 matheu, 2003 1,2 h-shift assumed like p->t mpmj=mp3j 1.830e+02 2.550 10960.0 !5 tsang, 2006 1,5 h-shift p->s (hexenyl radical) mpmj=mp2j 7.850e+11 -0.120 18300.0 !5 matheu, 2003 1,4 h-shift assumed like p->t ! memj=me2j 7.850e+11 -0.120 18300.0 !5 matheu, 2003 1,4 h-shift assumed like p->t ! ! ! !Radicals from olefins + oh c3h6oh1j2=nc3h7o 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 c3h6oh2j1=ic3h7o 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 !c4h8oh1j2=pc4h9o 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 !c4h8oh2j1=sc4h9o 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 !c5h10oh1j2=c5h11o-1 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 !c5h10oh2j1=c5h11o-2 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 !c6h12oh1j2=c6h13o-1 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 !c6h12oh2j1=c6h13o-2 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 !c7h14oh1j2=c7h15o-1 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 !c7h14oh2j1=c7h15o-2 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 c8h16oh1j2=c8h17o-1 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 c8h16oh2j1=c8h17o-2 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 c9h18oh1j2=c9h19o-1 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 c9h18oh2j1=c9h19o-2 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 !Radicals from unsaturated esters + oh mp2joh3=mp3o 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 mp3joh2=mp2o 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 mb3joh4=mb4o 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 mb4joh3=mb3o 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 mf4joh5=mf5o 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 mf5joh4=mf4o 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 mh5joh6=mh6o 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 mh6joh5=mh5o 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 ms6joh7=ms7o 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 ms7joh6=ms6o 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 mo7joh8=mo8o 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 mo8joh7=mo7o 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 mn8joh9=mn9o 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 mn9joh8=mn8o 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 md9joh10=md10o 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 md10joh9=md9o 3.695e+14 0.000 42070.0 !5 A from matheu et al., 2002 at 1000 K; Ea from Teixeira-Dias et al., 2003 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 6/H-atom abstraction from olefins ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! ! c9h18-1+h=c9h17-11+h2 8.040e+05 2.500 12280.0 !6 c9h18-1+h=c9h17-12+h2 4.050e+05 2.500 09794.0 !6 c9h18-1+h=c9h17-13+h2 3.376e+05 2.360 00207.0 !6 c9h18-1+h=c9h17-14+h2 1.300e+06 2.400 04471.0 !6 c9h18-1+h=c9h17-15+h2 1.300e+06 2.400 04471.0 !6 c9h18-1+h=c9h17-16+h2 1.300e+06 2.400 04471.0 !6 c9h18-1+h=c9h17-17+h2 1.300e+06 2.400 04471.0 !6 c9h18-1+h=c9h17-18+h2 1.300e+06 2.400 04471.0 !6 c9h18-1+h=c9h17-19+h2 9.400e+04 2.750 06280.0 !6 ! c9h18-1+ho2=c9h17-11+h2o2 7.500e+09 0.000 12570.0 !6 c9h18-1+ho2=c9h17-12+h2o2 3.000e+09 0.000 09930.0 !6 c9h18-1+ho2=c9h17-13+h2o2 4.820e+03 2.550 10530.0 !6 c9h18-1+ho2=c9h17-14+h2o2 5.880e+04 2.500 14860.0 !6 c9h18-1+ho2=c9h17-15+h2o2 5.880e+04 2.500 14860.0 !6 c9h18-1+ho2=c9h17-16+h2o2 5.880e+04 2.500 14860.0 !6 c9h18-1+ho2=c9h17-17+h2o2 5.880e+04 2.500 14860.0 !6 c9h18-1+ho2=c9h17-18+h2o2 5.880e+04 2.500 14860.0 !6 c9h18-1+ho2=c9h17-19+h2o2 4.050e+04 2.500 16690.0 !6 ! c9h18-1+oh=c9h17-11+h2o 2.110e+06 2.000 02778.0 !6 c9h18-1+oh=c9h17-12+h2o 1.110e+06 2.000 01451.0 !6 c9h18-1+oh=c9h17-13+h2o 2.764e+04 2.640 -01919.0 !6 c9h18-1+oh=c9h17-14+h2o 4.670e+07 1.610 -00035.0 !6 c9h18-1+oh=c9h17-15+h2o 4.670e+07 1.610 -00035.0 !6 c9h18-1+oh=c9h17-16+h2o 4.670e+07 1.610 -00035.0 !6 c9h18-1+oh=c9h17-17+h2o 4.670e+07 1.610 -00035.0 !6 c9h18-1+oh=c9h17-18+h2o 4.670e+07 1.610 -00035.0 !6 c9h18-1+oh=c9h17-19+h2o 5.270e+09 0.970 01590.0 !6 ! c9h18-1+o2=c9h17-11+ho2 2.000e+12 0.000 62900.0 !6 c9h18-1+o2=c9h17-12+ho2 1.400E+12 0.000 60700.0 !6 c9h18-1+o2=c9h17-13+ho2 2.200e+12 0.000 37220.0 !6 c9h18-1+o2=c9h17-14+ho2 4.000e+13 0.000 50160.0 !6 c9h18-1+o2=c9h17-15+ho2 4.000e+13 0.000 50160.0 !6 c9h18-1+o2=c9h17-16+ho2 4.000e+13 0.000 50160.0 !6 c9h18-1+o2=c9h17-17+ho2 4.000e+13 0.000 50160.0 !6 c9h18-1+o2=c9h17-18+ho2 4.000e+13 0.000 50160.0 !6 c9h18-1+o2=c9h17-19+ho2 6.000e+13 0.000 52800.0 !6 ! c9h18-1+o=c9h17-11+oh 1.200E+11 0.700 08959.0 !6 c9h18-1+o=c9h17-12+oh 6.030E+10 0.700 07632.0 !6 c9h18-1+o=c9h17-13+oh 6.600e+05 2.430 01210.0 !6 c9h18-1+o=c9h17-14+oh 5.946e+05 2.440 02846.0 !6 c9h18-1+o=c9h17-15+oh 5.946e+05 2.440 02846.0 !6 c9h18-1+o=c9h17-16+oh 5.946e+05 2.440 02846.0 !6 c9h18-1+o=c9h17-17+oh 5.946e+05 2.440 02846.0 !6 c9h18-1+o=c9h17-18+oh 5.946e+05 2.440 02846.0 !6 c9h18-1+o=c9h17-19+oh 1.046e+06 2.420 04766.0 !6 ! c9h18-1+ch3=c9h17-11+ch4 1.348E+00 3.500 12850.0 !6 c9h18-1+ch3=c9h17-12+ch4 8.400E-01 3.500 11660.0 !6 c9h18-1+ch3=c9h17-13+ch4 3.690e+00 3.310 04002.0 !6 c9h18-1+ch3=c9h17-14+ch4 8.400e+04 2.130 07574.0 !6 c9h18-1+ch3=c9h17-15+ch4 8.400e+04 2.130 07574.0 !6 c9h18-1+ch3=c9h17-16+ch4 8.400e+04 2.130 07574.0 !6 c9h18-1+ch3=c9h17-17+ch4 8.400e+04 2.130 07574.0 !6 c9h18-1+ch3=c9h17-18+ch4 8.400e+04 2.130 07574.0 !6 c9h18-1+ch3=c9h17-19+ch4 4.520e-01 3.650 07154.0 !6 ! !c9h18-1+ch3o=c9h17-11+ch3oh !c9h18-1+ch3o=c9h17-12+ch3oh c9h18-1+ch3o=c9h17-13+ch3oh 4.000e+01 2.900 08609.0 !6 c9h18-1+ch3o=c9h17-14+ch3oh 1.100e+11 0.000 05000.0 !6 c9h18-1+ch3o=c9h17-15+ch3oh 1.100e+11 0.000 05000.0 !6 c9h18-1+ch3o=c9h17-16+ch3oh 1.100e+11 0.000 05000.0 !6 c9h18-1+ch3o=c9h17-17+ch3oh 1.100e+11 0.000 05000.0 !6 c9h18-1+ch3o=c9h17-18+ch3oh 1.100e+11 0.000 05000.0 !6 c9h18-1+ch3o=c9h17-19+ch3oh 1.500e+10 0.000 07000.0 !6 ! c9h18-1+ch3o2=c9h17-11+ch3o2h 7.500e+09 0.000 12570.0 !6 c9h18-1+ch3o2=c9h17-12+ch3o2h 3.000e+09 0.000 09930.0 !6 c9h18-1+ch3o2=c9h17-13+ch3o2h 4.820e+03 2.550 10530.0 !6 c9h18-1+ch3o2=c9h17-14+ch3o2h 5.880e+04 2.500 14860.0 !6 c9h18-1+ch3o2=c9h17-15+ch3o2h 5.880e+04 2.500 14860.0 !6 c9h18-1+ch3o2=c9h17-16+ch3o2h 5.880e+04 2.500 14860.0 !6 c9h18-1+ch3o2=c9h17-17+ch3o2h 5.880e+04 2.500 14860.0 !6 c9h18-1+ch3o2=c9h17-18+ch3o2h 5.880e+04 2.500 14860.0 !6 c9h18-1+ch3o2=c9h17-19+ch3o2h 4.050e+04 2.500 16690.0 !6 ! c9h18-1+c2h3=c9h17-11+c2h4 1.387e+00 3.500 10870.0 !6 c9h18-1+c2h3=c9h17-12+c2h4 8.401e-01 3.500 09680.0 !6 c9h18-1+c2h3=c9h17-13+c2h4 2.211E+00 3.500 04690.0 !6 c9h18-1+c2h3=c9h17-14+c2h4 4.000e+11 0.000 16800.0 !6 c9h18-1+c2h3=c9h17-15+c2h4 4.000e+11 0.000 16800.0 !6 c9h18-1+c2h3=c9h17-16+c2h4 4.000e+11 0.000 16800.0 !6 c9h18-1+c2h3=c9h17-17+c2h4 4.000e+11 0.000 16800.0 !6 c9h18-1+c2h3=c9h17-18+c2h4 4.000e+11 0.000 16800.0 !6 c9h18-1+c2h3=c9h17-19+c2h4 5.000e+11 0.000 18000.0 !6 ! !c9h18-1+c2h5=c9h17-11+c2h6 !c9h18-1+c2h5=c9h17-12+c2h6 c9h18-1+c2h5=c9h17-13+c2h6 1.000e+11 0.000 09800.0 !6 c9h18-1+c2h5=c9h17-14+c2h6 5.000e+10 0.000 10400.0 !6 c9h18-1+c2h5=c9h17-15+c2h6 5.000e+10 0.000 10400.0 !6 c9h18-1+c2h5=c9h17-16+c2h6 5.000e+10 0.000 10400.0 !6 c9h18-1+c2h5=c9h17-17+c2h6 5.000e+10 0.000 10400.0 !6 c9h18-1+c2h5=c9h17-18+c2h6 5.000e+10 0.000 10400.0 !6 c9h18-1+c2h5=c9h17-19+c2h6 5.000e+10 0.000 13400.0 !6 ! c8h16-1+h=c8h15-11+h2 8.040e+05 2.500 12280.0 !6 c8h16-1+h=c8h15-12+h2 4.050e+05 2.500 09794.0 !6 c8h16-1+h=c8h15-13+h2 3.376e+05 2.360 00207.0 !6 c8h16-1+h=c8h15-14+h2 1.300e+06 2.400 04471.0 !6 c8h16-1+h=c8h15-15+h2 1.300e+06 2.400 04471.0 !6 c8h16-1+h=c8h15-16+h2 1.300e+06 2.400 04471.0 !6 c8h16-1+h=c8h15-17+h2 1.300e+06 2.400 04471.0 !6 c8h16-1+h=c8h15-18+h2 9.400e+04 2.750 06280.0 !6 ! c8h16-1+ho2=c8h15-11+h2o2 7.500e+09 0.000 12570.0 !6 c8h16-1+ho2=c8h15-12+h2o2 3.000e+09 0.000 09930.0 !6 c8h16-1+ho2=c8h15-13+h2o2 4.820e+03 2.550 10530.0 !6 c8h16-1+ho2=c8h15-14+h2o2 5.880e+04 2.500 14860.0 !6 c8h16-1+ho2=c8h15-15+h2o2 5.880e+04 2.500 14860.0 !6 c8h16-1+ho2=c8h15-16+h2o2 5.880e+04 2.500 14860.0 !6 c8h16-1+ho2=c8h15-17+h2o2 5.880e+04 2.500 14860.0 !6 c8h16-1+ho2=c8h15-18+h2o2 4.050e+04 2.500 16690.0 !6 ! c8h16-1+oh=c8h15-11+h2o 2.110e+06 2.000 02778.0 !6 c8h16-1+oh=c8h15-12+h2o 1.110e+06 2.000 01451.0 !6 c8h16-1+oh=c8h15-13+h2o 2.764e+04 2.640 -01919.0 !6 c8h16-1+oh=c8h15-14+h2o 4.670e+07 1.610 -00035.0 !6 c8h16-1+oh=c8h15-15+h2o 4.670e+07 1.610 -00035.0 !6 c8h16-1+oh=c8h15-16+h2o 4.670e+07 1.610 -00035.0 !6 c8h16-1+oh=c8h15-17+h2o 4.670e+07 1.610 -00035.0 !6 c8h16-1+oh=c8h15-18+h2o 5.270e+09 0.970 01590.0 !6 ! c8h16-1+o2=c8h15-11+ho2 2.000e+12 0.000 62900.0 !6 c8h16-1+o2=c8h15-12+ho2 1.400E+12 0.000 60700.0 !6 c8h16-1+o2=c8h15-13+ho2 2.200e+12 0.000 37220.0 !6 c8h16-1+o2=c8h15-14+ho2 4.000e+13 0.000 50160.0 !6 c8h16-1+o2=c8h15-15+ho2 4.000e+13 0.000 50160.0 !6 c8h16-1+o2=c8h15-16+ho2 4.000e+13 0.000 50160.0 !6 c8h16-1+o2=c8h15-17+ho2 4.000e+13 0.000 50160.0 !6 c8h16-1+o2=c8h15-18+ho2 6.000e+13 0.000 52800.0 !6 ! c8h16-1+o=c8h15-11+oh 1.200E+11 0.700 08959.0 !6 c8h16-1+o=c8h15-12+oh 6.030E+10 0.700 07632.0 !6 c8h16-1+o=c8h15-13+oh 6.600e+05 2.430 01210.0 !6 c8h16-1+o=c8h15-14+oh 5.946e+05 2.440 02846.0 !6 c8h16-1+o=c8h15-15+oh 5.946e+05 2.440 02846.0 !6 c8h16-1+o=c8h15-16+oh 5.946e+05 2.440 02846.0 !6 c8h16-1+o=c8h15-17+oh 5.946e+05 2.440 02846.0 !6 c8h16-1+o=c8h15-18+oh 1.046e+06 2.420 04766.0 !6 ! c8h16-1+ch3=c8h15-11+ch4 1.348E+00 3.500 12850.0 !6 c8h16-1+ch3=c8h15-12+ch4 8.400E-01 3.500 11660.0 !6 c8h16-1+ch3=c8h15-13+ch4 3.690e+00 3.310 04002.0 !6 c8h16-1+ch3=c8h15-14+ch4 8.400e+04 2.130 07574.0 !6 c8h16-1+ch3=c8h15-15+ch4 8.400e+04 2.130 07574.0 !6 c8h16-1+ch3=c8h15-16+ch4 8.400e+04 2.130 07574.0 !6 c8h16-1+ch3=c8h15-17+ch4 8.400e+04 2.130 07574.0 !6 c8h16-1+ch3=c8h15-18+ch4 4.520e-01 3.650 07154.0 !6 ! !c8h16-1+ch3o=c8h15-11+ch3oh !c8h16-1+ch3o=c8h15-12+ch3oh c8h16-1+ch3o=c8h15-13+ch3oh 4.000e+01 2.900 08609.0 !6 c8h16-1+ch3o=c8h15-14+ch3oh 1.100e+11 0.000 05000.0 !6 c8h16-1+ch3o=c8h15-15+ch3oh 1.100e+11 0.000 05000.0 !6 c8h16-1+ch3o=c8h15-16+ch3oh 1.100e+11 0.000 05000.0 !6 c8h16-1+ch3o=c8h15-17+ch3oh 1.100e+11 0.000 05000.0 !6 c8h16-1+ch3o=c8h15-18+ch3oh 1.500e+10 0.000 07000.0 !6 ! c8h16-1+ch3o2=c8h15-11+ch3o2h 7.500e+09 0.000 12570.0 !6 c8h16-1+ch3o2=c8h15-12+ch3o2h 3.000e+09 0.000 09930.0 !6 c8h16-1+ch3o2=c8h15-13+ch3o2h 4.820e+03 2.550 10530.0 !6 c8h16-1+ch3o2=c8h15-14+ch3o2h 5.880e+04 2.500 14860.0 !6 c8h16-1+ch3o2=c8h15-15+ch3o2h 5.880e+04 2.500 14860.0 !6 c8h16-1+ch3o2=c8h15-16+ch3o2h 5.880e+04 2.500 14860.0 !6 c8h16-1+ch3o2=c8h15-17+ch3o2h 5.880e+04 2.500 14860.0 !6 c8h16-1+ch3o2=c8h15-18+ch3o2h 4.050e+04 2.500 16690.0 !6 ! c8h16-1+c2h3=c8h15-11+c2h4 1.387e+00 3.500 10870.0 !6 c8h16-1+c2h3=c8h15-12+c2h4 8.401e-01 3.500 09680.0 !6 c8h16-1+c2h3=c8h15-13+c2h4 2.211E+00 3.500 04690.0 !6 c8h16-1+c2h3=c8h15-14+c2h4 4.000e+11 0.000 16800.0 !6 c8h16-1+c2h3=c8h15-15+c2h4 4.000e+11 0.000 16800.0 !6 c8h16-1+c2h3=c8h15-16+c2h4 4.000e+11 0.000 16800.0 !6 c8h16-1+c2h3=c8h15-17+c2h4 4.000e+11 0.000 16800.0 !6 c8h16-1+c2h3=c8h15-18+c2h4 5.000e+11 0.000 18000.0 !6 ! !c8h16-1+c2h5=c8h15-11+c2h6 !c8h16-1+c2h5=c8h15-12+c2h6 c8h16-1+c2h5=c8h15-13+c2h6 1.000e+11 0.000 09800.0 !6 c8h16-1+c2h5=c8h15-14+c2h6 5.000e+10 0.000 10400.0 !6 c8h16-1+c2h5=c8h15-15+c2h6 5.000e+10 0.000 10400.0 !6 c8h16-1+c2h5=c8h15-16+c2h6 5.000e+10 0.000 10400.0 !6 c8h16-1+c2h5=c8h15-17+c2h6 5.000e+10 0.000 10400.0 !6 c8h16-1+c2h5=c8h15-18+c2h6 5.000e+10 0.000 13400.0 !6 ! !c7h14-1+h=c7h13-11+h2 8.040e+05 2.500 12280.0 !6 !c7h14-1+h=c7h13-12+h2 4.050e+05 2.500 09794.0 !6 !c7h14-1+h=c7h13-13+h2 3.376e+05 2.360 00207.0 !6 !c7h14-1+h=c7h13-14+h2 1.300e+06 2.400 04471.0 !6 !c7h14-1+h=c7h13-15+h2 1.300e+06 2.400 04471.0 !6 !c7h14-1+h=c7h13-16+h2 1.300e+06 2.400 04471.0 !6 !c7h14-1+h=c7h13-17+h2 9.400e+04 2.750 06280.0 !6 ! !c7h14-1+ho2=c7h13-11+h2o2 7.500e+09 0.000 12570.0 !6 !c7h14-1+ho2=c7h13-12+h2o2 3.000e+09 0.000 09930.0 !6 !c7h14-1+ho2=c7h13-13+h2o2 4.820e+03 2.550 10530.0 !6 !c7h14-1+ho2=c7h13-14+h2o2 5.880e+04 2.500 14860.0 !6 !c7h14-1+ho2=c7h13-15+h2o2 5.880e+04 2.500 14860.0 !6 !c7h14-1+ho2=c7h13-16+h2o2 5.880e+04 2.500 14860.0 !6 !c7h14-1+ho2=c7h13-17+h2o2 4.050e+04 2.500 16690.0 !6 ! !c7h14-1+oh=c7h13-11+h2o 2.110e+06 2.000 02778.0 !6 !c7h14-1+oh=c7h13-12+h2o 1.110e+06 2.000 01451.0 !6 !c7h14-1+oh=c7h13-13+h2o 2.764e+04 2.640 -01919.0 !6 !c7h14-1+oh=c7h13-14+h2o 4.670e+07 1.610 -00035.0 !6 !c7h14-1+oh=c7h13-15+h2o 4.670e+07 1.610 -00035.0 !6 !c7h14-1+oh=c7h13-16+h2o 4.670e+07 1.610 -00035.0 !6 !c7h14-1+oh=c7h13-17+h2o 5.270e+09 0.970 01590.0 !6 ! !c7h14-1+o2=c7h13-11+ho2 2.000e+12 0.000 62900.0 !6 !c7h14-1+o2=c7h13-12+ho2 1.400E+12 0.000 60700.0 !6 !c7h14-1+o2=c7h13-13+ho2 2.200e+12 0.000 37220.0 !6 !c7h14-1+o2=c7h13-14+ho2 4.000e+13 0.000 50160.0 !6 !c7h14-1+o2=c7h13-15+ho2 4.000e+13 0.000 50160.0 !6 !c7h14-1+o2=c7h13-16+ho2 4.000e+13 0.000 50160.0 !6 !c7h14-1+o2=c7h13-17+ho2 6.000e+13 0.000 52800.0 !6 ! !c7h14-1+o=c7h13-11+oh 1.200E+11 0.700 08959.0 !6 !c7h14-1+o=c7h13-12+oh 6.030E+10 0.700 07632.0 !6 !c7h14-1+o=c7h13-13+oh 6.600e+05 2.430 01210.0 !6 !c7h14-1+o=c7h13-14+oh 5.946e+05 2.440 02846.0 !6 !c7h14-1+o=c7h13-15+oh 5.946e+05 2.440 02846.0 !6 !c7h14-1+o=c7h13-16+oh 5.946e+05 2.440 02846.0 !6 !c7h14-1+o=c7h13-17+oh 1.046e+06 2.420 04766.0 !6 ! !c7h14-1+ch3=c7h13-11+ch4 1.348E+00 3.500 12850.0 !6 !c7h14-1+ch3=c7h13-12+ch4 8.400E-01 3.500 11660.0 !6 !c7h14-1+ch3=c7h13-13+ch4 3.690e+00 3.310 04002.0 !6 !c7h14-1+ch3=c7h13-14+ch4 8.400e+04 2.130 07574.0 !6 !c7h14-1+ch3=c7h13-15+ch4 8.400e+04 2.130 07574.0 !6 !c7h14-1+ch3=c7h13-16+ch4 8.400e+04 2.130 07574.0 !6 !c7h14-1+ch3=c7h13-17+ch4 4.520e-01 3.650 07154.0 !6 ! !c7h14-1+ch3o=c7h13-11+ch3oh !c7h14-1+ch3o=c7h13-12+ch3oh !c7h14-1+ch3o=c7h13-13+ch3oh 4.000e+01 2.900 08609.0 !6 !c7h14-1+ch3o=c7h13-14+ch3oh 1.100e+11 0.000 05000.0 !6 !c7h14-1+ch3o=c7h13-15+ch3oh 1.100e+11 0.000 05000.0 !6 !c7h14-1+ch3o=c7h13-16+ch3oh 1.100e+11 0.000 05000.0 !6 !c7h14-1+ch3o=c7h13-17+ch3oh 1.500e+10 0.000 07000.0 !6 ! !c7h14-1+ch3o2=c7h13-11+ch3o2h 7.500e+09 0.000 12570.0 !6 !c7h14-1+ch3o2=c7h13-12+ch3o2h 3.000e+09 0.000 09930.0 !6 !c7h14-1+ch3o2=c7h13-13+ch3o2h 4.820e+03 2.550 10530.0 !6 !c7h14-1+ch3o2=c7h13-14+ch3o2h 5.880e+04 2.500 14860.0 !6 !c7h14-1+ch3o2=c7h13-15+ch3o2h 5.880e+04 2.500 14860.0 !6 !c7h14-1+ch3o2=c7h13-16+ch3o2h 5.880e+04 2.500 14860.0 !6 !c7h14-1+ch3o2=c7h13-17+ch3o2h 4.050e+04 2.500 16690.0 !6 ! !c7h14-1+c2h3=c7h13-11+c2h4 1.387e+00 3.500 10870.0 !6 !c7h14-1+c2h3=c7h13-12+c2h4 8.401e-01 3.500 09680.0 !6 !c7h14-1+c2h3=c7h13-13+c2h4 2.211E+00 3.500 04690.0 !6 !c7h14-1+c2h3=c7h13-14+c2h4 4.000e+11 0.000 16800.0 !6 !c7h14-1+c2h3=c7h13-15+c2h4 4.000e+11 0.000 16800.0 !6 !c7h14-1+c2h3=c7h13-16+c2h4 4.000e+11 0.000 16800.0 !6 !c7h14-1+c2h3=c7h13-17+c2h4 5.000e+11 0.000 18000.0 !6 ! !c7h14-1+c2h5=c7h13-11+c2h6 !c7h14-1+c2h5=c7h13-12+c2h6 !c7h14-1+c2h5=c7h13-13+c2h6 1.000e+11 0.000 09800.0 !6 !c7h14-1+c2h5=c7h13-14+c2h6 5.000e+10 0.000 10400.0 !6 !c7h14-1+c2h5=c7h13-15+c2h6 5.000e+10 0.000 10400.0 !6 !c7h14-1+c2h5=c7h13-16+c2h6 5.000e+10 0.000 10400.0 !6 !c7h14-1+c2h5=c7h13-17+c2h6 5.000e+10 0.000 13400.0 !6 ! !c6h12-1+h=c6h11-11+h2 8.040e+05 2.500 12280.0 !6 !c6h12-1+h=c6h11-12+h2 4.050e+05 2.500 09794.0 !6 !c6h12-1+h=c6h11-13+h2 3.376e+05 2.360 00207.0 !6 !c6h12-1+h=c6h11-14+h2 1.300e+06 2.400 04471.0 !6 !c6h12-1+h=c6h11-15+h2 1.300e+06 2.400 04471.0 !6 !c6h12-1+h=c6h11-16+h2 9.400e+04 2.750 06280.0 !6 ! !c6h12-1+ho2=c6h11-11+h2o2 7.500e+09 0.000 12570.0 !6 !c6h12-1+ho2=c6h11-12+h2o2 3.000e+09 0.000 09930.0 !6 !c6h12-1+ho2=c6h11-13+h2o2 4.820e+03 2.550 10530.0 !6 !c6h12-1+ho2=c6h11-14+h2o2 5.880e+04 2.500 14860.0 !6 !c6h12-1+ho2=c6h11-15+h2o2 5.880e+04 2.500 14860.0 !6 !c6h12-1+ho2=c6h11-16+h2o2 4.050e+04 2.500 16690.0 !6 ! !c6h12-1+oh=c6h11-11+h2o 2.110e+06 2.000 02778.0 !6 !c6h12-1+oh=c6h11-12+h2o 1.110e+06 2.000 01451.0 !6 !c6h12-1+oh=c6h11-13+h2o 2.764e+04 2.640 -01919.0 !6 !c6h12-1+oh=c6h11-14+h2o 4.670e+07 1.610 -00035.0 !6 !c6h12-1+oh=c6h11-15+h2o 4.670e+07 1.610 -00035.0 !6 !c6h12-1+oh=c6h11-16+h2o 5.270e+09 0.970 01590.0 !6 ! !c6h12-1+o2=c6h11-11+ho2 2.000e+12 0.000 62900.0 !6 !c6h12-1+o2=c6h11-12+ho2 1.400E+12 0.000 60700.0 !6 !c6h12-1+o2=c6h11-13+ho2 2.200e+12 0.000 37220.0 !6 !c6h12-1+o2=c6h11-14+ho2 4.000e+13 0.000 50160.0 !6 !c6h12-1+o2=c6h11-15+ho2 4.000e+13 0.000 50160.0 !6 !c6h12-1+o2=c6h11-16+ho2 6.000e+13 0.000 52800.0 !6 ! !c6h12-1+o=c6h11-11+oh 1.200E+11 0.700 08959.0 !6 !c6h12-1+o=c6h11-12+oh 6.030E+10 0.700 07632.0 !6 !c6h12-1+o=c6h11-13+oh 6.600e+05 2.430 01210.0 !6 !c6h12-1+o=c6h11-14+oh 5.946e+05 2.440 02846.0 !6 !c6h12-1+o=c6h11-15+oh 5.946e+05 2.440 02846.0 !6 !c6h12-1+o=c6h11-16+oh 1.046e+06 2.420 04766.0 !6 ! !c6h12-1+ch3=c6h11-11+ch4 1.348E+00 3.500 12850.0 !6 !c6h12-1+ch3=c6h11-12+ch4 8.400E-01 3.500 11660.0 !6 !c6h12-1+ch3=c6h11-13+ch4 3.690e+00 3.310 04002.0 !6 !c6h12-1+ch3=c6h11-14+ch4 8.400e+04 2.130 07574.0 !6 !c6h12-1+ch3=c6h11-15+ch4 8.400e+04 2.130 07574.0 !6 !c6h12-1+ch3=c6h11-16+ch4 4.520e-01 3.650 07154.0 !6 ! !c6h12-1+ch3o=c6h11-11+ch3oh !c6h12-1+ch3o=c6h11-12+ch3oh !c6h12-1+ch3o=c6h11-13+ch3oh 4.000e+01 2.900 08609.0 !6 !c6h12-1+ch3o=c6h11-14+ch3oh 1.100e+11 0.000 05000.0 !6 !c6h12-1+ch3o=c6h11-15+ch3oh 1.100e+11 0.000 05000.0 !6 !c6h12-1+ch3o=c6h11-16+ch3oh 1.500e+10 0.000 07000.0 !6 ! !c6h12-1+ch3o2=c6h11-11+ch3o2h 7.500e+09 0.000 12570.0 !6 !c6h12-1+ch3o2=c6h11-12+ch3o2h 3.000e+09 0.000 09930.0 !6 !c6h12-1+ch3o2=c6h11-13+ch3o2h 4.820e+03 2.550 10530.0 !6 !c6h12-1+ch3o2=c6h11-14+ch3o2h 5.880e+04 2.500 14860.0 !6 !c6h12-1+ch3o2=c6h11-15+ch3o2h 5.880e+04 2.500 14860.0 !6 !c6h12-1+ch3o2=c6h11-16+ch3o2h 4.050e+04 2.500 16690.0 !6 ! !c6h12-1+c2h3=c6h11-11+c2h4 1.387e+00 3.500 10870.0 !6 !c6h12-1+c2h3=c6h11-12+c2h4 8.401e-01 3.500 09680.0 !6 !c6h12-1+c2h3=c6h11-13+c2h4 2.211E+00 3.500 04690.0 !6 !c6h12-1+c2h3=c6h11-14+c2h4 4.000e+11 0.000 16800.0 !6 !c6h12-1+c2h3=c6h11-15+c2h4 4.000e+11 0.000 16800.0 !6 !c6h12-1+c2h3=c6h11-16+c2h4 5.000e+11 0.000 18000.0 !6 ! !c6h12-1+c2h5=c6h11-11+c2h6 !c6h12-1+c2h5=c6h11-12+c2h6 !c6h12-1+c2h5=c6h11-13+c2h6 1.000e+11 0.000 09800.0 !6 !c6h12-1+c2h5=c6h11-14+c2h6 5.000e+10 0.000 10400.0 !6 !c6h12-1+c2h5=c6h11-15+c2h6 5.000e+10 0.000 10400.0 !6 !c6h12-1+c2h5=c6h11-16+c2h6 5.000e+10 0.000 13400.0 !6 ! !c5h10-1+h=c5h9-11+h2 8.040e+05 2.500 12280.0 !6 !c5h10-1+h=c5h9-12+h2 4.050e+05 2.500 09794.0 !6 !c5h10-1+h=c5h9-13+h2 3.376e+05 2.360 00207.0 !6 !c5h10-1+h=c5h9-14+h2 1.300e+06 2.400 04471.0 !6 !c5h10-1+h=c5h9-15+h2 9.400e+04 2.750 06280.0 !6 ! !c5h10-1+ho2=c5h9-11+h2o2 7.500e+09 0.000 12570.0 !6 !c5h10-1+ho2=c5h9-12+h2o2 3.000e+09 0.000 09930.0 !6 !c5h10-1+ho2=c5h9-13+h2o2 4.820e+03 2.550 10530.0 !6 !c5h10-1+ho2=c5h9-14+h2o2 5.880e+04 2.500 14860.0 !6 !c5h10-1+ho2=c5h9-15+h2o2 4.050e+04 2.500 16690.0 !6 ! !c5h10-1+oh=c5h9-11+h2o 2.110e+06 2.000 02778.0 !6 !c5h10-1+oh=c5h9-12+h2o 1.110e+06 2.000 01451.0 !6 !c5h10-1+oh=c5h9-13+h2o 2.764e+04 2.640 -01919.0 !6 !c5h10-1+oh=c5h9-14+h2o 4.670e+07 1.610 -00035.0 !6 !c5h10-1+oh=c5h9-15+h2o 5.270e+09 0.970 01590.0 !6 ! !c5h10-1+o2=c5h9-11+ho2 2.000e+12 0.000 62900.0 !6 !c5h10-1+o2=c5h9-12+ho2 1.400E+12 0.000 60700.0 !6 !c5h10-1+o2=c5h9-13+ho2 2.200e+12 0.000 37220.0 !6 !c5h10-1+o2=c5h9-14+ho2 4.000e+13 0.000 50160.0 !6 !c5h10-1+o2=c5h9-15+ho2 6.000e+13 0.000 52800.0 !6 ! !c5h10-1+o=c5h9-11+oh 1.200E+11 0.700 08959.0 !6 !c5h10-1+o=c5h9-12+oh 6.030E+10 0.700 07632.0 !6 !c5h10-1+o=c5h9-13+oh 6.600e+05 2.430 01210.0 !6 !c5h10-1+o=c5h9-14+oh 5.946e+05 2.440 02846.0 !6 !c5h10-1+o=c5h9-15+oh 1.046e+06 2.420 04766.0 !6 ! !c5h10-1+ch3=c5h9-11+ch4 1.348E+00 3.500 12850.0 !6 !c5h10-1+ch3=c5h9-12+ch4 8.400E-01 3.500 11660.0 !6 !c5h10-1+ch3=c5h9-13+ch4 3.690e+00 3.310 04002.0 !6 !c5h10-1+ch3=c5h9-14+ch4 8.400e+04 2.130 07574.0 !6 !c5h10-1+ch3=c5h9-15+ch4 4.520e-01 3.650 07154.0 !6 ! !c5h10-1+ch3o=c5h9-11+ch3oh !c5h10-1+ch3o=c5h9-12+ch3oh !c5h10-1+ch3o=c5h9-13+ch3oh 4.000e+01 2.900 08609.0 !6 !c5h10-1+ch3o=c5h9-14+ch3oh 1.100e+11 0.000 05000.0 !6 !c5h10-1+ch3o=c5h9-15+ch3oh 1.500e+10 0.000 07000.0 !6 ! !c5h10-1+ch3o2=c5h9-11+ch3o2h 7.500e+09 0.000 12570.0 !6 !c5h10-1+ch3o2=c5h9-12+ch3o2h 3.000e+09 0.000 09930.0 !6 !c5h10-1+ch3o2=c5h9-13+ch3o2h 4.820e+03 2.550 10530.0 !6 !c5h10-1+ch3o2=c5h9-14+ch3o2h 5.880e+04 2.500 14860.0 !6 !c5h10-1+ch3o2=c5h9-15+ch3o2h 4.050e+04 2.500 16690.0 !6 ! !c5h10-1+c2h3=c5h9-11+c2h4 1.387e+00 3.500 10870.0 !6 !c5h10-1+c2h3=c5h9-12+c2h4 8.401e-01 3.500 09680.0 !6 !c5h10-1+c2h3=c5h9-13+c2h4 2.211E+00 3.500 04690.0 !6 !c5h10-1+c2h3=c5h9-14+c2h4 4.000e+11 0.000 16800.0 !6 !c5h10-1+c2h3=c5h9-15+c2h4 5.000e+11 0.000 18000.0 !6 ! !c5h10-1+c2h5=c5h9-11+c2h6 !c5h10-1+c2h5=c5h9-12+c2h6 !c5h10-1+c2h5=c5h9-13+c2h6 1.000e+11 0.000 09800.0 !6 !c5h10-1+c2h5=c5h9-14+c2h6 5.000e+10 0.000 10400.0 !6 !c5h10-1+c2h5=c5h9-15+c2h6 5.000e+10 0.000 13400.0 !6 ! !c4h8-1+h=c4h7-11+h2 8.040e+05 2.500 12280.0 !6 !c4h8-1+h=c4h7-12+h2 4.050e+05 2.500 09794.0 !6 !c4h8-1+h=c4h7-13+h2 3.376e+05 2.360 00207.0 !6 !c4h8-1+h=c4h7-14+h2 9.400e+04 2.750 06280.0 !6 ! !c4h8-1+ho2=c4h7-11+h2o2 7.500e+09 0.000 12570.0 !6 !c4h8-1+ho2=c4h7-12+h2o2 3.000e+09 0.000 09930.0 !6 !c4h8-1+ho2=c4h7-13+h2o2 4.820e+03 2.550 10530.0 !6 !c4h8-1+ho2=c4h7-14+h2o2 4.050e+04 2.500 16690.0 !6 ! !c4h8-1+oh=c4h7-11+h2o 2.110e+06 2.000 02778.0 !6 !c4h8-1+oh=c4h7-12+h2o 1.110e+06 2.000 01451.0 !6 !c4h8-1+oh=c4h7-13+h2o 2.764e+04 2.640 -01919.0 !6 !c4h8-1+oh=c4h7-14+h2o 5.270e+09 0.970 01590.0 !6 ! !c4h8-1+o2=c4h7-11+ho2 2.000e+12 0.000 62900.0 !6 !c4h8-1+o2=c4h7-12+ho2 1.400E+12 0.000 60700.0 !6 !c4h8-1+o2=c4h7-13+ho2 2.200e+12 0.000 37220.0 !6 !c4h8-1+o2=c4h7-14+ho2 6.000e+13 0.000 52800.0 !6 ! !c4h8-1+o=c4h7-11+oh 1.200E+11 0.700 08959.0 !6 !c4h8-1+o=c4h7-12+oh 6.030E+10 0.700 07632.0 !6 !c4h8-1+o=c4h7-13+oh 6.600e+05 2.430 01210.0 !6 !c4h8-1+o=c4h7-14+oh 1.046e+06 2.420 04766.0 !6 ! !c4h8-1+ch3=c4h7-11+ch4 1.348E+00 3.500 12850.0 !6 !c4h8-1+ch3=c4h7-12+ch4 8.400E-01 3.500 11660.0 !6 !c4h8-1+ch3=c4h7-13+ch4 3.690e+00 3.310 04002.0 !6 !c4h8-1+ch3=c4h7-14+ch4 4.520e-01 3.650 07154.0 !6 ! !c4h8-1+ch3o=c4h7-11+ch3oh !c4h8-1+ch3o=c4h7-12+ch3oh !c4h8-1+ch3o=c4h7-13+ch3oh 4.000e+01 2.900 08609.0 !6 !c4h8-1+ch3o=c4h7-14+ch3oh 1.500e+10 0.000 07000.0 !6 ! !c4h8-1+ch3o2=c4h7-11+ch3o2h 7.500e+09 0.000 12570.0 !6 !c4h8-1+ch3o2=c4h7-12+ch3o2h 3.000e+09 0.000 09930.0 !6 !c4h8-1+ch3o2=c4h7-13+ch3o2h 4.820e+03 2.550 10530.0 !6 !c4h8-1+ch3o2=c4h7-14+ch3o2h 4.050e+04 2.500 16690.0 !6 ! !c4h8-1+c2h3=c4h7-11+c2h4 1.387e+00 3.500 10870.0 !6 !c4h8-1+c2h3=c4h7-12+c2h4 8.401e-01 3.500 09680.0 !6 !c4h8-1+c2h3=c4h7-13+c2h4 2.211E+00 3.500 04690.0 !6 !c4h8-1+c2h3=c4h7-14+c2h4 5.000e+11 0.000 18000.0 !6 ! !c4h8-1+c2h5=c4h7-11+c2h6 !c4h8-1+c2h5=c4h7-12+c2h6 !c4h8-1+c2h5=c4h7-13+c2h6 1.000e+11 0.000 09800.0 !6 !c4h8-1+c2h5=c4h7-14+c2h6 5.000e+10 0.000 13400.0 !6 ! ! !H abstractions from unsaturated esters ! !primary H mp2d+h=mp2dmj+h2 9.400e+04 2.750 06280.0 !6 mp2d+ho2=mp2dmj+h2o2 4.050e+04 2.500 16690.0 !6 mp2d+oh=mp2dmj+h2o 5.270e+09 0.970 01590.0 !6 mp2d+o2=mp2dmj+ho2 6.000e+13 0.000 52800.0 !6 mp2d+o=mp2dmj+oh 1.046e+06 2.420 04766.0 !6 mp2d+ch3=mp2dmj+ch4 4.520e-01 3.650 07154.0 !6 mp2d+ch3o=mp2dmj+ch3oh 1.500e+10 0.000 07000.0 !6 mp2d+ch3o2=mp2dmj+ch3o2h 4.050e+04 2.500 16690.0 !6 mp2d+c2h3=mp2dmj+c2h4 5.000e+11 0.000 18000.0 !6 mp2d+c2h5=mp2dmj+c2h6 5.000e+10 0.000 13400.0 !6 ! !vin H mp2d+h=mp2d3j+h2 8.040e+05 2.500 12280.0 !6 mp2d+ho2=mp2d3j+h2o2 7.500e+09 0.000 12570.0 !6 mp2d+oh=mp2d3j+h2o 2.110e+06 2.000 02778.0 !6 mp2d+o2=mp2d3j+ho2 2.000e+12 0.000 62900.0 !6 mp2d+o=mp2d3j+oh 1.200e+11 0.700 08959.0 !6 mp2d+ch3=mp2d3j+ch4 1.348e+00 3.500 12850.0 !6 !mp2d+ch3o=mp2d3j+ch3oh !6 mp2d+ch3o2=mp2d3j+ch3o2h 7.500e+09 0.000 12570.0 !6 mp2d+c2h3=mp2d3j+c2h4 1.387e+00 3.500 10870.0 !6 !mp2d+c2h5=mp2d3j+c2h6 !6 ! !vins H mp2d+h=mp2d2j+h2 4.050e+05 2.500 09794.0 !6 mp2d+ho2=mp2d2j+h2o2 3.000e+09 0.000 09930.0 !6 mp2d+oh=mp2d2j+h2o 1.110e+06 2.000 01451.0 !6 mp2d+o2=mp2d2j+ho2 1.400e+12 0.000 60700.0 !6 mp2d+o=mp2d2j+oh 6.030e+10 0.700 07632.0 !6 mp2d+ch3=mp2d2j+ch4 8.400e-01 3.500 11660.0 !6 !mp2d+ch3o=mp2d2j+ch3oh !6 mp2d+ch3o2=mp2d2j+ch3o2h 3.000e+09 0.000 09930.0 !6 mp2d+c2h3=mp2d2j+c2h4 8.401e-01 3.500 09680.0 !6 !mp2d+c2h5=mp2d2j+c2h6 !6 ! !primary H mb3d+h=mb3dmj+h2 9.400e+04 2.750 06280.0 !6 mb3d+ho2=mb3dmj+h2o2 4.050e+04 2.500 16690.0 !6 mb3d+oh=mb3dmj+h2o 5.270e+09 0.970 01590.0 !6 mb3d+o2=mb3dmj+ho2 6.000e+13 0.000 52800.0 !6 mb3d+o=mb3dmj+oh 1.046e+06 2.420 04766.0 !6 mb3d+ch3=mb3dmj+ch4 4.520e-01 3.650 07154.0 !6 mb3d+ch3o=mb3dmj+ch3oh 1.500e+10 0.000 07000.0 !6 mb3d+ch3o2=mb3dmj+ch3o2h 4.050e+04 2.500 16690.0 !6 mb3d+c2h3=mb3dmj+c2h4 5.000e+11 0.000 18000.0 !6 mb3d+c2h5=mb3dmj+c2h6 5.000e+10 0.000 13400.0 !6 ! !allylic H mb3d+h=mb3d2j+h2 3.376e+05 2.360 00207.0 !6 mb3d+ho2=mb3d2j+h2o2 4.820e+03 2.550 10530.0 !6 mb3d+oh=mb3d2j+h2o 2.764e+04 2.640 -01919.0 !6 mb3d+o2=mb3d2j+ho2 2.200e+12 0.000 37220.0 !6 mb3d+o=mb3d2j+oh 6.600e+05 2.430 01210.0 !6 mb3d+ch3=mb3d2j+ch4 3.690e+00 3.310 04002.0 !6 mb3d+ch3o=mb3d2j+ch3oh 4.000e+01 2.900 08609.0 !6 mb3d+ch3o2=mb3d2j+ch3o2h 4.820e+03 2.550 10530.0 !6 mb3d+c2h3=mb3d2j+c2h4 2.211E+00 3.500 04690.0 !6 mb3d+c2h5=mb3d2j+c2h6 1.000e+11 0.000 09800.0 !6 ! !vin H mb3d+h=mb3d4j+h2 8.040e+05 2.500 12280.0 !6 mb3d+ho2=mb3d4j+h2o2 7.500e+09 0.000 12570.0 !6 mb3d+oh=mb3d4j+h2o 2.110e+06 2.000 02778.0 !6 mb3d+o2=mb3d4j+ho2 2.000e+12 0.000 62900.0 !6 mb3d+o=mb3d4j+oh 1.200e+11 0.700 08959.0 !6 mb3d+ch3=mb3d4j+ch4 1.348e+00 3.500 12850.0 !6 !mb3d+ch3o=mb3d4j+ch3oh !6 mb3d+ch3o2=mb3d4j+ch3o2h 7.500e+09 0.000 12570.0 !6 mb3d+c2h3=mb3d4j+c2h4 1.387e+00 3.500 10870.0 !6 !mb3d+c2h5=mb3d4j+c2h6 !6 ! !vins H mb3d+h=mb3d3j+h2 4.050e+05 2.500 09794.0 !6 mb3d+ho2=mb3d3j+h2o2 3.000e+09 0.000 09930.0 !6 mb3d+oh=mb3d3j+h2o 1.110e+06 2.000 01451.0 !6 mb3d+o2=mb3d3j+ho2 1.400e+12 0.000 60700.0 !6 mb3d+o=mb3d3j+oh 6.030e+10 0.700 07632.0 !6 mb3d+ch3=mb3d3j+ch4 8.400e-01 3.500 11660.0 !6 !mb3d+ch3o=mb3d3j+ch3oh !6 mb3d+ch3o2=mb3d3j+ch3o2h 3.000e+09 0.000 09930.0 !6 mb3d+c2h3=mb3d3j+c2h4 8.401e-01 3.500 09680.0 !6 !mb3d+c2h5=mb3d3j+c2h6 !6 ! !primary H mf4d+h=mf4dmj+h2 9.400e+04 2.750 06280.0 !6 mf4d+ho2=mf4dmj+h2o2 4.050e+04 2.500 16690.0 !6 mf4d+oh=mf4dmj+h2o 5.270e+09 0.970 01590.0 !6 mf4d+o2=mf4dmj+ho2 6.000e+13 0.000 52800.0 !6 mf4d+o=mf4dmj+oh 1.046e+06 2.420 04766.0 !6 mf4d+ch3=mf4dmj+ch4 4.520e-01 3.650 07154.0 !6 mf4d+ch3o=mf4dmj+ch3oh 1.500e+10 0.000 07000.0 !6 mf4d+ch3o2=mf4dmj+ch3o2h 4.050e+04 2.500 16690.0 !6 mf4d+c2h3=mf4dmj+c2h4 5.000e+11 0.000 18000.0 !6 mf4d+c2h5=mf4dmj+c2h6 5.000e+10 0.000 13400.0 !6 ! !tertiary H assumed mf4d+h=mf4d2j+h2 3.620e+06 2.540 06756.0 !6 mf4d+ho2=mf4d2j+h2o2 7.220e+03 2.550 10530.0 !6 mf4d+oh=mf4d2j+h2o 1.146e+11 0.510 00063.0 !6 mf4d+o2=mf4d2j+ho2 4.080e+13 0.000 41350.0 !6 mf4d+o=mf4d2j+oh 3.936e+05 2.400 01150.0 !6 mf4d+ch3=mf4d2j+ch4 2.720e+00 3.650 07154.0 !6 mf4d+ch3o=mf4d2j+ch3oh 3.800e+10 0.000 02800.0 !6 mf4d+ch3o2=mf4d2j+ch3o2h 7.220e+03 2.550 10530.0 !6 mf4d+c2h3=mf4d2j+c2h4 4.000e+11 0.000 14300.0 !6 mf4d+c2h5=mf4d2j+c2h6 2.000E+11 0.000 07900.0 !6 ! !allylic H mf4d+h=mf4d3j+h2 3.376e+05 2.360 00207.0 !6 mf4d+ho2=mf4d3j+h2o2 4.820e+03 2.550 10530.0 !6 mf4d+oh=mf4d3j+h2o 2.764e+04 2.640 -01919.0 !6 mf4d+o2=mf4d3j+ho2 2.200e+12 0.000 37220.0 !6 mf4d+o=mf4d3j+oh 6.600e+05 2.430 01210.0 !6 mf4d+ch3=mf4d3j+ch4 3.690e+00 3.310 04002.0 !6 mf4d+ch3o=mf4d3j+ch3oh 4.000e+01 2.900 08609.0 !6 mf4d+ch3o2=mf4d3j+ch3o2h 4.820e+03 2.550 10530.0 !6 mf4d+c2h3=mf4d3j+c2h4 2.211E+00 3.500 04690.0 !6 mf4d+c2h5=mf4d3j+c2h6 1.000e+11 0.000 09800.0 !6 ! !vin H mf4d+h=mf4d5j+h2 8.040e+05 2.500 12280.0 !6 mf4d+ho2=mf4d5j+h2o2 7.500e+09 0.000 12570.0 !6 mf4d+oh=mf4d5j+h2o 2.110e+06 2.000 02778.0 !6 mf4d+o2=mf4d5j+ho2 2.000e+12 0.000 62900.0 !6 mf4d+o=mf4d5j+oh 1.200e+11 0.700 08959.0 !6 mf4d+ch3=mf4d5j+ch4 1.348e+00 3.500 12850.0 !6 !mf4d+ch3o=mf4d5j+ch3oh !6 mf4d+ch3o2=mf4d5j+ch3o2h 7.500e+09 0.000 12570.0 !6 mf4d+c2h3=mf4d5j+c2h4 1.387e+00 3.500 10870.0 !6 !mf4d+c2h5=mf4d5j+c2h6 !6 ! !vins H mf4d+h=mf4d4j+h2 4.050e+05 2.500 09794.0 !6 mf4d+ho2=mf4d4j+h2o2 3.000e+09 0.000 09930.0 !6 mf4d+oh=mf4d4j+h2o 1.110e+06 2.000 01451.0 !6 mf4d+o2=mf4d4j+ho2 1.400e+12 0.000 60700.0 !6 mf4d+o=mf4d4j+oh 6.030e+10 0.700 07632.0 !6 mf4d+ch3=mf4d4j+ch4 8.400e-01 3.500 11660.0 !6 !mf4d+ch3o=mf4d4j+ch3oh !6 mf4d+ch3o2=mf4d4j+ch3o2h 3.000e+09 0.000 09930.0 !6 mf4d+c2h3=mf4d4j+c2h4 8.401e-01 3.500 09680.0 !6 !mf4d+c2h5=mf4d4j+c2h6 !6 ! !primary H mh5d+h=mh5dmj+h2 9.400e+04 2.750 06280.0 !6 mh5d+ho2=mh5dmj+h2o2 4.050e+04 2.500 16690.0 !6 mh5d+oh=mh5dmj+h2o 5.270e+09 0.970 01590.0 !6 mh5d+o2=mh5dmj+ho2 6.000e+13 0.000 52800.0 !6 mh5d+o=mh5dmj+oh 1.046e+06 2.420 04766.0 !6 mh5d+ch3=mh5dmj+ch4 4.520e-01 3.650 07154.0 !6 mh5d+ch3o=mh5dmj+ch3oh 1.500e+10 0.000 07000.0 !6 mh5d+ch3o2=mh5dmj+ch3o2h 4.050e+04 2.500 16690.0 !6 mh5d+c2h3=mh5dmj+c2h4 5.000e+11 0.000 18000.0 !6 mh5d+c2h5=mh5dmj+c2h6 5.000e+10 0.000 13400.0 !6 ! !tertiary H assumed mh5d+h=mh5d2j+h2 3.620e+06 2.540 06756.0 !6 mh5d+ho2=mh5d2j+h2o2 7.220e+03 2.550 10530.0 !6 mh5d+oh=mh5d2j+h2o 1.146e+11 0.510 00063.0 !6 mh5d+o2=mh5d2j+ho2 4.080e+13 0.000 41350.0 !6 mh5d+o=mh5d2j+oh 3.936e+05 2.400 01150.0 !6 mh5d+ch3=mh5d2j+ch4 2.720e+00 3.650 07154.0 !6 mh5d+ch3o=mh5d2j+ch3oh 3.800e+10 0.000 02800.0 !6 mh5d+ch3o2=mh5d2j+ch3o2h 7.220e+03 2.550 10530.0 !6 mh5d+c2h3=mh5d2j+c2h4 4.000e+11 0.000 14300.0 !6 mh5d+c2h5=mh5d2j+c2h6 2.000E+11 0.000 07900.0 !6 ! mh5d+h=mh5d3j+h2 1.300e+06 2.400 04471.0 !6 mh5d+ho2=mh5d3j+h2o2 5.880e+04 2.500 14860.0 !6 mh5d+oh=mh5d3j+h2o 4.670e+07 1.610 -00035.0 !6 mh5d+o2=mh5d3j+ho2 4.000e+13 0.000 50160.0 !6 mh5d+o=mh5d3j+oh 5.946e+05 2.440 02846.0 !6 mh5d+ch3=mh5d3j+ch4 8.400e+04 2.130 07574.0 !6 mh5d+ch3o=mh5d3j+ch3oh 1.100e+11 0.000 05000.0 !6 mh5d+ch3o2=mh5d3j+ch3o2h 5.880e+04 2.500 14860.0 !6 mh5d+c2h3=mh5d3j+c2h4 4.000e+11 0.000 16800.0 !6 mh5d+c2h5=mh5d3j+c2h6 5.000e+10 0.000 10400.0 !6 ! !allylic H mh5d+h=mh5d4j+h2 3.376e+05 2.360 00207.0 !6 mh5d+ho2=mh5d4j+h2o2 4.820e+03 2.550 10530.0 !6 mh5d+oh=mh5d4j+h2o 2.764e+04 2.640 -01919.0 !6 mh5d+o2=mh5d4j+ho2 2.200e+12 0.000 37220.0 !6 mh5d+o=mh5d4j+oh 6.600e+05 2.430 01210.0 !6 mh5d+ch3=mh5d4j+ch4 3.690e+00 3.310 04002.0 !6 mh5d+ch3o=mh5d4j+ch3oh 4.000e+01 2.900 08609.0 !6 mh5d+ch3o2=mh5d4j+ch3o2h 4.820e+03 2.550 10530.0 !6 mh5d+c2h3=mh5d4j+c2h4 2.211E+00 3.500 04690.0 !6 mh5d+c2h5=mh5d4j+c2h6 1.000e+11 0.000 09800.0 !6 ! !vin H mh5d+h=mh5d6j+h2 8.040e+05 2.500 12280.0 !6 mh5d+ho2=mh5d6j+h2o2 7.500e+09 0.000 12570.0 !6 mh5d+oh=mh5d6j+h2o 2.110e+06 2.000 02778.0 !6 mh5d+o2=mh5d6j+ho2 2.000e+12 0.000 62900.0 !6 mh5d+o=mh5d6j+oh 1.200e+11 0.700 08959.0 !6 mh5d+ch3=mh5d6j+ch4 1.348e+00 3.500 12850.0 !6 !mh5d+ch3o=mh5d6j+ch3oh !6 mh5d+ch3o2=mh5d6j+ch3o2h 7.500e+09 0.000 12570.0 !6 mh5d+c2h3=mh5d6j+c2h4 1.387e+00 3.500 10870.0 !6 !mh5d+c2h5=mh5d6j+c2h6 !6 ! !vins H mh5d+h=mh5d5j+h2 4.050e+05 2.500 09794.0 !6 mh5d+ho2=mh5d5j+h2o2 3.000e+09 0.000 09930.0 !6 mh5d+oh=mh5d5j+h2o 1.110e+06 2.000 01451.0 !6 mh5d+o2=mh5d5j+ho2 1.400e+12 0.000 60700.0 !6 mh5d+o=mh5d5j+oh 6.030e+10 0.700 07632.0 !6 mh5d+ch3=mh5d5j+ch4 8.400e-01 3.500 11660.0 !6 !mh5d+ch3o=mh5d5j+ch3oh !6 mh5d+ch3o2=mh5d5j+ch3o2h 3.000e+09 0.000 09930.0 !6 mh5d+c2h3=mh5d5j+c2h4 8.401e-01 3.500 09680.0 !6 !mh5d+c2h5=mh5d5j+c2h6 !6 ! !primary H ms6d+h=ms6dmj+h2 9.400e+04 2.750 06280.0 !6 ms6d+ho2=ms6dmj+h2o2 4.050e+04 2.500 16690.0 !6 ms6d+oh=ms6dmj+h2o 5.270e+09 0.970 01590.0 !6 ms6d+o2=ms6dmj+ho2 6.000e+13 0.000 52800.0 !6 ms6d+o=ms6dmj+oh 1.046e+06 2.420 04766.0 !6 ms6d+ch3=ms6dmj+ch4 4.520e-01 3.650 07154.0 !6 ms6d+ch3o=ms6dmj+ch3oh 1.500e+10 0.000 07000.0 !6 ms6d+ch3o2=ms6dmj+ch3o2h 4.050e+04 2.500 16690.0 !6 ms6d+c2h3=ms6dmj+c2h4 5.000e+11 0.000 18000.0 !6 ms6d+c2h5=ms6dmj+c2h6 5.000e+10 0.000 13400.0 !6 ! !tertiary H assumed ms6d+h=ms6d2j+h2 3.620e+06 2.540 06756.0 !6 ms6d+ho2=ms6d2j+h2o2 7.220e+03 2.550 10530.0 !6 ms6d+oh=ms6d2j+h2o 1.146e+11 0.510 00063.0 !6 ms6d+o2=ms6d2j+ho2 4.080e+13 0.000 41350.0 !6 ms6d+o=ms6d2j+oh 3.936e+05 2.400 01150.0 !6 ms6d+ch3=ms6d2j+ch4 2.720e+00 3.650 07154.0 !6 ms6d+ch3o=ms6d2j+ch3oh 3.800e+10 0.000 02800.0 !6 ms6d+ch3o2=ms6d2j+ch3o2h 7.220e+03 2.550 10530.0 !6 ms6d+c2h3=ms6d2j+c2h4 4.000e+11 0.000 14300.0 !6 ms6d+c2h5=ms6d2j+c2h6 2.000E+11 0.000 07900.0 !6 ! ms6d+h=ms6d3j+h2 1.300e+06 2.400 04471.0 !6 ms6d+ho2=ms6d3j+h2o2 5.880e+04 2.500 14860.0 !6 ms6d+oh=ms6d3j+h2o 4.670e+07 1.610 -00035.0 !6 ms6d+o2=ms6d3j+ho2 4.000e+13 0.000 50160.0 !6 ms6d+o=ms6d3j+oh 5.946e+05 2.440 02846.0 !6 ms6d+ch3=ms6d3j+ch4 8.400e+04 2.130 07574.0 !6 ms6d+ch3o=ms6d3j+ch3oh 1.100e+11 0.000 05000.0 !6 ms6d+ch3o2=ms6d3j+ch3o2h 5.880e+04 2.500 14860.0 !6 ms6d+c2h3=ms6d3j+c2h4 4.000e+11 0.000 16800.0 !6 ms6d+c2h5=ms6d3j+c2h6 5.000e+10 0.000 10400.0 !6 ! ms6d+h=ms6d4j+h2 1.300e+06 2.400 04471.0 !6 ms6d+ho2=ms6d4j+h2o2 5.880e+04 2.500 14860.0 !6 ms6d+oh=ms6d4j+h2o 4.670e+07 1.610 -00035.0 !6 ms6d+o2=ms6d4j+ho2 4.000e+13 0.000 50160.0 !6 ms6d+o=ms6d4j+oh 5.946e+05 2.440 02846.0 !6 ms6d+ch3=ms6d4j+ch4 8.400e+04 2.130 07574.0 !6 ms6d+ch3o=ms6d4j+ch3oh 1.100e+11 0.000 05000.0 !6 ms6d+ch3o2=ms6d4j+ch3o2h 5.880e+04 2.500 14860.0 !6 ms6d+c2h3=ms6d4j+c2h4 4.000e+11 0.000 16800.0 !6 ms6d+c2h5=ms6d4j+c2h6 5.000e+10 0.000 10400.0 !6 ! !allylic H ms6d+h=ms6d5j+h2 3.376e+05 2.360 00207.0 !6 ms6d+ho2=ms6d5j+h2o2 4.820e+03 2.550 10530.0 !6 ms6d+oh=ms6d5j+h2o 2.764e+04 2.640 -01919.0 !6 ms6d+o2=ms6d5j+ho2 2.200e+12 0.000 37220.0 !6 ms6d+o=ms6d5j+oh 6.600e+05 2.430 01210.0 !6 ms6d+ch3=ms6d5j+ch4 3.690e+00 3.310 04002.0 !6 ms6d+ch3o=ms6d5j+ch3oh 4.000e+01 2.900 08609.0 !6 ms6d+ch3o2=ms6d5j+ch3o2h 4.820e+03 2.550 10530.0 !6 ms6d+c2h3=ms6d5j+c2h4 2.211E+00 3.500 04690.0 !6 ms6d+c2h5=ms6d5j+c2h6 1.000e+11 0.000 09800.0 !6 ! !vin H ms6d+h=ms6d7j+h2 8.040e+05 2.500 12280.0 !6 ms6d+ho2=ms6d7j+h2o2 7.500e+09 0.000 12570.0 !6 ms6d+oh=ms6d7j+h2o 2.110e+06 2.000 02778.0 !6 ms6d+o2=ms6d7j+ho2 2.000e+12 0.000 62900.0 !6 ms6d+o=ms6d7j+oh 1.200e+11 0.700 08959.0 !6 ms6d+ch3=ms6d7j+ch4 1.348e+00 3.500 12850.0 !6 !ms6d+ch3o=ms6d7j+ch3oh !6 ms6d+ch3o2=ms6d7j+ch3o2h 7.500e+09 0.000 12570.0 !6 ms6d+c2h3=ms6d7j+c2h4 1.387e+00 3.500 10870.0 !6 !ms6d+c2h5=ms6d7j+c2h6 !6 ! !vins H ms6d+h=ms6d6j+h2 4.050e+05 2.500 09794.0 !6 ms6d+ho2=ms6d6j+h2o2 3.000e+09 0.000 09930.0 !6 ms6d+oh=ms6d6j+h2o 1.110e+06 2.000 01451.0 !6 ms6d+o2=ms6d6j+ho2 1.400e+12 0.000 60700.0 !6 ms6d+o=ms6d6j+oh 6.030e+10 0.700 07632.0 !6 ms6d+ch3=ms6d6j+ch4 8.400e-01 3.500 11660.0 !6 !ms6d+ch3o=ms6d6j+ch3oh !6 ms6d+ch3o2=ms6d6j+ch3o2h 3.000e+09 0.000 09930.0 !6 ms6d+c2h3=ms6d6j+c2h4 8.401e-01 3.500 09680.0 !6 !ms6d+c2h5=ms6d6j+c2h6 !6 ! !primary H mo7d+h=mo7dmj+h2 9.400e+04 2.750 06280.0 !6 mo7d+ho2=mo7dmj+h2o2 4.050e+04 2.500 16690.0 !6 mo7d+oh=mo7dmj+h2o 5.270e+09 0.970 01590.0 !6 mo7d+o2=mo7dmj+ho2 6.000e+13 0.000 52800.0 !6 mo7d+o=mo7dmj+oh 1.046e+06 2.420 04766.0 !6 mo7d+ch3=mo7dmj+ch4 4.520e-01 3.650 07154.0 !6 mo7d+ch3o=mo7dmj+ch3oh 1.500e+10 0.000 07000.0 !6 mo7d+ch3o2=mo7dmj+ch3o2h 4.050e+04 2.500 16690.0 !6 mo7d+c2h3=mo7dmj+c2h4 5.000e+11 0.000 18000.0 !6 mo7d+c2h5=mo7dmj+c2h6 5.000e+10 0.000 13400.0 !6 ! !tertiary H assumed mo7d+h=mo7d2j+h2 3.620e+06 2.540 06756.0 !6 mo7d+ho2=mo7d2j+h2o2 7.220e+03 2.550 10530.0 !6 mo7d+oh=mo7d2j+h2o 1.146e+11 0.510 00063.0 !6 mo7d+o2=mo7d2j+ho2 4.080e+13 0.000 41350.0 !6 mo7d+o=mo7d2j+oh 3.936e+05 2.400 01150.0 !6 mo7d+ch3=mo7d2j+ch4 2.720e+00 3.650 07154.0 !6 mo7d+ch3o=mo7d2j+ch3oh 3.800e+10 0.000 02800.0 !6 mo7d+ch3o2=mo7d2j+ch3o2h 7.220e+03 2.550 10530.0 !6 mo7d+c2h3=mo7d2j+c2h4 4.000e+11 0.000 14300.0 !6 mo7d+c2h5=mo7d2j+c2h6 2.000E+11 0.000 07900.0 !6 ! mo7d+h=mo7d3j+h2 1.300e+06 2.400 04471.0 !6 mo7d+ho2=mo7d3j+h2o2 5.880e+04 2.500 14860.0 !6 mo7d+oh=mo7d3j+h2o 4.670e+07 1.610 -00035.0 !6 mo7d+o2=mo7d3j+ho2 4.000e+13 0.000 50160.0 !6 mo7d+o=mo7d3j+oh 5.946e+05 2.440 02846.0 !6 mo7d+ch3=mo7d3j+ch4 8.400e+04 2.130 07574.0 !6 mo7d+ch3o=mo7d3j+ch3oh 1.100e+11 0.000 05000.0 !6 mo7d+ch3o2=mo7d3j+ch3o2h 5.880e+04 2.500 14860.0 !6 mo7d+c2h3=mo7d3j+c2h4 4.000e+11 0.000 16800.0 !6 mo7d+c2h5=mo7d3j+c2h6 5.000e+10 0.000 10400.0 !6 ! mo7d+h=mo7d4j+h2 1.300e+06 2.400 04471.0 !6 mo7d+ho2=mo7d4j+h2o2 5.880e+04 2.500 14860.0 !6 mo7d+oh=mo7d4j+h2o 4.670e+07 1.610 -00035.0 !6 mo7d+o2=mo7d4j+ho2 4.000e+13 0.000 50160.0 !6 mo7d+o=mo7d4j+oh 5.946e+05 2.440 02846.0 !6 mo7d+ch3=mo7d4j+ch4 8.400e+04 2.130 07574.0 !6 mo7d+ch3o=mo7d4j+ch3oh 1.100e+11 0.000 05000.0 !6 mo7d+ch3o2=mo7d4j+ch3o2h 5.880e+04 2.500 14860.0 !6 mo7d+c2h3=mo7d4j+c2h4 4.000e+11 0.000 16800.0 !6 mo7d+c2h5=mo7d4j+c2h6 5.000e+10 0.000 10400.0 !6 ! mo7d+h=mo7d5j+h2 1.300e+06 2.400 04471.0 !6 mo7d+ho2=mo7d5j+h2o2 5.880e+04 2.500 14860.0 !6 mo7d+oh=mo7d5j+h2o 4.670e+07 1.610 -00035.0 !6 mo7d+o2=mo7d5j+ho2 4.000e+13 0.000 50160.0 !6 mo7d+o=mo7d5j+oh 5.946e+05 2.440 02846.0 !6 mo7d+ch3=mo7d5j+ch4 8.400e+04 2.130 07574.0 !6 mo7d+ch3o=mo7d5j+ch3oh 1.100e+11 0.000 05000.0 !6 mo7d+ch3o2=mo7d5j+ch3o2h 5.880e+04 2.500 14860.0 !6 mo7d+c2h3=mo7d5j+c2h4 4.000e+11 0.000 16800.0 !6 mo7d+c2h5=mo7d5j+c2h6 5.000e+10 0.000 10400.0 !6 ! !allylic H mo7d+h=mo7d6j+h2 3.376e+05 2.360 00207.0 !6 mo7d+ho2=mo7d6j+h2o2 4.820e+03 2.550 10530.0 !6 mo7d+oh=mo7d6j+h2o 2.764e+04 2.640 -01919.0 !6 mo7d+o2=mo7d6j+ho2 2.200e+12 0.000 37220.0 !6 mo7d+o=mo7d6j+oh 6.600e+05 2.430 01210.0 !6 mo7d+ch3=mo7d6j+ch4 3.690e+00 3.310 04002.0 !6 mo7d+ch3o=mo7d6j+ch3oh 4.000e+01 2.900 08609.0 !6 mo7d+ch3o2=mo7d6j+ch3o2h 4.820e+03 2.550 10530.0 !6 mo7d+c2h3=mo7d6j+c2h4 2.211E+00 3.500 04690.0 !6 mo7d+c2h5=mo7d6j+c2h6 1.000e+11 0.000 09800.0 !6 ! !vin H mo7d+h=mo7d8j+h2 8.040e+05 2.500 12280.0 !6 mo7d+ho2=mo7d8j+h2o2 7.500e+09 0.000 12570.0 !6 mo7d+oh=mo7d8j+h2o 2.110e+06 2.000 02778.0 !6 mo7d+o2=mo7d8j+ho2 2.000e+12 0.000 62900.0 !6 mo7d+o=mo7d8j+oh 1.200e+11 0.700 08959.0 !6 mo7d+ch3=mo7d8j+ch4 1.348e+00 3.500 12850.0 !6 !mo7d+ch3o=mo7d8j+ch3oh !6 mo7d+ch3o2=mo7d8j+ch3o2h 7.500e+09 0.000 12570.0 !6 mo7d+c2h3=mo7d8j+c2h4 1.387e+00 3.500 10870.0 !6 !mo7d+c2h5=mo7d8j+c2h6 !6 ! !vins H mo7d+h=mo7d7j+h2 4.050e+05 2.500 09794.0 !6 mo7d+ho2=mo7d7j+h2o2 3.000e+09 0.000 09930.0 !6 mo7d+oh=mo7d7j+h2o 1.110e+06 2.000 01451.0 !6 mo7d+o2=mo7d7j+ho2 1.400e+12 0.000 60700.0 !6 mo7d+o=mo7d7j+oh 6.030e+10 0.700 07632.0 !6 mo7d+ch3=mo7d7j+ch4 8.400e-01 3.500 11660.0 !6 !mo7d+ch3o=mo7d7j+ch3oh !6 mo7d+ch3o2=mo7d7j+ch3o2h 3.000e+09 0.000 09930.0 !6 mo7d+c2h3=mo7d7j+c2h4 8.401e-01 3.500 09680.0 !6 !mo7d+c2h5=mo7d7j+c2h6 !6 ! !primary H mn8d+h=mn8dmj+h2 9.400e+04 2.750 06280.0 !6 mn8d+ho2=mn8dmj+h2o2 4.050e+04 2.500 16690.0 !6 mn8d+oh=mn8dmj+h2o 5.270e+09 0.970 01590.0 !6 mn8d+o2=mn8dmj+ho2 6.000e+13 0.000 52800.0 !6 mn8d+o=mn8dmj+oh 1.046e+06 2.420 04766.0 !6 mn8d+ch3=mn8dmj+ch4 4.520e-01 3.650 07154.0 !6 mn8d+ch3o=mn8dmj+ch3oh 1.500e+10 0.000 07000.0 !6 mn8d+ch3o2=mn8dmj+ch3o2h 4.050e+04 2.500 16690.0 !6 mn8d+c2h3=mn8dmj+c2h4 5.000e+11 0.000 18000.0 !6 mn8d+c2h5=mn8dmj+c2h6 5.000e+10 0.000 13400.0 !6 ! !tertiary H assumed mn8d+h=mn8d2j+h2 3.620e+06 2.540 06756.0 !6 mn8d+ho2=mn8d2j+h2o2 7.220e+03 2.550 10530.0 !6 mn8d+oh=mn8d2j+h2o 1.146e+11 0.510 00063.0 !6 mn8d+o2=mn8d2j+ho2 4.080e+13 0.000 41350.0 !6 mn8d+o=mn8d2j+oh 3.936e+05 2.400 01150.0 !6 mn8d+ch3=mn8d2j+ch4 2.720e+00 3.650 07154.0 !6 mn8d+ch3o=mn8d2j+ch3oh 3.800e+10 0.000 02800.0 !6 mn8d+ch3o2=mn8d2j+ch3o2h 7.220e+03 2.550 10530.0 !6 mn8d+c2h3=mn8d2j+c2h4 4.000e+11 0.000 14300.0 !6 mn8d+c2h5=mn8d2j+c2h6 2.000E+11 0.000 07900.0 !6 ! mn8d+h=mn8d3j+h2 1.300e+06 2.400 04471.0 !6 mn8d+ho2=mn8d3j+h2o2 5.880e+04 2.500 14860.0 !6 mn8d+oh=mn8d3j+h2o 4.670e+07 1.610 -00035.0 !6 mn8d+o2=mn8d3j+ho2 4.000e+13 0.000 50160.0 !6 mn8d+o=mn8d3j+oh 5.946e+05 2.440 02846.0 !6 mn8d+ch3=mn8d3j+ch4 8.400e+04 2.130 07574.0 !6 mn8d+ch3o=mn8d3j+ch3oh 1.100e+11 0.000 05000.0 !6 mn8d+ch3o2=mn8d3j+ch3o2h 5.880e+04 2.500 14860.0 !6 mn8d+c2h3=mn8d3j+c2h4 4.000e+11 0.000 16800.0 !6 mn8d+c2h5=mn8d3j+c2h6 5.000e+10 0.000 10400.0 !6 ! mn8d+h=mn8d4j+h2 1.300e+06 2.400 04471.0 !6 mn8d+ho2=mn8d4j+h2o2 5.880e+04 2.500 14860.0 !6 mn8d+oh=mn8d4j+h2o 4.670e+07 1.610 -00035.0 !6 mn8d+o2=mn8d4j+ho2 4.000e+13 0.000 50160.0 !6 mn8d+o=mn8d4j+oh 5.946e+05 2.440 02846.0 !6 mn8d+ch3=mn8d4j+ch4 8.400e+04 2.130 07574.0 !6 mn8d+ch3o=mn8d4j+ch3oh 1.100e+11 0.000 05000.0 !6 mn8d+ch3o2=mn8d4j+ch3o2h 5.880e+04 2.500 14860.0 !6 mn8d+c2h3=mn8d4j+c2h4 4.000e+11 0.000 16800.0 !6 mn8d+c2h5=mn8d4j+c2h6 5.000e+10 0.000 10400.0 !6 ! mn8d+h=mn8d5j+h2 1.300e+06 2.400 04471.0 !6 mn8d+ho2=mn8d5j+h2o2 5.880e+04 2.500 14860.0 !6 mn8d+oh=mn8d5j+h2o 4.670e+07 1.610 -00035.0 !6 mn8d+o2=mn8d5j+ho2 4.000e+13 0.000 50160.0 !6 mn8d+o=mn8d5j+oh 5.946e+05 2.440 02846.0 !6 mn8d+ch3=mn8d5j+ch4 8.400e+04 2.130 07574.0 !6 mn8d+ch3o=mn8d5j+ch3oh 1.100e+11 0.000 05000.0 !6 mn8d+ch3o2=mn8d5j+ch3o2h 5.880e+04 2.500 14860.0 !6 mn8d+c2h3=mn8d5j+c2h4 4.000e+11 0.000 16800.0 !6 mn8d+c2h5=mn8d5j+c2h6 5.000e+10 0.000 10400.0 !6 ! mn8d+h=mn8d6j+h2 1.300e+06 2.400 04471.0 !6 mn8d+ho2=mn8d6j+h2o2 5.880e+04 2.500 14860.0 !6 mn8d+oh=mn8d6j+h2o 4.670e+07 1.610 -00035.0 !6 mn8d+o2=mn8d6j+ho2 4.000e+13 0.000 50160.0 !6 mn8d+o=mn8d6j+oh 5.946e+05 2.440 02846.0 !6 mn8d+ch3=mn8d6j+ch4 8.400e+04 2.130 07574.0 !6 mn8d+ch3o=mn8d6j+ch3oh 1.100e+11 0.000 05000.0 !6 mn8d+ch3o2=mn8d6j+ch3o2h 5.880e+04 2.500 14860.0 !6 mn8d+c2h3=mn8d6j+c2h4 4.000e+11 0.000 16800.0 !6 mn8d+c2h5=mn8d6j+c2h6 5.000e+10 0.000 10400.0 !6 ! !allylic H mn8d+h=mn8d7j+h2 3.376e+05 2.360 00207.0 !6 mn8d+ho2=mn8d7j+h2o2 4.820e+03 2.550 10530.0 !6 mn8d+oh=mn8d7j+h2o 2.764e+04 2.640 -01919.0 !6 mn8d+o2=mn8d7j+ho2 2.200e+12 0.000 37220.0 !6 mn8d+o=mn8d7j+oh 6.600e+05 2.430 01210.0 !6 mn8d+ch3=mn8d7j+ch4 3.690e+00 3.310 04002.0 !6 mn8d+ch3o=mn8d7j+ch3oh 4.000e+01 2.900 08609.0 !6 mn8d+ch3o2=mn8d7j+ch3o2h 4.820e+03 2.550 10530.0 !6 mn8d+c2h3=mn8d7j+c2h4 2.211E+00 3.500 04690.0 !6 mn8d+c2h5=mn8d7j+c2h6 1.000e+11 0.000 09800.0 !6 ! !vin H mn8d+h=mn8d9j+h2 8.040e+05 2.500 12280.0 !6 mn8d+ho2=mn8d9j+h2o2 7.500e+09 0.000 12570.0 !6 mn8d+oh=mn8d9j+h2o 2.110e+06 2.000 02778.0 !6 mn8d+o2=mn8d9j+ho2 2.000e+12 0.000 62900.0 !6 mn8d+o=mn8d9j+oh 1.200e+11 0.700 08959.0 !6 mn8d+ch3=mn8d9j+ch4 1.348e+00 3.500 12850.0 !6 !mn8d+ch3o=mn8d9j+ch3oh !6 mn8d+ch3o2=mn8d9j+ch3o2h 7.500e+09 0.000 12570.0 !6 mn8d+c2h3=mn8d9j+c2h4 1.387e+00 3.500 10870.0 !6 !mn8d+c2h5=mn8d9j+c2h6 !6 ! !vins H mn8d+h=mn8d8j+h2 4.050e+05 2.500 09794.0 !6 mn8d+ho2=mn8d8j+h2o2 3.000e+09 0.000 09930.0 !6 mn8d+oh=mn8d8j+h2o 1.110e+06 2.000 01451.0 !6 mn8d+o2=mn8d8j+ho2 1.400e+12 0.000 60700.0 !6 mn8d+o=mn8d8j+oh 6.030e+10 0.700 07632.0 !6 mn8d+ch3=mn8d8j+ch4 8.400e-01 3.500 11660.0 !6 !mn8d+ch3o=mn8d8j+ch3oh !6 mn8d+ch3o2=mn8d8j+ch3o2h 3.000e+09 0.000 09930.0 !6 mn8d+c2h3=mn8d8j+c2h4 8.401e-01 3.500 09680.0 !6 !mn8d+c2h5=mn8d8j+c2h6 !6 ! !primary H md9d+h=md9dmj+h2 9.400e+04 2.750 06280.0 !6 md9d+ho2=md9dmj+h2o2 4.050e+04 2.500 16690.0 !6 md9d+oh=md9dmj+h2o 5.270e+09 0.970 01590.0 !6 md9d+o2=md9dmj+ho2 6.000e+13 0.000 52800.0 !6 md9d+o=md9dmj+oh 1.046e+06 2.420 04766.0 !6 md9d+ch3=md9dmj+ch4 4.520e-01 3.650 07154.0 !6 md9d+ch3o=md9dmj+ch3oh 1.500e+10 0.000 07000.0 !6 md9d+ch3o2=md9dmj+ch3o2h 4.050e+04 2.500 16690.0 !6 md9d+c2h3=md9dmj+c2h4 5.000e+11 0.000 18000.0 !6 md9d+c2h5=md9dmj+c2h6 5.000e+10 0.000 13400.0 !6 ! !tertiary H assumed md9d+h=md9d2j+h2 3.620e+06 2.540 06756.0 !6 md9d+ho2=md9d2j+h2o2 7.220e+03 2.550 10530.0 !6 md9d+oh=md9d2j+h2o 1.146e+11 0.510 00063.0 !6 md9d+o2=md9d2j+ho2 4.080e+13 0.000 41350.0 !6 md9d+o=md9d2j+oh 3.936e+05 2.400 01150.0 !6 md9d+ch3=md9d2j+ch4 2.720e+00 3.650 07154.0 !6 md9d+ch3o=md9d2j+ch3oh 3.800e+10 0.000 02800.0 !6 md9d+ch3o2=md9d2j+ch3o2h 7.220e+03 2.550 10530.0 !6 md9d+c2h3=md9d2j+c2h4 4.000e+11 0.000 14300.0 !6 md9d+c2h5=md9d2j+c2h6 2.000E+11 0.000 07900.0 !6 ! md9d+h=md9d3j+h2 1.300e+06 2.400 04471.0 !6 md9d+ho2=md9d3j+h2o2 5.880e+04 2.500 14860.0 !6 md9d+oh=md9d3j+h2o 4.670e+07 1.610 -00035.0 !6 md9d+o2=md9d3j+ho2 4.000e+13 0.000 50160.0 !6 md9d+o=md9d3j+oh 5.946e+05 2.440 02846.0 !6 md9d+ch3=md9d3j+ch4 8.400e+04 2.130 07574.0 !6 md9d+ch3o=md9d3j+ch3oh 1.100e+11 0.000 05000.0 !6 md9d+ch3o2=md9d3j+ch3o2h 5.880e+04 2.500 14860.0 !6 md9d+c2h3=md9d3j+c2h4 4.000e+11 0.000 16800.0 !6 md9d+c2h5=md9d3j+c2h6 5.000e+10 0.000 10400.0 !6 ! md9d+h=md9d4j+h2 1.300e+06 2.400 04471.0 !6 md9d+ho2=md9d4j+h2o2 5.880e+04 2.500 14860.0 !6 md9d+oh=md9d4j+h2o 4.670e+07 1.610 -00035.0 !6 md9d+o2=md9d4j+ho2 4.000e+13 0.000 50160.0 !6 md9d+o=md9d4j+oh 5.946e+05 2.440 02846.0 !6 md9d+ch3=md9d4j+ch4 8.400e+04 2.130 07574.0 !6 md9d+ch3o=md9d4j+ch3oh 1.100e+11 0.000 05000.0 !6 md9d+ch3o2=md9d4j+ch3o2h 5.880e+04 2.500 14860.0 !6 md9d+c2h3=md9d4j+c2h4 4.000e+11 0.000 16800.0 !6 md9d+c2h5=md9d4j+c2h6 5.000e+10 0.000 10400.0 !6 ! md9d+h=md9d5j+h2 1.300e+06 2.400 04471.0 !6 md9d+ho2=md9d5j+h2o2 5.880e+04 2.500 14860.0 !6 md9d+oh=md9d5j+h2o 4.670e+07 1.610 -00035.0 !6 md9d+o2=md9d5j+ho2 4.000e+13 0.000 50160.0 !6 md9d+o=md9d5j+oh 5.946e+05 2.440 02846.0 !6 md9d+ch3=md9d5j+ch4 8.400e+04 2.130 07574.0 !6 md9d+ch3o=md9d5j+ch3oh 1.100e+11 0.000 05000.0 !6 md9d+ch3o2=md9d5j+ch3o2h 5.880e+04 2.500 14860.0 !6 md9d+c2h3=md9d5j+c2h4 4.000e+11 0.000 16800.0 !6 md9d+c2h5=md9d5j+c2h6 5.000e+10 0.000 10400.0 !6 ! md9d+h=md9d6j+h2 1.300e+06 2.400 04471.0 !6 md9d+ho2=md9d6j+h2o2 5.880e+04 2.500 14860.0 !6 md9d+oh=md9d6j+h2o 4.670e+07 1.610 -00035.0 !6 md9d+o2=md9d6j+ho2 4.000e+13 0.000 50160.0 !6 md9d+o=md9d6j+oh 5.946e+05 2.440 02846.0 !6 md9d+ch3=md9d6j+ch4 8.400e+04 2.130 07574.0 !6 md9d+ch3o=md9d6j+ch3oh 1.100e+11 0.000 05000.0 !6 md9d+ch3o2=md9d6j+ch3o2h 5.880e+04 2.500 14860.0 !6 md9d+c2h3=md9d6j+c2h4 4.000e+11 0.000 16800.0 !6 md9d+c2h5=md9d6j+c2h6 5.000e+10 0.000 10400.0 !6 ! md9d+h=md9d7j+h2 1.300e+06 2.400 04471.0 !6 md9d+ho2=md9d7j+h2o2 5.880e+04 2.500 14860.0 !6 md9d+oh=md9d7j+h2o 4.670e+07 1.610 -00035.0 !6 md9d+o2=md9d7j+ho2 4.000e+13 0.000 50160.0 !6 md9d+o=md9d7j+oh 5.946e+05 2.440 02846.0 !6 md9d+ch3=md9d7j+ch4 8.400e+04 2.130 07574.0 !6 md9d+ch3o=md9d7j+ch3oh 1.100e+11 0.000 05000.0 !6 md9d+ch3o2=md9d7j+ch3o2h 5.880e+04 2.500 14860.0 !6 md9d+c2h3=md9d7j+c2h4 4.000e+11 0.000 16800.0 !6 md9d+c2h5=md9d7j+c2h6 5.000e+10 0.000 10400.0 !6 ! !allylic H md9d+h=md9d8j+h2 3.376e+05 2.360 00207.0 !6 md9d+ho2=md9d8j+h2o2 4.820e+03 2.550 10530.0 !6 md9d+oh=md9d8j+h2o 2.764e+04 2.640 -01919.0 !6 md9d+o2=md9d8j+ho2 2.200e+12 0.000 37220.0 !6 md9d+o=md9d8j+oh 6.600e+05 2.430 01210.0 !6 md9d+ch3=md9d8j+ch4 3.690e+00 3.310 04002.0 !6 md9d+ch3o=md9d8j+ch3oh 4.000e+01 2.900 08609.0 !6 md9d+ch3o2=md9d8j+ch3o2h 4.820e+03 2.550 10530.0 !6 md9d+c2h3=md9d8j+c2h4 2.211E+00 3.500 04690.0 !6 md9d+c2h5=md9d8j+c2h6 1.000e+11 0.000 09800.0 !6 ! !vin H md9d+h=md9d10j+h2 8.040e+05 2.500 12280.0 !6 md9d+ho2=md9d10j+h2o2 7.500e+09 0.000 12570.0 !6 md9d+oh=md9d10j+h2o 2.110e+06 2.000 02778.0 !6 md9d+o2=md9d10j+ho2 2.000e+12 0.000 62900.0 !6 md9d+o=md9d10j+oh 1.200e+11 0.700 08959.0 !6 md9d+ch3=md9d10j+ch4 1.348e+00 3.500 12850.0 !6 !md9d+ch3o=md9d10j+ch3oh !6 md9d+ch3o2=md9d10j+ch3o2h 7.500e+09 0.000 12570.0 !6 md9d+c2h3=md9d10j+c2h4 1.387e+00 3.500 10870.0 !6 !md9d+c2h5=md9d10j+c2h6 !6 ! !vins H md9d+h=md9d9j+h2 4.050e+05 2.500 09794.0 !6 md9d+ho2=md9d9j+h2o2 3.000e+09 0.000 09930.0 !6 md9d+oh=md9d9j+h2o 1.110e+06 2.000 01451.0 !6 md9d+o2=md9d9j+ho2 1.400e+12 0.000 60700.0 !6 md9d+o=md9d9j+oh 6.030e+10 0.700 07632.0 !6 md9d+ch3=md9d9j+ch4 8.400e-01 3.500 11660.0 !6 !md9d+ch3o=md9d9j+ch3oh !6 md9d+ch3o2=md9d9j+ch3o2h 3.000e+09 0.000 09930.0 !6 md9d+c2h3=md9d9j+c2h4 8.401e-01 3.500 09680.0 !6 !md9d+c2h5=md9d9j+c2h6 !6 ! !primary H md8d+h=md8dmj+h2 9.400e+04 2.750 06280.0 !6 md8d+ho2=md8dmj+h2o2 4.050e+04 2.500 16690.0 !6 md8d+oh=md8dmj+h2o 5.270e+09 0.970 01590.0 !6 md8d+o2=md8dmj+ho2 6.000e+13 0.000 52800.0 !6 md8d+o=md8dmj+oh 1.046e+06 2.420 04766.0 !6 md8d+ch3=md8dmj+ch4 4.520e-01 3.650 07154.0 !6 md8d+ch3o=md8dmj+ch3oh 1.500e+10 0.000 07000.0 !6 md8d+ch3o2=md8dmj+ch3o2h 4.050e+04 2.500 16690.0 !6 md8d+c2h3=md8dmj+c2h4 5.000e+11 0.000 18000.0 !6 md8d+c2h5=md8dmj+c2h6 5.000e+10 0.000 13400.0 !6 ! !tertiary H assumed md8d+h=md8d2j+h2 3.620e+06 2.540 06756.0 !6 md8d+ho2=md8d2j+h2o2 7.220e+03 2.550 10530.0 !6 md8d+oh=md8d2j+h2o 1.146e+11 0.510 00063.0 !6 md8d+o2=md8d2j+ho2 4.080e+13 0.000 41350.0 !6 md8d+o=md8d2j+oh 3.936e+05 2.400 01150.0 !6 md8d+ch3=md8d2j+ch4 2.720e+00 3.650 07154.0 !6 md8d+ch3o=md8d2j+ch3oh 3.800e+10 0.000 02800.0 !6 md8d+ch3o2=md8d2j+ch3o2h 7.220e+03 2.550 10530.0 !6 md8d+c2h3=md8d2j+c2h4 4.000e+11 0.000 14300.0 !6 md8d+c2h5=md8d2j+c2h6 2.000E+11 0.000 07900.0 !6 ! md8d+h=md8d3j+h2 1.300e+06 2.400 04471.0 !6 md8d+ho2=md8d3j+h2o2 5.880e+04 2.500 14860.0 !6 md8d+oh=md8d3j+h2o 4.670e+07 1.610 -00035.0 !6 md8d+o2=md8d3j+ho2 4.000e+13 0.000 50160.0 !6 md8d+o=md8d3j+oh 5.946e+05 2.440 02846.0 !6 md8d+ch3=md8d3j+ch4 8.400e+04 2.130 07574.0 !6 md8d+ch3o=md8d3j+ch3oh 1.100e+11 0.000 05000.0 !6 md8d+ch3o2=md8d3j+ch3o2h 5.880e+04 2.500 14860.0 !6 md8d+c2h3=md8d3j+c2h4 4.000e+11 0.000 16800.0 !6 md8d+c2h5=md8d3j+c2h6 5.000e+10 0.000 10400.0 !6 ! md8d+h=md8d4j+h2 1.300e+06 2.400 04471.0 !6 md8d+ho2=md8d4j+h2o2 5.880e+04 2.500 14860.0 !6 md8d+oh=md8d4j+h2o 4.670e+07 1.610 -00035.0 !6 md8d+o2=md8d4j+ho2 4.000e+13 0.000 50160.0 !6 md8d+o=md8d4j+oh 5.946e+05 2.440 02846.0 !6 md8d+ch3=md8d4j+ch4 8.400e+04 2.130 07574.0 !6 md8d+ch3o=md8d4j+ch3oh 1.100e+11 0.000 05000.0 !6 md8d+ch3o2=md8d4j+ch3o2h 5.880e+04 2.500 14860.0 !6 md8d+c2h3=md8d4j+c2h4 4.000e+11 0.000 16800.0 !6 md8d+c2h5=md8d4j+c2h6 5.000e+10 0.000 10400.0 !6 ! md8d+h=md8d5j+h2 1.300e+06 2.400 04471.0 !6 md8d+ho2=md8d5j+h2o2 5.880e+04 2.500 14860.0 !6 md8d+oh=md8d5j+h2o 4.670e+07 1.610 -00035.0 !6 md8d+o2=md8d5j+ho2 4.000e+13 0.000 50160.0 !6 md8d+o=md8d5j+oh 5.946e+05 2.440 02846.0 !6 md8d+ch3=md8d5j+ch4 8.400e+04 2.130 07574.0 !6 md8d+ch3o=md8d5j+ch3oh 1.100e+11 0.000 05000.0 !6 md8d+ch3o2=md8d5j+ch3o2h 5.880e+04 2.500 14860.0 !6 md8d+c2h3=md8d5j+c2h4 4.000e+11 0.000 16800.0 !6 md8d+c2h5=md8d5j+c2h6 5.000e+10 0.000 10400.0 !6 ! md8d+h=md8d6j+h2 1.300e+06 2.400 04471.0 !6 md8d+ho2=md8d6j+h2o2 5.880e+04 2.500 14860.0 !6 md8d+oh=md8d6j+h2o 4.670e+07 1.610 -00035.0 !6 md8d+o2=md8d6j+ho2 4.000e+13 0.000 50160.0 !6 md8d+o=md8d6j+oh 5.946e+05 2.440 02846.0 !6 md8d+ch3=md8d6j+ch4 8.400e+04 2.130 07574.0 !6 md8d+ch3o=md8d6j+ch3oh 1.100e+11 0.000 05000.0 !6 md8d+ch3o2=md8d6j+ch3o2h 5.880e+04 2.500 14860.0 !6 md8d+c2h3=md8d6j+c2h4 4.000e+11 0.000 16800.0 !6 md8d+c2h5=md8d6j+c2h6 5.000e+10 0.000 10400.0 !6 ! !allylic H md8d+h=md8d7j+h2 3.376e+05 2.360 00207.0 !6 md8d+ho2=md8d7j+h2o2 4.820e+03 2.550 10530.0 !6 md8d+oh=md8d7j+h2o 2.764e+04 2.640 -01919.0 !6 md8d+o2=md8d7j+ho2 2.200e+12 0.000 37220.0 !6 md8d+o=md8d7j+oh 6.600e+05 2.430 01210.0 !6 md8d+ch3=md8d7j+ch4 3.690e+00 3.310 04002.0 !6 md8d+ch3o=md8d7j+ch3oh 4.000e+01 2.900 08609.0 !6 md8d+ch3o2=md8d7j+ch3o2h 4.820e+03 2.550 10530.0 !6 md8d+c2h3=md8d7j+c2h4 2.211E+00 3.500 04690.0 !6 md8d+c2h5=md8d7j+c2h6 1.000e+11 0.000 09800.0 !6 ! !vins H md8d+h=md8d8j+h2 4.050e+05 2.500 09794.0 !6 md8d+ho2=md8d8j+h2o2 3.000e+09 0.000 09930.0 !6 md8d+oh=md8d8j+h2o 1.110e+06 2.000 01451.0 !6 md8d+o2=md8d8j+ho2 1.400e+12 0.000 60700.0 !6 md8d+o=md8d8j+oh 6.030e+10 0.700 07632.0 !6 md8d+ch3=md8d8j+ch4 8.400e-01 3.500 11660.0 !6 !md8d+ch3o=md8d8j+ch3oh !6 md8d+ch3o2=md8d8j+ch3o2h 3.000e+09 0.000 09930.0 !6 md8d+c2h3=md8d8j+c2h4 8.401e-01 3.500 09680.0 !6 !md8d+c2h5=mp9d8j+c2h6 !6 ! !vins H md8d+h=md8d9j+h2 4.050e+05 2.500 09794.0 !6 md8d+ho2=md8d9j+h2o2 3.000e+09 0.000 09930.0 !6 md8d+oh=md8d9j+h2o 1.110e+06 2.000 01451.0 !6 md8d+o2=md8d9j+ho2 1.400e+12 0.000 60700.0 !6 md8d+o=md8d9j+oh 6.030e+10 0.700 07632.0 !6 md8d+ch3=md8d9j+ch4 8.400e-01 3.500 11660.0 !6 !md8d+ch3o=md8d9j+ch3oh !6 md8d+ch3o2=md8d9j+ch3o2h 3.000e+09 0.000 09930.0 !6 md8d+c2h3=md8d9j+c2h4 8.401e-01 3.500 09680.0 !6 !md8d+c2h5=mp9d9j+c2h6 !6 ! !allylic H md8d+h=md9d8j+h2 3.376e+05 2.360 00207.0 !6 md8d+ho2=md9d8j+h2o2 4.820e+03 2.550 10530.0 !6 md8d+oh=md9d8j+h2o 2.764e+04 2.640 -01919.0 !6 md8d+o2=md9d8j+ho2 2.200e+12 0.000 37220.0 !6 md8d+o=md9d8j+oh 6.600e+05 2.430 01210.0 !6 md8d+ch3=md9d8j+ch4 3.690e+00 3.310 04002.0 !6 md8d+ch3o=md9d8j+ch3oh 4.000e+01 2.900 08609.0 !6 md8d+ch3o2=md9d8j+ch3o2h 4.820e+03 2.550 10530.0 !6 md8d+c2h3=md9d8j+c2h4 2.211E+00 3.500 04690.0 !6 md8d+c2h5=md9d8j+c2h6 1.000e+11 0.000 09800.0 !6 ! !primary H md7d+h=md7dmj+h2 9.400e+04 2.750 06280.0 !6 md7d+ho2=md7dmj+h2o2 4.050e+04 2.500 16690.0 !6 md7d+oh=md7dmj+h2o 5.270e+09 0.970 01590.0 !6 md7d+o2=md7dmj+ho2 6.000e+13 0.000 52800.0 !6 md7d+o=md7dmj+oh 1.046e+06 2.420 04766.0 !6 md7d+ch3=md7dmj+ch4 4.520e-01 3.650 07154.0 !6 md7d+ch3o=md7dmj+ch3oh 1.500e+10 0.000 07000.0 !6 md7d+ch3o2=md7dmj+ch3o2h 4.050e+04 2.500 16690.0 !6 md7d+c2h3=md7dmj+c2h4 5.000e+11 0.000 18000.0 !6 md7d+c2h5=md7dmj+c2h6 5.000e+10 0.000 13400.0 !6 ! !tertiary H assumed md7d+h=md7d2j+h2 3.620e+06 2.540 06756.0 !6 md7d+ho2=md7d2j+h2o2 7.220e+03 2.550 10530.0 !6 md7d+oh=md7d2j+h2o 1.146e+11 0.510 00063.0 !6 md7d+o2=md7d2j+ho2 4.080e+13 0.000 41350.0 !6 md7d+o=md7d2j+oh 3.936e+05 2.400 01150.0 !6 md7d+ch3=md7d2j+ch4 2.720e+00 3.650 07154.0 !6 md7d+ch3o=md7d2j+ch3oh 3.800e+10 0.000 02800.0 !6 md7d+ch3o2=md7d2j+ch3o2h 7.220e+03 2.550 10530.0 !6 md7d+c2h3=md7d2j+c2h4 4.000e+11 0.000 14300.0 !6 md7d+c2h5=md7d2j+c2h6 2.000E+11 0.000 07900.0 !6 ! md7d+h=md7d3j+h2 1.300e+06 2.400 04471.0 !6 md7d+ho2=md7d3j+h2o2 5.880e+04 2.500 14860.0 !6 md7d+oh=md7d3j+h2o 4.670e+07 1.610 -00035.0 !6 md7d+o2=md7d3j+ho2 4.000e+13 0.000 50160.0 !6 md7d+o=md7d3j+oh 5.946e+05 2.440 02846.0 !6 md7d+ch3=md7d3j+ch4 8.400e+04 2.130 07574.0 !6 md7d+ch3o=md7d3j+ch3oh 1.100e+11 0.000 05000.0 !6 md7d+ch3o2=md7d3j+ch3o2h 5.880e+04 2.500 14860.0 !6 md7d+c2h3=md7d3j+c2h4 4.000e+11 0.000 16800.0 !6 md7d+c2h5=md7d3j+c2h6 5.000e+10 0.000 10400.0 !6 ! md7d+h=md7d4j+h2 1.300e+06 2.400 04471.0 !6 md7d+ho2=md7d4j+h2o2 5.880e+04 2.500 14860.0 !6 md7d+oh=md7d4j+h2o 4.670e+07 1.610 -00035.0 !6 md7d+o2=md7d4j+ho2 4.000e+13 0.000 50160.0 !6 md7d+o=md7d4j+oh 5.946e+05 2.440 02846.0 !6 md7d+ch3=md7d4j+ch4 8.400e+04 2.130 07574.0 !6 md7d+ch3o=md7d4j+ch3oh 1.100e+11 0.000 05000.0 !6 md7d+ch3o2=md7d4j+ch3o2h 5.880e+04 2.500 14860.0 !6 md7d+c2h3=md7d4j+c2h4 4.000e+11 0.000 16800.0 !6 md7d+c2h5=md7d4j+c2h6 5.000e+10 0.000 10400.0 !6 ! md7d+h=md7d5j+h2 1.300e+06 2.400 04471.0 !6 md7d+ho2=md7d5j+h2o2 5.880e+04 2.500 14860.0 !6 md7d+oh=md7d5j+h2o 4.670e+07 1.610 -00035.0 !6 md7d+o2=md7d5j+ho2 4.000e+13 0.000 50160.0 !6 md7d+o=md7d5j+oh 5.946e+05 2.440 02846.0 !6 md7d+ch3=md7d5j+ch4 8.400e+04 2.130 07574.0 !6 md7d+ch3o=md7d5j+ch3oh 1.100e+11 0.000 05000.0 !6 md7d+ch3o2=md7d5j+ch3o2h 5.880e+04 2.500 14860.0 !6 md7d+c2h3=md7d5j+c2h4 4.000e+11 0.000 16800.0 !6 md7d+c2h5=md7d5j+c2h6 5.000e+10 0.000 10400.0 !6 ! !allylic H md7d+h=md7d6j+h2 3.376e+05 2.360 00207.0 !6 md7d+ho2=md7d6j+h2o2 4.820e+03 2.550 10530.0 !6 md7d+oh=md7d6j+h2o 2.764e+04 2.640 -01919.0 !6 md7d+o2=md7d6j+ho2 2.200e+12 0.000 37220.0 !6 md7d+o=md7d6j+oh 6.600e+05 2.430 01210.0 !6 md7d+ch3=md7d6j+ch4 3.690e+00 3.310 04002.0 !6 md7d+ch3o=md7d6j+ch3oh 4.000e+01 2.900 08609.0 !6 md7d+ch3o2=md7d6j+ch3o2h 4.820e+03 2.550 10530.0 !6 md7d+c2h3=md7d6j+c2h4 2.211E+00 3.500 04690.0 !6 md7d+c2h5=md7d6j+c2h6 1.000e+11 0.000 09800.0 !6 ! !vins H md7d+h=md7d7j+h2 4.050e+05 2.500 09794.0 !6 md7d+ho2=md7d7j+h2o2 3.000e+09 0.000 09930.0 !6 md7d+oh=md7d7j+h2o 1.110e+06 2.000 01451.0 !6 md7d+o2=md7d7j+ho2 1.400e+12 0.000 60700.0 !6 md7d+o=md7d7j+oh 6.030e+10 0.700 07632.0 !6 md7d+ch3=md7d7j+ch4 8.400e-01 3.500 11660.0 !6 !md7d+ch3o=md7d7j+ch3oh !6 md7d+ch3o2=md7d7j+ch3o2h 3.000e+09 0.000 09930.0 !6 md7d+c2h3=md7d7j+c2h4 8.401e-01 3.500 09680.0 !6 !md7d+c2h5=mp9d7j+c2h6 !6 ! !vins H md7d+h=md7d8j+h2 4.050e+05 2.500 09794.0 !6 md7d+ho2=md7d8j+h2o2 3.000e+09 0.000 09930.0 !6 md7d+oh=md7d8j+h2o 1.110e+06 2.000 01451.0 !6 md7d+o2=md7d8j+ho2 1.400e+12 0.000 60700.0 !6 md7d+o=md7d8j+oh 6.030e+10 0.700 07632.0 !6 md7d+ch3=md7d8j+ch4 8.400e-01 3.500 11660.0 !6 !md7d+ch3o=md7d8j+ch3oh !6 md7d+ch3o2=md7d8j+ch3o2h 3.000e+09 0.000 09930.0 !6 md7d+c2h3=md7d8j+c2h4 8.401e-01 3.500 09680.0 !6 !md7d+c2h5=mp9d8j+c2h6 !6 ! !allylic H md7d+h=md8d7j+h2 3.376e+05 2.360 00207.0 !6 md7d+ho2=md8d7j+h2o2 4.820e+03 2.550 10530.0 !6 md7d+oh=md8d7j+h2o 2.764e+04 2.640 -01919.0 !6 md7d+o2=md8d7j+ho2 2.200e+12 0.000 37220.0 !6 md7d+o=md8d7j+oh 6.600e+05 2.430 01210.0 !6 md7d+ch3=md8d7j+ch4 3.690e+00 3.310 04002.0 !6 md7d+ch3o=md8d7j+ch3oh 4.000e+01 2.900 08609.0 !6 md7d+ch3o2=md8d7j+ch3o2h 4.820e+03 2.550 10530.0 !6 md7d+c2h3=md8d7j+c2h4 2.211E+00 3.500 04690.0 !6 md7d+c2h5=md8d7j+c2h6 1.000e+11 0.000 09800.0 !6 ! !primary H md7d+h=md7d10j+h2 9.400e+04 2.750 06280.0 !6 md7d+ho2=md7d10j+h2o2 4.050e+04 2.500 16690.0 !6 md7d+oh=md7d10j+h2o 5.270e+09 0.970 01590.0 !6 md7d+o2=md7d10j+ho2 6.000e+13 0.000 52800.0 !6 md7d+o=md7d10j+oh 1.046e+06 2.420 04766.0 !6 md7d+ch3=md7d10j+ch4 4.520e-01 3.650 07154.0 !6 md7d+ch3o=md7d10j+ch3oh 1.500e+10 0.000 07000.0 !6 md7d+ch3o2=md7d10j+ch3o2h 4.050e+04 2.500 16690.0 !6 md7d+c2h3=md7d10j+c2h4 5.000e+11 0.000 18000.0 !6 md7d+c2h5=md7d10j+c2h6 5.000e+10 0.000 13400.0 !6 ! !primary H md6d+h=md6dmj+h2 9.400e+04 2.750 06280.0 !6 md6d+ho2=md6dmj+h2o2 4.050e+04 2.500 16690.0 !6 md6d+oh=md6dmj+h2o 5.270e+09 0.970 01590.0 !6 md6d+o2=md6dmj+ho2 6.000e+13 0.000 52800.0 !6 md6d+o=md6dmj+oh 1.046e+06 2.420 04766.0 !6 md6d+ch3=md6dmj+ch4 4.520e-01 3.650 07154.0 !6 md6d+ch3o=md6dmj+ch3oh 1.500e+10 0.000 07000.0 !6 md6d+ch3o2=md6dmj+ch3o2h 4.050e+04 2.500 16690.0 !6 md6d+c2h3=md6dmj+c2h4 5.000e+11 0.000 18000.0 !6 md6d+c2h5=md6dmj+c2h6 5.000e+10 0.000 13400.0 !6 ! !tertiary H assumed md6d+h=md6d2j+h2 3.620e+06 2.540 06756.0 !6 md6d+ho2=md6d2j+h2o2 7.220e+03 2.550 10530.0 !6 md6d+oh=md6d2j+h2o 1.146e+11 0.510 00063.0 !6 md6d+o2=md6d2j+ho2 4.080e+13 0.000 41350.0 !6 md6d+o=md6d2j+oh 3.936e+05 2.400 01150.0 !6 md6d+ch3=md6d2j+ch4 2.720e+00 3.650 07154.0 !6 md6d+ch3o=md6d2j+ch3oh 3.800e+10 0.000 02800.0 !6 md6d+ch3o2=md6d2j+ch3o2h 7.220e+03 2.550 10530.0 !6 md6d+c2h3=md6d2j+c2h4 4.000e+11 0.000 14300.0 !6 md6d+c2h5=md6d2j+c2h6 2.000E+11 0.000 07900.0 !6 ! md6d+h=md6d3j+h2 1.300e+06 2.400 04471.0 !6 md6d+ho2=md6d3j+h2o2 5.880e+04 2.500 14860.0 !6 md6d+oh=md6d3j+h2o 4.670e+07 1.610 -00035.0 !6 md6d+o2=md6d3j+ho2 4.000e+13 0.000 50160.0 !6 md6d+o=md6d3j+oh 5.946e+05 2.440 02846.0 !6 md6d+ch3=md6d3j+ch4 8.400e+04 2.130 07574.0 !6 md6d+ch3o=md6d3j+ch3oh 1.100e+11 0.000 05000.0 !6 md6d+ch3o2=md6d3j+ch3o2h 5.880e+04 2.500 14860.0 !6 md6d+c2h3=md6d3j+c2h4 4.000e+11 0.000 16800.0 !6 md6d+c2h5=md6d3j+c2h6 5.000e+10 0.000 10400.0 !6 ! md6d+h=md6d4j+h2 1.300e+06 2.400 04471.0 !6 md6d+ho2=md6d4j+h2o2 5.880e+04 2.500 14860.0 !6 md6d+oh=md6d4j+h2o 4.670e+07 1.610 -00035.0 !6 md6d+o2=md6d4j+ho2 4.000e+13 0.000 50160.0 !6 md6d+o=md6d4j+oh 5.946e+05 2.440 02846.0 !6 md6d+ch3=md6d4j+ch4 8.400e+04 2.130 07574.0 !6 md6d+ch3o=md6d4j+ch3oh 1.100e+11 0.000 05000.0 !6 md6d+ch3o2=md6d4j+ch3o2h 5.880e+04 2.500 14860.0 !6 md6d+c2h3=md6d4j+c2h4 4.000e+11 0.000 16800.0 !6 md6d+c2h5=md6d4j+c2h6 5.000e+10 0.000 10400.0 !6 ! !allylic H md6d+h=md6d5j+h2 3.376e+05 2.360 00207.0 !6 md6d+ho2=md6d5j+h2o2 4.820e+03 2.550 10530.0 !6 md6d+oh=md6d5j+h2o 2.764e+04 2.640 -01919.0 !6 md6d+o2=md6d5j+ho2 2.200e+12 0.000 37220.0 !6 md6d+o=md6d5j+oh 6.600e+05 2.430 01210.0 !6 md6d+ch3=md6d5j+ch4 3.690e+00 3.310 04002.0 !6 md6d+ch3o=md6d5j+ch3oh 4.000e+01 2.900 08609.0 !6 md6d+ch3o2=md6d5j+ch3o2h 4.820e+03 2.550 10530.0 !6 md6d+c2h3=md6d5j+c2h4 2.211E+00 3.500 04690.0 !6 md6d+c2h5=md6d5j+c2h6 1.000e+11 0.000 09800.0 !6 ! !vins H md6d+h=md6d6j+h2 4.050e+05 2.500 09794.0 !6 md6d+ho2=md6d6j+h2o2 3.000e+09 0.000 09930.0 !6 md6d+oh=md6d6j+h2o 1.110e+06 2.000 01451.0 !6 md6d+o2=md6d6j+ho2 1.400e+12 0.000 60700.0 !6 md6d+o=md6d6j+oh 6.030e+10 0.700 07632.0 !6 md6d+ch3=md6d6j+ch4 8.400e-01 3.500 11660.0 !6 !md6d+ch3o=md6d6j+ch3oh !6 md6d+ch3o2=md6d6j+ch3o2h 3.000e+09 0.000 09930.0 !6 md6d+c2h3=md6d6j+c2h4 8.401e-01 3.500 09680.0 !6 !md6d+c2h5=md9d6j+c2h6 !6 ! !vins H md6d+h=md6d7j+h2 4.050e+05 2.500 09794.0 !6 md6d+ho2=md6d7j+h2o2 3.000e+09 0.000 09930.0 !6 md6d+oh=md6d7j+h2o 1.110e+06 2.000 01451.0 !6 md6d+o2=md6d7j+ho2 1.400e+12 0.000 60700.0 !6 md6d+o=md6d7j+oh 6.030e+10 0.700 07632.0 !6 md6d+ch3=md6d7j+ch4 8.400e-01 3.500 11660.0 !6 !md6d+ch3o=md6d7j+ch3oh !6 md6d+ch3o2=md6d7j+ch3o2h 3.000e+09 0.000 09930.0 !6 md6d+c2h3=md6d7j+c2h4 8.401e-01 3.500 09680.0 !6 !md6d+c2h5=md9d7j+c2h6 !6 ! !allylic H md6d+h=md7d6j+h2 3.376e+05 2.360 00207.0 !6 md6d+ho2=md7d6j+h2o2 4.820e+03 2.550 10530.0 !6 md6d+oh=md7d6j+h2o 2.764e+04 2.640 -01919.0 !6 md6d+o2=md7d6j+ho2 2.200e+12 0.000 37220.0 !6 md6d+o=md7d6j+oh 6.600e+05 2.430 01210.0 !6 md6d+ch3=md7d6j+ch4 3.690e+00 3.310 04002.0 !6 md6d+ch3o=md7d6j+ch3oh 4.000e+01 2.900 08609.0 !6 md6d+ch3o2=md7d6j+ch3o2h 4.820e+03 2.550 10530.0 !6 md6d+c2h3=md7d6j+c2h4 2.211E+00 3.500 04690.0 !6 md6d+c2h5=md7d6j+c2h6 1.000e+11 0.000 09800.0 !6 ! md6d+h=md6d9j+h2 1.300e+06 2.400 04471.0 !6 md6d+ho2=md6d9j+h2o2 5.880e+04 2.500 14860.0 !6 md6d+oh=md6d9j+h2o 4.670e+07 1.610 -00035.0 !6 md6d+o2=md6d9j+ho2 4.000e+13 0.000 50160.0 !6 md6d+o=md6d9j+oh 5.946e+05 2.440 02846.0 !6 md6d+ch3=md6d9j+ch4 8.400e+04 2.130 07574.0 !6 md6d+ch3o=md6d9j+ch3oh 1.100e+11 0.000 05000.0 !6 md6d+ch3o2=md6d9j+ch3o2h 5.880e+04 2.500 14860.0 !6 md6d+c2h3=md6d9j+c2h4 4.000e+11 0.000 16800.0 !6 md6d+c2h5=md6d9j+c2h6 5.000e+10 0.000 10400.0 !6 ! !primary H md6d+h=md6d10j+h2 9.400e+04 2.750 06280.0 !6 md6d+ho2=md6d10j+h2o2 4.050e+04 2.500 16690.0 !6 md6d+oh=md6d10j+h2o 5.270e+09 0.970 01590.0 !6 md6d+o2=md6d10j+ho2 6.000e+13 0.000 52800.0 !6 md6d+o=md6d10j+oh 1.046e+06 2.420 04766.0 !6 md6d+ch3=md6d10j+ch4 4.520e-01 3.650 07154.0 !6 md6d+ch3o=md6d10j+ch3oh 1.500e+10 0.000 07000.0 !6 md6d+ch3o2=md6d10j+ch3o2h 4.050e+04 2.500 16690.0 !6 md6d+c2h3=md6d10j+c2h4 5.000e+11 0.000 18000.0 !6 md6d+c2h5=md6d10j+c2h6 5.000e+10 0.000 13400.0 !6 ! !primary H md5d+h=md5dmj+h2 9.400e+04 2.750 06280.0 !6 md5d+ho2=md5dmj+h2o2 4.050e+04 2.500 16690.0 !6 md5d+oh=md5dmj+h2o 5.270e+09 0.970 01590.0 !6 md5d+o2=md5dmj+ho2 6.000e+13 0.000 52800.0 !6 md5d+o=md5dmj+oh 1.046e+06 2.420 04766.0 !6 md5d+ch3=md5dmj+ch4 4.520e-01 3.650 07154.0 !6 md5d+ch3o=md5dmj+ch3oh 1.500e+10 0.000 07000.0 !6 md5d+ch3o2=md5dmj+ch3o2h 4.050e+04 2.500 16690.0 !6 md5d+c2h3=md5dmj+c2h4 5.000e+11 0.000 18000.0 !6 md5d+c2h5=md5dmj+c2h6 5.000e+10 0.000 13400.0 !6 ! !tertiary H assumed md5d+h=md5d2j+h2 3.620e+06 2.540 06756.0 !6 md5d+ho2=md5d2j+h2o2 7.220e+03 2.550 10530.0 !6 md5d+oh=md5d2j+h2o 1.146e+11 0.510 00063.0 !6 md5d+o2=md5d2j+ho2 4.080e+13 0.000 41350.0 !6 md5d+o=md5d2j+oh 3.936e+05 2.400 01150.0 !6 md5d+ch3=md5d2j+ch4 2.720e+00 3.650 07154.0 !6 md5d+ch3o=md5d2j+ch3oh 3.800e+10 0.000 02800.0 !6 md5d+ch3o2=md5d2j+ch3o2h 7.220e+03 2.550 10530.0 !6 md5d+c2h3=md5d2j+c2h4 4.000e+11 0.000 14300.0 !6 md5d+c2h5=md5d2j+c2h6 2.000E+11 0.000 07900.0 !6 ! md5d+h=md5d3j+h2 1.300e+06 2.400 04471.0 !6 md5d+ho2=md5d3j+h2o2 5.880e+04 2.500 14860.0 !6 md5d+oh=md5d3j+h2o 4.670e+07 1.610 -00035.0 !6 md5d+o2=md5d3j+ho2 4.000e+13 0.000 50160.0 !6 md5d+o=md5d3j+oh 5.946e+05 2.440 02846.0 !6 md5d+ch3=md5d3j+ch4 8.400e+04 2.130 07574.0 !6 md5d+ch3o=md5d3j+ch3oh 1.100e+11 0.000 05000.0 !6 md5d+ch3o2=md5d3j+ch3o2h 5.880e+04 2.500 14860.0 !6 md5d+c2h3=md5d3j+c2h4 4.000e+11 0.000 16800.0 !6 md5d+c2h5=md5d3j+c2h6 5.000e+10 0.000 10400.0 !6 ! !allylic H md5d+h=md5d4j+h2 3.376e+05 2.360 00207.0 !6 md5d+ho2=md5d4j+h2o2 4.820e+03 2.550 10530.0 !6 md5d+oh=md5d4j+h2o 2.764e+04 2.640 -01919.0 !6 md5d+o2=md5d4j+ho2 2.200e+12 0.000 37220.0 !6 md5d+o=md5d4j+oh 6.600e+05 2.430 01210.0 !6 md5d+ch3=md5d4j+ch4 3.690e+00 3.310 04002.0 !6 md5d+ch3o=md5d4j+ch3oh 4.000e+01 2.900 08609.0 !6 md5d+ch3o2=md5d4j+ch3o2h 4.820e+03 2.550 10530.0 !6 md5d+c2h3=md5d4j+c2h4 2.211E+00 3.500 04690.0 !6 md5d+c2h5=md5d4j+c2h6 1.000e+11 0.000 09800.0 !6 ! !vins H md5d+h=md5d5j+h2 4.050e+05 2.500 09794.0 !6 md5d+ho2=md5d5j+h2o2 3.000e+09 0.000 09930.0 !6 md5d+oh=md5d5j+h2o 1.110e+06 2.000 01451.0 !6 md5d+o2=md5d5j+ho2 1.400e+12 0.000 60700.0 !6 md5d+o=md5d5j+oh 6.030e+10 0.700 07632.0 !6 md5d+ch3=md5d5j+ch4 8.400e-01 3.500 11660.0 !6 !md5d+ch3o=md5d5j+ch3oh !6 md5d+ch3o2=md5d5j+ch3o2h 3.000e+09 0.000 09930.0 !6 md5d+c2h3=md5d5j+c2h4 8.401e-01 3.500 09680.0 !6 !md5d+c2h5=md9d5j+c2h6 !6 ! !vins H md5d+h=md5d6j+h2 4.050e+05 2.500 09794.0 !6 md5d+ho2=md5d6j+h2o2 3.000e+09 0.000 09930.0 !6 md5d+oh=md5d6j+h2o 1.110e+06 2.000 01451.0 !6 md5d+o2=md5d6j+ho2 1.400e+12 0.000 60700.0 !6 md5d+o=md5d6j+oh 6.030e+10 0.700 07632.0 !6 md5d+ch3=md5d6j+ch4 8.400e-01 3.500 11660.0 !6 !md5d+ch3o=md5d6j+ch3oh !6 md5d+ch3o2=md5d6j+ch3o2h 3.000e+09 0.000 09930.0 !6 md5d+c2h3=md5d6j+c2h4 8.401e-01 3.500 09680.0 !6 !md5d+c2h5=md9d6j+c2h6 !6 ! !allylic H md5d+h=md6d5j+h2 3.376e+05 2.360 00207.0 !6 md5d+ho2=md6d5j+h2o2 4.820e+03 2.550 10530.0 !6 md5d+oh=md6d5j+h2o 2.764e+04 2.640 -01919.0 !6 md5d+o2=md6d5j+ho2 2.200e+12 0.000 37220.0 !6 md5d+o=md6d5j+oh 6.600e+05 2.430 01210.0 !6 md5d+ch3=md6d5j+ch4 3.690e+00 3.310 04002.0 !6 md5d+ch3o=md6d5j+ch3oh 4.000e+01 2.900 08609.0 !6 md5d+ch3o2=md6d5j+ch3o2h 4.820e+03 2.550 10530.0 !6 md5d+c2h3=md6d5j+c2h4 2.211E+00 3.500 04690.0 !6 md5d+c2h5=md6d5j+c2h6 1.000e+11 0.000 09800.0 !6 ! md5d+h=md5d8j+h2 1.300e+06 2.400 04471.0 !6 md5d+ho2=md5d8j+h2o2 5.880e+04 2.500 14860.0 !6 md5d+oh=md5d8j+h2o 4.670e+07 1.610 -00035.0 !6 md5d+o2=md5d8j+ho2 4.000e+13 0.000 50160.0 !6 md5d+o=md5d8j+oh 5.946e+05 2.440 02846.0 !6 md5d+ch3=md5d8j+ch4 8.400e+04 2.130 07574.0 !6 md5d+ch3o=md5d8j+ch3oh 1.100e+11 0.000 05000.0 !6 md5d+ch3o2=md5d8j+ch3o2h 5.880e+04 2.500 14860.0 !6 md5d+c2h3=md5d8j+c2h4 4.000e+11 0.000 16800.0 !6 md5d+c2h5=md5d8j+c2h6 5.000e+10 0.000 10400.0 !6 ! md5d+h=md5d9j+h2 1.300e+06 2.400 04471.0 !6 md5d+ho2=md5d9j+h2o2 5.880e+04 2.500 14860.0 !6 md5d+oh=md5d9j+h2o 4.670e+07 1.610 -00035.0 !6 md5d+o2=md5d9j+ho2 4.000e+13 0.000 50160.0 !6 md5d+o=md5d9j+oh 5.946e+05 2.440 02846.0 !6 md5d+ch3=md5d9j+ch4 8.400e+04 2.130 07574.0 !6 md5d+ch3o=md5d9j+ch3oh 1.100e+11 0.000 05000.0 !6 md5d+ch3o2=md5d9j+ch3o2h 5.880e+04 2.500 14860.0 !6 md5d+c2h3=md5d9j+c2h4 4.000e+11 0.000 16800.0 !6 md5d+c2h5=md5d9j+c2h6 5.000e+10 0.000 10400.0 !6 ! !primary H md5d+h=md5d10j+h2 9.400e+04 2.750 06280.0 !6 md5d+ho2=md5d10j+h2o2 4.050e+04 2.500 16690.0 !6 md5d+oh=md5d10j+h2o 5.270e+09 0.970 01590.0 !6 md5d+o2=md5d10j+ho2 6.000e+13 0.000 52800.0 !6 md5d+o=md5d10j+oh 1.046e+06 2.420 04766.0 !6 md5d+ch3=md5d10j+ch4 4.520e-01 3.650 07154.0 !6 md5d+ch3o=md5d10j+ch3oh 1.500e+10 0.000 07000.0 !6 md5d+ch3o2=md5d10j+ch3o2h 4.050e+04 2.500 16690.0 !6 md5d+c2h3=md5d10j+c2h4 5.000e+11 0.000 18000.0 !6 md5d+c2h5=md5d10j+c2h6 5.000e+10 0.000 13400.0 !6 ! !primary H md4d+h=md4dmj+h2 9.400e+04 2.750 06280.0 !6 md4d+ho2=md4dmj+h2o2 4.050e+04 2.500 16690.0 !6 md4d+oh=md4dmj+h2o 5.270e+09 0.970 01590.0 !6 md4d+o2=md4dmj+ho2 6.000e+13 0.000 52800.0 !6 md4d+o=md4dmj+oh 1.046e+06 2.420 04766.0 !6 md4d+ch3=md4dmj+ch4 4.520e-01 3.650 07154.0 !6 md4d+ch3o=md4dmj+ch3oh 1.500e+10 0.000 07000.0 !6 md4d+ch3o2=md4dmj+ch3o2h 4.050e+04 2.500 16690.0 !6 md4d+c2h3=md4dmj+c2h4 5.000e+11 0.000 18000.0 !6 md4d+c2h5=md4dmj+c2h6 5.000e+10 0.000 13400.0 !6 ! !tertiary H assumed md4d+h=md4d2j+h2 3.620e+06 2.540 06756.0 !6 md4d+ho2=md4d2j+h2o2 7.220e+03 2.550 10530.0 !6 md4d+oh=md4d2j+h2o 1.146e+11 0.510 00063.0 !6 md4d+o2=md4d2j+ho2 4.080e+13 0.000 41350.0 !6 md4d+o=md4d2j+oh 3.936e+05 2.400 01150.0 !6 md4d+ch3=md4d2j+ch4 2.720e+00 3.650 07154.0 !6 md4d+ch3o=md4d2j+ch3oh 3.800e+10 0.000 02800.0 !6 md4d+ch3o2=md4d2j+ch3o2h 7.220e+03 2.550 10530.0 !6 md4d+c2h3=md4d2j+c2h4 4.000e+11 0.000 14300.0 !6 md4d+c2h5=md4d2j+c2h6 2.000E+11 0.000 07900.0 !6 ! !allylic H md4d+h=md4d3j+h2 3.376e+05 2.360 00207.0 !6 md4d+ho2=md4d3j+h2o2 4.820e+03 2.550 10530.0 !6 md4d+oh=md4d3j+h2o 2.764e+04 2.640 -01919.0 !6 md4d+o2=md4d3j+ho2 2.200e+12 0.000 37220.0 !6 md4d+o=md4d3j+oh 6.600e+05 2.430 01210.0 !6 md4d+ch3=md4d3j+ch4 3.690e+00 3.310 04002.0 !6 md4d+ch3o=md4d3j+ch3oh 4.000e+01 2.900 08609.0 !6 md4d+ch3o2=md4d3j+ch3o2h 4.820e+03 2.550 10530.0 !6 md4d+c2h3=md4d3j+c2h4 2.211E+00 3.500 04690.0 !6 md4d+c2h5=md4d3j+c2h6 1.000e+11 0.000 09800.0 !6 ! !vins H md4d+h=md4d4j+h2 4.050e+05 2.500 09794.0 !6 md4d+ho2=md4d4j+h2o2 3.000e+09 0.000 09930.0 !6 md4d+oh=md4d4j+h2o 1.110e+06 2.000 01451.0 !6 md4d+o2=md4d4j+ho2 1.400e+12 0.000 60700.0 !6 md4d+o=md4d4j+oh 6.030e+10 0.700 07632.0 !6 md4d+ch3=md4d4j+ch4 8.400e-01 3.500 11660.0 !6 !md4d+ch3o=md4d4j+ch3oh !6 md4d+ch3o2=md4d4j+ch3o2h 3.000e+09 0.000 09930.0 !6 md4d+c2h3=md4d4j+c2h4 8.401e-01 3.500 09680.0 !6 !md4d+c2h5=md9d4j+c2h6 !6 ! !vins H md4d+h=md4d5j+h2 4.050e+05 2.500 09794.0 !6 md4d+ho2=md4d5j+h2o2 3.000e+09 0.000 09930.0 !6 md4d+oh=md4d5j+h2o 1.110e+06 2.000 01451.0 !6 md4d+o2=md4d5j+ho2 1.400e+12 0.000 60700.0 !6 md4d+o=md4d5j+oh 6.030e+10 0.700 07632.0 !6 md4d+ch3=md4d5j+ch4 8.400e-01 3.500 11660.0 !6 !md4d+ch3o=md4d5j+ch3oh !6 md4d+ch3o2=md4d5j+ch3o2h 3.000e+09 0.000 09930.0 !6 md4d+c2h3=md4d5j+c2h4 8.401e-01 3.500 09680.0 !6 !md4d+c2h5=md9d5j+c2h6 !6 ! !allylic H md4d+h=md5d4j+h2 3.376e+05 2.360 00207.0 !6 md4d+ho2=md5d4j+h2o2 4.820e+03 2.550 10530.0 !6 md4d+oh=md5d4j+h2o 2.764e+04 2.640 -01919.0 !6 md4d+o2=md5d4j+ho2 2.200e+12 0.000 37220.0 !6 md4d+o=md5d4j+oh 6.600e+05 2.430 01210.0 !6 md4d+ch3=md5d4j+ch4 3.690e+00 3.310 04002.0 !6 md4d+ch3o=md5d4j+ch3oh 4.000e+01 2.900 08609.0 !6 md4d+ch3o2=md5d4j+ch3o2h 4.820e+03 2.550 10530.0 !6 md4d+c2h3=md5d4j+c2h4 2.211E+00 3.500 04690.0 !6 md4d+c2h5=md5d4j+c2h6 1.000e+11 0.000 09800.0 !6 ! md4d+h=md4d7j+h2 1.300e+06 2.400 04471.0 !6 md4d+ho2=md4d7j+h2o2 5.880e+04 2.500 14860.0 !6 md4d+oh=md4d7j+h2o 4.670e+07 1.610 -00035.0 !6 md4d+o2=md4d7j+ho2 4.000e+13 0.000 50160.0 !6 md4d+o=md4d7j+oh 5.946e+05 2.440 02846.0 !6 md4d+ch3=md4d7j+ch4 8.400e+04 2.130 07574.0 !6 md4d+ch3o=md4d7j+ch3oh 1.100e+11 0.000 05000.0 !6 md4d+ch3o2=md4d7j+ch3o2h 5.880e+04 2.500 14860.0 !6 md4d+c2h3=md4d7j+c2h4 4.000e+11 0.000 16800.0 !6 md4d+c2h5=md4d7j+c2h6 5.000e+10 0.000 10400.0 !6 ! md4d+h=md4d8j+h2 1.300e+06 2.400 04471.0 !6 md4d+ho2=md4d8j+h2o2 5.880e+04 2.500 14860.0 !6 md4d+oh=md4d8j+h2o 4.670e+07 1.610 -00035.0 !6 md4d+o2=md4d8j+ho2 4.000e+13 0.000 50160.0 !6 md4d+o=md4d8j+oh 5.946e+05 2.440 02846.0 !6 md4d+ch3=md4d8j+ch4 8.400e+04 2.130 07574.0 !6 md4d+ch3o=md4d8j+ch3oh 1.100e+11 0.000 05000.0 !6 md4d+ch3o2=md4d8j+ch3o2h 5.880e+04 2.500 14860.0 !6 md4d+c2h3=md4d8j+c2h4 4.000e+11 0.000 16800.0 !6 md4d+c2h5=md4d8j+c2h6 5.000e+10 0.000 10400.0 !6 ! md4d+h=md4d9j+h2 1.300e+06 2.400 04471.0 !6 md4d+ho2=md4d9j+h2o2 5.880e+04 2.500 14860.0 !6 md4d+oh=md4d9j+h2o 4.670e+07 1.610 -00035.0 !6 md4d+o2=md4d9j+ho2 4.000e+13 0.000 50160.0 !6 md4d+o=md4d9j+oh 5.946e+05 2.440 02846.0 !6 md4d+ch3=md4d9j+ch4 8.400e+04 2.130 07574.0 !6 md4d+ch3o=md4d9j+ch3oh 1.100e+11 0.000 05000.0 !6 md4d+ch3o2=md4d9j+ch3o2h 5.880e+04 2.500 14860.0 !6 md4d+c2h3=md4d9j+c2h4 4.000e+11 0.000 16800.0 !6 md4d+c2h5=md4d9j+c2h6 5.000e+10 0.000 10400.0 !6 ! !primary H md4d+h=md4d10j+h2 9.400e+04 2.750 06280.0 !6 md4d+ho2=md4d10j+h2o2 4.050e+04 2.500 16690.0 !6 md4d+oh=md4d10j+h2o 5.270e+09 0.970 01590.0 !6 md4d+o2=md4d10j+ho2 6.000e+13 0.000 52800.0 !6 md4d+o=md4d10j+oh 1.046e+06 2.420 04766.0 !6 md4d+ch3=md4d10j+ch4 4.520e-01 3.650 07154.0 !6 md4d+ch3o=md4d10j+ch3oh 1.500e+10 0.000 07000.0 !6 md4d+ch3o2=md4d10j+ch3o2h 4.050e+04 2.500 16690.0 !6 md4d+c2h3=md4d10j+c2h4 5.000e+11 0.000 18000.0 !6 md4d+c2h5=md4d10j+c2h6 5.000e+10 0.000 13400.0 !6 ! !primary H md3d+h=md3dmj+h2 9.400e+04 2.750 06280.0 !6 md3d+ho2=md3dmj+h2o2 4.050e+04 2.500 16690.0 !6 md3d+oh=md3dmj+h2o 5.270e+09 0.970 01590.0 !6 md3d+o2=md3dmj+ho2 6.000e+13 0.000 52800.0 !6 md3d+o=md3dmj+oh 1.046e+06 2.420 04766.0 !6 md3d+ch3=md3dmj+ch4 4.520e-01 3.650 07154.0 !6 md3d+ch3o=md3dmj+ch3oh 1.500e+10 0.000 07000.0 !6 md3d+ch3o2=md3dmj+ch3o2h 4.050e+04 2.500 16690.0 !6 md3d+c2h3=md3dmj+c2h4 5.000e+11 0.000 18000.0 !6 md3d+c2h5=md3dmj+c2h6 5.000e+10 0.000 13400.0 !6 ! !tertiary H assumed md3d+h=md3d2j+h2 3.620e+06 2.540 06756.0 !6 md3d+ho2=md3d2j+h2o2 7.220e+03 2.550 10530.0 !6 md3d+oh=md3d2j+h2o 1.146e+11 0.510 00063.0 !6 md3d+o2=md3d2j+ho2 4.080e+13 0.000 41350.0 !6 md3d+o=md3d2j+oh 3.936e+05 2.400 01150.0 !6 md3d+ch3=md3d2j+ch4 2.720e+00 3.650 07154.0 !6 md3d+ch3o=md3d2j+ch3oh 3.800e+10 0.000 02800.0 !6 md3d+ch3o2=md3d2j+ch3o2h 7.220e+03 2.550 10530.0 !6 md3d+c2h3=md3d2j+c2h4 4.000e+11 0.000 14300.0 !6 md3d+c2h5=md3d2j+c2h6 2.000E+11 0.000 07900.0 !6 ! !vins H md3d+h=md3d3j+h2 4.050e+05 2.500 09794.0 !6 md3d+ho2=md3d3j+h2o2 3.000e+09 0.000 09930.0 !6 md3d+oh=md3d3j+h2o 1.110e+06 2.000 01451.0 !6 md3d+o2=md3d3j+ho2 1.400e+12 0.000 60700.0 !6 md3d+o=md3d3j+oh 6.030e+10 0.700 07632.0 !6 md3d+ch3=md3d3j+ch4 8.400e-01 3.500 11660.0 !6 !md3d+ch3o=md3d3j+ch3oh !6 md3d+ch3o2=md3d3j+ch3o2h 3.000e+09 0.000 09930.0 !6 md3d+c2h3=md3d3j+c2h4 8.401e-01 3.500 09680.0 !6 !md3d+c2h5=md9d3j+c2h6 !6 ! !vins H md3d+h=md3d4j+h2 4.050e+05 2.500 09794.0 !6 md3d+ho2=md3d4j+h2o2 3.000e+09 0.000 09930.0 !6 md3d+oh=md3d4j+h2o 1.110e+06 2.000 01451.0 !6 md3d+o2=md3d4j+ho2 1.400e+12 0.000 60700.0 !6 md3d+o=md3d4j+oh 6.030e+10 0.700 07632.0 !6 md3d+ch3=md3d4j+ch4 8.400e-01 3.500 11660.0 !6 !md3d+ch3o=md3d4j+ch3oh !6 md3d+ch3o2=md3d4j+ch3o2h 3.000e+09 0.000 09930.0 !6 md3d+c2h3=md3d4j+c2h4 8.401e-01 3.500 09680.0 !6 !md3d+c2h5=md9d4j+c2h6 !6 ! !allylic H md3d+h=md4d3j+h2 3.376e+05 2.360 00207.0 !6 md3d+ho2=md4d3j+h2o2 4.820e+03 2.550 10530.0 !6 md3d+oh=md4d3j+h2o 2.764e+04 2.640 -01919.0 !6 md3d+o2=md4d3j+ho2 2.200e+12 0.000 37220.0 !6 md3d+o=md4d3j+oh 6.600e+05 2.430 01210.0 !6 md3d+ch3=md4d3j+ch4 3.690e+00 3.310 04002.0 !6 md3d+ch3o=md4d3j+ch3oh 4.000e+01 2.900 08609.0 !6 md3d+ch3o2=md4d3j+ch3o2h 4.820e+03 2.550 10530.0 !6 md3d+c2h3=md4d3j+c2h4 2.211E+00 3.500 04690.0 !6 md3d+c2h5=md4d3j+c2h6 1.000e+11 0.000 09800.0 !6 ! md3d+h=md3d6j+h2 1.300e+06 2.400 04471.0 !6 md3d+ho2=md3d6j+h2o2 5.880e+04 2.500 14860.0 !6 md3d+oh=md3d6j+h2o 4.670e+07 1.610 -00035.0 !6 md3d+o2=md3d6j+ho2 4.000e+13 0.000 50160.0 !6 md3d+o=md3d6j+oh 5.946e+05 2.440 02846.0 !6 md3d+ch3=md3d6j+ch4 8.400e+04 2.130 07574.0 !6 md3d+ch3o=md3d6j+ch3oh 1.100e+11 0.000 05000.0 !6 md3d+ch3o2=md3d6j+ch3o2h 5.880e+04 2.500 14860.0 !6 md3d+c2h3=md3d6j+c2h4 4.000e+11 0.000 16800.0 !6 md3d+c2h5=md3d6j+c2h6 5.000e+10 0.000 10400.0 !6 ! md3d+h=md3d7j+h2 1.300e+06 2.400 04471.0 !6 md3d+ho2=md3d7j+h2o2 5.880e+04 2.500 14860.0 !6 md3d+oh=md3d7j+h2o 4.670e+07 1.610 -00035.0 !6 md3d+o2=md3d7j+ho2 4.000e+13 0.000 50160.0 !6 md3d+o=md3d7j+oh 5.946e+05 2.440 02846.0 !6 md3d+ch3=md3d7j+ch4 8.400e+04 2.130 07574.0 !6 md3d+ch3o=md3d7j+ch3oh 1.100e+11 0.000 05000.0 !6 md3d+ch3o2=md3d7j+ch3o2h 5.880e+04 2.500 14860.0 !6 md3d+c2h3=md3d7j+c2h4 4.000e+11 0.000 16800.0 !6 md3d+c2h5=md3d7j+c2h6 5.000e+10 0.000 10400.0 !6 ! md3d+h=md3d8j+h2 1.300e+06 2.400 04471.0 !6 md3d+ho2=md3d8j+h2o2 5.880e+04 2.500 14860.0 !6 md3d+oh=md3d8j+h2o 4.670e+07 1.610 -00035.0 !6 md3d+o2=md3d8j+ho2 4.000e+13 0.000 50160.0 !6 md3d+o=md3d8j+oh 5.946e+05 2.440 02846.0 !6 md3d+ch3=md3d8j+ch4 8.400e+04 2.130 07574.0 !6 md3d+ch3o=md3d8j+ch3oh 1.100e+11 0.000 05000.0 !6 md3d+ch3o2=md3d8j+ch3o2h 5.880e+04 2.500 14860.0 !6 md3d+c2h3=md3d8j+c2h4 4.000e+11 0.000 16800.0 !6 md3d+c2h5=md3d8j+c2h6 5.000e+10 0.000 10400.0 !6 ! md3d+h=md3d9j+h2 1.300e+06 2.400 04471.0 !6 md3d+ho2=md3d9j+h2o2 5.880e+04 2.500 14860.0 !6 md3d+oh=md3d9j+h2o 4.670e+07 1.610 -00035.0 !6 md3d+o2=md3d9j+ho2 4.000e+13 0.000 50160.0 !6 md3d+o=md3d9j+oh 5.946e+05 2.440 02846.0 !6 md3d+ch3=md3d9j+ch4 8.400e+04 2.130 07574.0 !6 md3d+ch3o=md3d9j+ch3oh 1.100e+11 0.000 05000.0 !6 md3d+ch3o2=md3d9j+ch3o2h 5.880e+04 2.500 14860.0 !6 md3d+c2h3=md3d9j+c2h4 4.000e+11 0.000 16800.0 !6 md3d+c2h5=md3d9j+c2h6 5.000e+10 0.000 10400.0 !6 ! !primary H md3d+h=md3d10j+h2 9.400e+04 2.750 06280.0 !6 md3d+ho2=md3d10j+h2o2 4.050e+04 2.500 16690.0 !6 md3d+oh=md3d10j+h2o 5.270e+09 0.970 01590.0 !6 md3d+o2=md3d10j+ho2 6.000e+13 0.000 52800.0 !6 md3d+o=md3d10j+oh 1.046e+06 2.420 04766.0 !6 md3d+ch3=md3d10j+ch4 4.520e-01 3.650 07154.0 !6 md3d+ch3o=md3d10j+ch3oh 1.500e+10 0.000 07000.0 !6 md3d+ch3o2=md3d10j+ch3o2h 4.050e+04 2.500 16690.0 !6 md3d+c2h3=md3d10j+c2h4 5.000e+11 0.000 18000.0 !6 md3d+c2h5=md3d10j+c2h6 5.000e+10 0.000 13400.0 !6 ! !primary H md2d+h=md2dmj+h2 9.400e+04 2.750 06280.0 !6 md2d+ho2=md2dmj+h2o2 4.050e+04 2.500 16690.0 !6 md2d+oh=md2dmj+h2o 5.270e+09 0.970 01590.0 !6 md2d+o2=md2dmj+ho2 6.000e+13 0.000 52800.0 !6 md2d+o=md2dmj+oh 1.046e+06 2.420 04766.0 !6 md2d+ch3=md2dmj+ch4 4.520e-01 3.650 07154.0 !6 md2d+ch3o=md2dmj+ch3oh 1.500e+10 0.000 07000.0 !6 md2d+ch3o2=md2dmj+ch3o2h 4.050e+04 2.500 16690.0 !6 md2d+c2h3=md2dmj+c2h4 5.000e+11 0.000 18000.0 !6 md2d+c2h5=md2dmj+c2h6 5.000e+10 0.000 13400.0 !6 ! !vins H md2d+h=md2d2j+h2 4.050e+05 2.500 09794.0 !6 md2d+ho2=md2d2j+h2o2 3.000e+09 0.000 09930.0 !6 md2d+oh=md2d2j+h2o 1.110e+06 2.000 01451.0 !6 md2d+o2=md2d2j+ho2 1.400e+12 0.000 60700.0 !6 md2d+o=md2d2j+oh 6.030e+10 0.700 07632.0 !6 md2d+ch3=md2d2j+ch4 8.400e-01 3.500 11660.0 !6 !md2d+ch3o=md2d2j+ch3oh !6 md2d+ch3o2=md2d2j+ch3o2h 3.000e+09 0.000 09930.0 !6 md2d+c2h3=md2d2j+c2h4 8.401e-01 3.500 09680.0 !6 !md2d+c2h5=md9d2j+c2h6 !6 ! !vins H md2d+h=md2d3j+h2 4.050e+05 2.500 09794.0 !6 md2d+ho2=md2d3j+h2o2 3.000e+09 0.000 09930.0 !6 md2d+oh=md2d3j+h2o 1.110e+06 2.000 01451.0 !6 md2d+o2=md2d3j+ho2 1.400e+12 0.000 60700.0 !6 md2d+o=md2d3j+oh 6.030e+10 0.700 07632.0 !6 md2d+ch3=md2d3j+ch4 8.400e-01 3.500 11660.0 !6 !md2d+ch3o=md2d3j+ch3oh !6 md2d+ch3o2=md2d3j+ch3o2h 3.000e+09 0.000 09930.0 !6 md2d+c2h3=md2d3j+c2h4 8.401e-01 3.500 09680.0 !6 !md2d+c2h5=md9d3j+c2h6 !6 ! !allylic H md2d+h=md3d2j+h2 3.376e+05 2.360 00207.0 !6 md2d+ho2=md3d2j+h2o2 4.820e+03 2.550 10530.0 !6 md2d+oh=md3d2j+h2o 2.764e+04 2.640 -01919.0 !6 md2d+o2=md3d2j+ho2 2.200e+12 0.000 37220.0 !6 md2d+o=md3d2j+oh 6.600e+05 2.430 01210.0 !6 md2d+ch3=md3d2j+ch4 3.690e+00 3.310 04002.0 !6 md2d+ch3o=md3d2j+ch3oh 4.000e+01 2.900 08609.0 !6 md2d+ch3o2=md3d2j+ch3o2h 4.820e+03 2.550 10530.0 !6 md2d+c2h3=md3d2j+c2h4 2.211E+00 3.500 04690.0 !6 md2d+c2h5=md3d2j+c2h6 1.000e+11 0.000 09800.0 !6 ! md2d+h=md2d5j+h2 1.300e+06 2.400 04471.0 !6 md2d+ho2=md2d5j+h2o2 5.880e+04 2.500 14860.0 !6 md2d+oh=md2d5j+h2o 4.670e+07 1.610 -00035.0 !6 md2d+o2=md2d5j+ho2 4.000e+13 0.000 50160.0 !6 md2d+o=md2d5j+oh 5.946e+05 2.440 02846.0 !6 md2d+ch3=md2d5j+ch4 8.400e+04 2.130 07574.0 !6 md2d+ch3o=md2d5j+ch3oh 1.100e+11 0.000 05000.0 !6 md2d+ch3o2=md2d5j+ch3o2h 5.880e+04 2.500 14860.0 !6 md2d+c2h3=md2d5j+c2h4 4.000e+11 0.000 16800.0 !6 md2d+c2h5=md2d5j+c2h6 5.000e+10 0.000 10400.0 !6 ! md2d+h=md2d6j+h2 1.300e+06 2.400 04471.0 !6 md2d+ho2=md2d6j+h2o2 5.880e+04 2.500 14860.0 !6 md2d+oh=md2d6j+h2o 4.670e+07 1.610 -00035.0 !6 md2d+o2=md2d6j+ho2 4.000e+13 0.000 50160.0 !6 md2d+o=md2d6j+oh 5.946e+05 2.440 02846.0 !6 md2d+ch3=md2d6j+ch4 8.400e+04 2.130 07574.0 !6 md2d+ch3o=md2d6j+ch3oh 1.100e+11 0.000 05000.0 !6 md2d+ch3o2=md2d6j+ch3o2h 5.880e+04 2.500 14860.0 !6 md2d+c2h3=md2d6j+c2h4 4.000e+11 0.000 16800.0 !6 md2d+c2h5=md2d6j+c2h6 5.000e+10 0.000 10400.0 !6 ! md2d+h=md2d7j+h2 1.300e+06 2.400 04471.0 !6 md2d+ho2=md2d7j+h2o2 5.880e+04 2.500 14860.0 !6 md2d+oh=md2d7j+h2o 4.670e+07 1.610 -00035.0 !6 md2d+o2=md2d7j+ho2 4.000e+13 0.000 50160.0 !6 md2d+o=md2d7j+oh 5.946e+05 2.440 02846.0 !6 md2d+ch3=md2d7j+ch4 8.400e+04 2.130 07574.0 !6 md2d+ch3o=md2d7j+ch3oh 1.100e+11 0.000 05000.0 !6 md2d+ch3o2=md2d7j+ch3o2h 5.880e+04 2.500 14860.0 !6 md2d+c2h3=md2d7j+c2h4 4.000e+11 0.000 16800.0 !6 md2d+c2h5=md2d7j+c2h6 5.000e+10 0.000 10400.0 !6 ! md2d+h=md2d8j+h2 1.300e+06 2.400 04471.0 !6 md2d+ho2=md2d8j+h2o2 5.880e+04 2.500 14860.0 !6 md2d+oh=md2d8j+h2o 4.670e+07 1.610 -00035.0 !6 md2d+o2=md2d8j+ho2 4.000e+13 0.000 50160.0 !6 md2d+o=md2d8j+oh 5.946e+05 2.440 02846.0 !6 md2d+ch3=md2d8j+ch4 8.400e+04 2.130 07574.0 !6 md2d+ch3o=md2d8j+ch3oh 1.100e+11 0.000 05000.0 !6 md2d+ch3o2=md2d8j+ch3o2h 5.880e+04 2.500 14860.0 !6 md2d+c2h3=md2d8j+c2h4 4.000e+11 0.000 16800.0 !6 md2d+c2h5=md2d8j+c2h6 5.000e+10 0.000 10400.0 !6 ! md2d+h=md2d9j+h2 1.300e+06 2.400 04471.0 !6 md2d+ho2=md2d9j+h2o2 5.880e+04 2.500 14860.0 !6 md2d+oh=md2d9j+h2o 4.670e+07 1.610 -00035.0 !6 md2d+o2=md2d9j+ho2 4.000e+13 0.000 50160.0 !6 md2d+o=md2d9j+oh 5.946e+05 2.440 02846.0 !6 md2d+ch3=md2d9j+ch4 8.400e+04 2.130 07574.0 !6 md2d+ch3o=md2d9j+ch3oh 1.100e+11 0.000 05000.0 !6 md2d+ch3o2=md2d9j+ch3o2h 5.880e+04 2.500 14860.0 !6 md2d+c2h3=md2d9j+c2h4 4.000e+11 0.000 16800.0 !6 md2d+c2h5=md2d9j+c2h6 5.000e+10 0.000 10400.0 !6 ! !primary H md2d+h=md2d10j+h2 9.400e+04 2.750 06280.0 !6 md2d+ho2=md2d10j+h2o2 4.050e+04 2.500 16690.0 !6 md2d+oh=md2d10j+h2o 5.270e+09 0.970 01590.0 !6 md2d+o2=md2d10j+ho2 6.000e+13 0.000 52800.0 !6 md2d+o=md2d10j+oh 1.046e+06 2.420 04766.0 !6 md2d+ch3=md2d10j+ch4 4.520e-01 3.650 07154.0 !6 md2d+ch3o=md2d10j+ch3oh 1.500e+10 0.000 07000.0 !6 md2d+ch3o2=md2d10j+ch3o2h 4.050e+04 2.500 16690.0 !6 md2d+c2h3=md2d10j+c2h4 5.000e+11 0.000 18000.0 !6 md2d+c2h5=md2d10j+c2h6 5.000e+10 0.000 13400.0 !6 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 7/additions to olefins and unsaturated esters ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! !addition of ch3 to olefins c9h18-1+ch3=c10h21-3 3.216e+28 -5.500 14750.0 !7 based on c3h6+ch3=ic4h9 in All_huge_v1a.mech c9h18-1+ch3=c9h181ch32 3.216e+28 -5.500 14750.0 !7 based on c3h6+ch3=ic4h9 in All_huge_v1a.mech c8h16-1+ch3=c8h161ch32 3.216e+28 -5.500 14750.0 !7 based on c3h6+ch3=ic4h9 in All_huge_v1a.mech c7h14-1+ch3=c7h141ch32 3.216e+28 -5.500 14750.0 !7 based on c3h6+ch3=ic4h9 in All_huge_v1a.mech c6h12-1+ch3=c6h121ch32 3.216e+28 -5.500 14750.0 !7 based on c3h6+ch3=ic4h9 in All_huge_v1a.mech c5h10-1+ch3=c5h101ch32 3.216e+28 -5.500 14750.0 !7 based on c3h6+ch3=ic4h9 in All_huge_v1a.mech c4h8-1+ch3=c4h81ch32 3.216e+28 -5.500 14750.0 !7 based on c3h6+ch3=ic4h9 in All_huge_v1a.mech c3h6+ch3=ic4h9 3.216e+28 -5.500 14750.0 !7 based on c3h6+ch3=ic4h9 in All_huge_v1a.mech ! !additions of oh to olefins c9h18-1+oh=c9h18oh2j1 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 c9h18-1+oh=c9h18oh1j2 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 c8h16-1+oh=c8h16oh2j1 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 c8h16-1+oh=c8h16oh1j2 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 !c7h14-1+oh=c7h14oh2j1 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 !c7h14-1+oh=c7h14oh1j2 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 !c6h12-1+oh=c6h12oh2j1 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 !c6h12-1+oh=c6h12oh1j2 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 !c5h10-1+oh=c5h10oh2j1 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 !c5h10-1+oh=c5h10oh1j2 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 !c4h8-1+oh=c4h8oh2j1 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 !c4h8-1+oh=c4h8oh1j2 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 c3h6+oh=c3h6oh2j1 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 c3h6+oh=c3h6oh1j2 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 ! !additions of oh to unsaturated esters mp2d+oh=mp2joh3 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 mp2d+oh=mp3joh2 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 mb3d+oh=mb3joh4 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 mb3d+oh=mb4joh3 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 mf4d+oh=mf4joh5 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 mf4d+oh=mf5joh4 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 mh5d+oh=mh5joh6 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 mh5d+oh=mh6joh5 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 ms6d+oh=ms6joh7 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 ms6d+oh=ms7joh6 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 mo7d+oh=mo7joh8 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 mo7d+oh=mo8joh7 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 mn8d+oh=mn8joh9 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 mn8d+oh=mn9joh8 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 md9d+oh=md9joh10 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 md9d+oh=md10joh9 1.129e+05 2.280 -1241.0 !7 Zhu et al., 2005 c2h4+oh A/2 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 8/alkenyl and unsaturated ester radicals decomposition and isomerization ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! !Decompositions ! c2h2+c7h15-1=c9h17-11 8.800e+03 2.480 06130.0 !8 h+c9h16-1=c9h17-11 2.500e+11 0.510 02620.0 !8 c3h4-a+c6h13-1=c9h17-12 8.800e+03 2.480 06130.0 !8 h+c9h16-1=c9h17-12 2.500e+11 0.510 02620.0 !8 h+c9h16-12=c9h17-12 2.500e+11 0.510 02620.0 !8 h+c9h16-13=c9h17-13 2.500e+11 0.510 02620.0 !8 c5h11-1+c4h6=c9h17-13 1.760e+04 2.480 06130.0 !8 A*2 h+c9h16-13=c9h17-14 2.500e+11 0.510 02620.0 !8 h+c9h16-14=c9h17-14 2.500e+11 0.510 02620.0 !8 c2h3+c7h14-1=c9h17-14 2.000E+11 0.000 02007.0 !8 Weissman et Benson, 1984 pc4h9+c5h8-14=c9h17-14 8.800e+03 2.480 06130.0 !8 h+c9h16-14=c9h17-15 2.500e+11 0.510 02620.0 !8 h+c9h16-15=c9h17-15 2.500e+11 0.510 02620.0 !8 c9h17-15=c3h5-a+c6h12-1 3.310e+13 0.000 21460.0 !8 gierczak et al., 1986 nc3h7+c6h10-15=c9h17-15 8.800e+03 2.480 06130.0 !8 h+c9h16-15=c9h17-16 2.500e+11 0.510 02620.0 !8 h+c9h16-16=c9h17-16 2.500e+11 0.510 02620.0 !8 c4h7-14+c5h10-1=c9h17-16 8.800e+03 2.480 06130.0 !8 c2h5+c7h12-16=c9h17-16 8.800e+03 2.480 06130.0 !8 h+c9h16-16=c9h17-17 2.500e+11 0.510 02620.0 !8 h+c9h16-17=c9h17-17 2.500e+11 0.510 02620.0 !8 c5h9-15+c4h8-1=c9h17-17 8.800e+03 2.480 06130.0 !8 ch3+c8h14-17=c9h17-17 8.800e+03 2.480 06130.0 !8 h+c9h16-17=c9h17-18 2.500e+11 0.510 02620.0 !8 h+c9h16-18=c9h17-18 4.240e+11 0.510 01230.0 !8 c6h11-16+c3h6=c9h17-18 8.800e+03 2.480 06130.0 !8 h+c9h16-18=c9h17-19 5.000e+11 0.510 02620.0 !8 A*2 c7h13-17+c2h4=c9h17-19 8.800e+03 2.480 06130.0 !8 ! c2h2+c6h13-1=c8h15-11 8.800e+03 2.480 06130.0 !8 h+c8h14-1=c8h15-11 2.500e+11 0.510 02620.0 !8 c3h4-a+c5h11-1=c8h15-12 8.800e+03 2.480 06130.0 !8 h+c8h14-1=c8h15-12 2.500e+11 0.510 02620.0 !8 h+c8h14-12=c8h15-12 2.500e+11 0.510 02620.0 !8 h+c8h14-13=c8h15-13 2.500e+11 0.510 02620.0 !8 pc4h9+c4h6=c8h15-13 1.760e+04 2.480 06130.0 !8 A*2 h+c8h14-13=c8h15-14 2.500e+11 0.510 02620.0 !8 h+c8h14-14=c8h15-14 2.500e+11 0.510 02620.0 !8 c2h3+c6h12-1=c8h15-14 2.000E+11 0.000 02007.0 !8 Weissman et Benson, 1984 nc3h7+c5h8-14=c8h15-14 8.800e+03 2.480 06130.0 !8 h+c8h14-14=c8h15-15 2.500e+11 0.510 02620.0 !8 h+c8h14-15=c8h15-15 2.500e+11 0.510 02620.0 !8 c8h15-15=c3h5-a+c5h10-1 3.310e+13 0.000 21460.0 !8 gierczak et al., 1986 c2h5+c6h10-15=c8h15-15 8.800e+03 2.480 06130.0 !8 h+c8h14-15=c8h15-16 2.500e+11 0.510 02620.0 !8 h+c8h14-16=c8h15-16 2.500e+11 0.510 02620.0 !8 c4h7-14+c4h8-1=c8h15-16 8.800e+03 2.480 06130.0 !8 ch3+c7h12-16=c8h15-16 8.800e+03 2.480 06130.0 !8 h+c8h14-16=c8h15-17 2.500e+11 0.510 02620.0 !8 h+c8h14-17=c8h15-17 4.240e+11 0.510 01230.0 !8 c5h9-15+c3h6=c8h15-17 8.800e+03 2.480 06130.0 !8 h+c8h14-17=c8h15-18 5.000e+11 0.510 02620.0 !8 A*2 c6h11-16+c2h4=c8h15-18 8.800e+03 2.480 06130.0 !8 ! !c2h2+c5h11-1=c7h13-11 8.800e+03 2.480 06130.0 !8 !h+c7h12-1=c7h13-11 2.500e+11 0.510 02620.0 !8 !c3h4-a+pc4h9=c7h13-12 8.800e+03 2.480 06130.0 !8 !h+c7h12-1=c7h13-12 2.500e+11 0.510 02620.0 !8 !h+c7h12-12=c7h13-12 2.500e+11 0.510 02620.0 !8 !h+c7h12-13=c7h13-13 2.500e+11 0.510 02620.0 !8 !nc3h7+c4h6=c7h13-13 1.760e+04 2.480 06130.0 !8 A*2 !h+c7h12-13=c7h13-14 2.500e+11 0.510 02620.0 !8 !h+c7h12-14=c7h13-14 2.500e+11 0.510 02620.0 !8 !c2h3+c5h10-1=c7h13-14 2.000E+11 0.000 02007.0 !8 Weissman et Benson, 1984 !c2h5+c5h8-14=c7h13-14 8.800e+03 2.480 06130.0 !8 !h+c7h12-14=c7h13-15 2.500e+11 0.510 02620.0 !8 !h+c7h12-15=c7h13-15 2.500e+11 0.510 02620.0 !8 !c7h13-15=c3h5-a+c4h8-1 3.310e+13 0.000 21460.0 !8 gierczak et al., 1986 !ch3+c6h10-15=c7h13-15 8.800e+03 2.480 06130.0 !8 !h+c7h12-15=c7h13-16 2.500e+11 0.510 02620.0 !8 !h+c7h12-16=c7h13-16 4.240e+11 0.510 01230.0 !8 !c4h7-14+c3h6=c7h13-16 8.800e+03 2.480 06130.0 !8 !h+c7h12-16=c7h13-17 5.000e+11 0.510 02620.0 !8 A*2 !c5h9-15+c2h4=c7h13-17 8.800e+03 2.480 06130.0 !8 ! !c2h2+pc4h9=c6h11-11 8.800e+03 2.480 06130.0 !8 !h+c6h10-1=c6h11-11 2.500e+11 0.510 02620.0 !8 !c3h4-a+nc3h7=c6h11-12 8.800e+03 2.480 06130.0 !8 !h+c6h10-1=c6h11-12 2.500e+11 0.510 02620.0 !8 !h+c6h10-12=c6h11-12 2.500e+11 0.510 02620.0 !8 !h+c6h10-13=c6h11-13 2.500e+11 0.510 02620.0 !8 !c2h5+c4h6=c6h11-13 1.760e+04 2.480 06130.0 !8 A*2 !h+c6h10-13=c6h11-14 2.500e+11 0.510 02620.0 !8 !h+c6h10-14=c6h11-14 2.500e+11 0.510 02620.0 !8 !c2h3+c4h8-1=c6h11-14 2.000E+11 0.000 02007.0 !8 Weissman et Benson, 1984 !ch3+c5h8-14=c6h11-14 8.800e+03 2.480 06130.0 !8 !h+c6h10-14=c6h11-15 2.500e+11 0.510 02620.0 !8 !h+c6h10-15=c6h11-15 4.240e+11 0.510 01230.0 !8 !c6h11-15=c3h5-a+c3h6 3.310e+13 0.000 21460.0 !8 gierczak et al., 1986 !h+c6h10-15=c6h11-16 5.000e+11 0.510 02620.0 !8 A*2 !c2h4+c4h7-14=c6h11-16 8.800e+03 2.480 06130.0 !8 ! !c2h2+nc3h7=c5h9-11 8.800e+03 2.480 06130.0 !8 !h+c5h8-1=c5h9-11 2.500e+11 0.510 02620.0 !8 !c3h4-a+c2h5=c5h9-12 8.800e+03 2.480 06130.0 !8 !h+c5h8-1=c5h9-12 2.500e+11 0.510 02620.0 !8 !h+c5h8-12=c5h9-12 2.500e+11 0.510 02620.0 !8 !h+c5h8-13=c5h9-13 2.500e+11 0.510 02620.0 !8 !ch3+c4h6=c5h9-13 3.580e+04 2.480 06130.0 !8 A*2 !h+c5h8-13=c5h9-14 2.500e+11 0.510 02620.0 !8 !h+c5h8-14=c5h9-14 4.240e+11 0.510 01230.0 !8 !c2h3+c3h6=c5h9-14 2.000E+11 0.000 02007.0 !8 Weissman et Benson, 1984 !h+c5h8-14=c5h9-15 5.000e+11 0.510 02620.0 !8 A*2 !c5h9-15=c2h4+c3h5-a 3.310e+13 0.000 21460.0 !8 gierczak et al., 1986 ! !c2h2+c2h5=c4h7-11 8.800e+03 2.480 06130.0 !8 !h+c4h6-1=c4h7-11 2.500e+11 0.510 02620.0 !8 !c3h4-a+ch3=c4h7-12 8.800e+03 2.480 06130.0 !8 !h+c4h6-12=c4h7-12 2.500e+11 0.510 02620.0 !8 !h+c4h6-1=c4h7-12 2.500e+11 0.510 02620.0 !8 !h+c4h6=c4h7-13 4.240e+11 0.510 01230.0 !8 !h+c4h6=c4h7-14 2.500e+11 0.510 02620.0 !8 !c2h3+c2h4=c4h7-14 2.000E+11 0.000 02007.0 !8 Weissman et Benson, 1984 ! ! !Isomerizations ! !c4h7-14=c4h7-13 3.560e+10 0.880 31500.0 !8 Matheu et al., 2003 1,2 h-shift s->a ! !c5h9-14=c5h9-13 3.560e+10 0.880 31500.0 !8 Matheu et al., 2003 1,2 h-shift s->a !c5h9-15=c5h9-13 3.800e+10 0.670 30600.0 !8 1,3 h-shift s->a correlation from 1,2 h-shift s->s & s->a !c5h9-15=c5h9-14 3.560e+10 0.880 37300.0 !8 Matheu et al., 2003 1,2 h-shift p->s ! !c6h11-14=c6h11-13 3.560e+10 0.880 31500.0 !8 Matheu et al., 2003 1,2 h-shift s->a !c6h11-15=c6h11-13 3.800e+10 0.670 30600.0 !8 1,3 h-shift s->a correlation from 1,2 h-shift s->s & s->a !c6h11-16=c6h11-13 7.850e+11 -0.120 15900.0 !8 1,4 h-shift s->a correlation from 1,2 h-shift s->s & s->a !c6h11-14=c6h11-15 3.560e+10 0.880 39100.0 !8 Matheu et al., 2003 1,2 h-shift s->s !c6h11-16=c6h11-14 3.800e+10 0.670 36600.0 !8 Matheu et al., 2003 1,3 h-shift p->s !c6h11-16=c6h11-15 3.560e+10 0.880 37300.0 !8 Matheu et al., 2003 1,2 h-shift p->s ! !c7h13-14=c7h13-13 3.560e+10 0.880 31500.0 !8 Matheu et al., 2003 1,2 h-shift s->a !c7h13-15=c7h13-13 3.800e+10 0.670 30600.0 !8 1,3 h-shift s->a correlation from 1,2 h-shift s->s & s->a !c7h13-16=c7h13-13 7.850e+11 -0.120 15900.0 !8 1,4 h-shift s->a correlation from 1,2 h-shift s->s & s->a !c7h13-17=c7h13-13 3.670e+12 -0.600 04900.0 !8 1,5 h-shift p->a correlation from 1,2 h-shift p->s & p->a !c7h13-14=c7h13-15 3.560e+10 0.880 39100.0 !8 Matheu et al., 2003 1,2 h-shift s->s !c7h13-14=c7h13-16 3.800e+10 0.670 38200.0 !8 Matheu et al., 2003 1,3 h-shift s->s !c7h13-17=c7h13-14 7.850e+11 -0.120 20600.0 !8 Matheu et al., 2003 1,4 h-shift p->s !c7h13-15=c7h13-16 3.560e+10 0.880 39100.0 !8 Matheu et al., 2003 1,2 h-shift s->s !c7h13-17=c7h13-15 3.800e+10 0.670 36600.0 !8 Matheu et al., 2003 1,3 h-shift p->s !c7h13-17=c7h13-16 3.560e+10 0.880 37300.0 !8 Matheu et al., 2003 1,2 h-shift p->s ! c8h15-14=c8h15-13 3.560e+10 0.880 31500.0 !8 Matheu et al., 2003 1,2 h-shift s->a c8h15-15=c8h15-13 3.800e+10 0.670 30600.0 !8 1,3 h-shift s->a correlation from 1,2 h-shift s->s & s->a c8h15-16=c8h15-13 7.850e+11 -0.120 15900.0 !8 1,4 h-shift s->a correlation from 1,2 h-shift s->s & s->a c8h15-17=c8h15-13 3.670e+12 -0.600 07100.0 !8 1,5 h-shift s->a correlation from 1,2 h-shift s->s & s->a c8h15-14=c8h15-15 3.560e+10 0.880 39100.0 !8 Matheu et al., 2003 1,2 h-shift s->s c8h15-14=c8h15-16 3.800e+10 0.670 38200.0 !8 Matheu et al., 2003 1,3 h-shift s->s c8h15-14=c8h15-17 7.850e+11 -0.120 23500.0 !8 Matheu et al., 2003 1,4 h-shift s->s c8h15-18=c8h15-14 1.830e+02 2.550 10960.0 !8 tsang, 2006 1,5 h-shift p->s (hexenyl radical) c8h15-15=c8h15-16 3.560e+10 0.880 39100.0 !8 Matheu et al., 2003 1,2 h-shift s->s c8h15-15=c8h15-17 3.800e+10 0.670 38200.0 !8 Matheu et al., 2003 1,3 h-shift s->s c8h15-18=c8h15-15 7.850e+11 -0.120 20600.0 !8 Matheu et al., 2003 1,4 h-shift p->s c8h15-16=c8h15-17 3.560e+10 0.880 39100.0 !8 Matheu et al., 2003 1,2 h-shift s->s c8h15-18=c8h15-16 3.800e+10 0.670 36600.0 !8 Matheu et al., 2003 1,3 h-shift p->s c8h15-18=c8h15-17 3.560e+10 0.880 37300.0 !8 Matheu et al., 2003 1,2 h-shift p->s ! c9h17-14=c9h17-13 3.560e+10 0.880 31500.0 !8 Matheu et al., 2003 1,2 h-shift s->a c9h17-15=c9h17-13 3.800e+10 0.670 30600.0 !8 1,3 h-shift s->a correlation from 1,2 h-shift s->s & s->a c9h17-16=c9h17-13 7.850e+11 -0.120 15900.0 !8 1,4 h-shift s->a correlation from 1,2 h-shift s->s & s->a c9h17-17=c9h17-13 3.670e+12 -0.600 07100.0 !8 1,5 h-shift s->a correlation from 1,2 h-shift s->s & s->a c9h17-14=c9h17-15 3.560e+10 0.880 39100.0 !8 Matheu et al., 2003 1,2 h-shift s->s c9h17-14=c9h17-16 3.800e+10 0.670 38200.0 !8 Matheu et al., 2003 1,3 h-shift s->s c9h17-14=c9h17-17 7.850e+11 -0.120 23500.0 !8 Matheu et al., 2003 1,4 h-shift s->s c9h17-14=c9h17-18 3.670e+12 -0.600 14700.0 !8 1,5 h-shift s->s correlation from 1,4 h-shift s->s & p->p c9h17-15=c9h17-16 3.560e+10 0.880 39100.0 !8 Matheu et al., 2003 1,2 h-shift s->s c9h17-15=c9h17-17 3.800e+10 0.670 38200.0 !8 Matheu et al., 2003 1,3 h-shift s->s c9h17-15=c9h17-18 7.850e+11 -0.120 23500.0 !8 Matheu et al., 2003 1,4 h-shift s->s c9h17-19=c9h17-15 1.830e+02 2.550 10960.0 !8 tsang, 2006 1,5 h-shift p->s (hexenyl radical) c9h17-16=c9h17-17 3.560e+10 0.880 39100.0 !8 Matheu et al., 2003 1,2 h-shift s->s c9h17-16=c9h17-18 3.800e+10 0.670 38200.0 !8 Matheu et al., 2003 1,3 h-shift s->s c9h17-19=c9h17-16 7.850e+11 -0.120 20600.0 !8 Matheu et al., 2003 1,4 h-shift p->s c9h17-17=c9h17-18 3.560e+10 0.880 39100.0 !8 Matheu et al., 2003 1,2 h-shift s->s c9h17-19=c9h17-17 3.800e+10 0.670 36600.0 !8 Matheu et al., 2003 1,3 h-shift p->s c9h17-19=c9h17-18 3.560e+10 0.880 37300.0 !8 Matheu et al., 2003 1,2 h-shift p->s ! ! !08b/Unsaturated ester radicals !Decompositions ! ch2o+c2h3co=mp2dmj 1.259e+11 0.000 07595.0 !8 henry, 2003 ch3+ch2=o ch3o+ch2cco=mp2d2j 5.000e+11 0.000 -01000.0 !8 from mb mechanism h+mp2t=mp2d2j 2.500e+11 0.510 02620.0 !8 c2h2+ch3oco=mp2d3j 1.055e+11 0.000 07350.0 !8 from mb mechanism h+mp2t=mp2d3j 2.500e+11 0.510 02620.0 !8 ! ch2o+c3h5co=mb3dmj 1.259e+11 0.000 07595.0 !8 henry, 2003 ch3+ch2=o ch3o+c2h3chco=mb3d2j 5.000e+11 0.000 -01000.0 !8 from mb mechanism c3h4-a+ch3oco=mb3d3j 1.055e+11 0.000 07350.0 !8 from mb mechanism h+mb3t=mb3d3j 2.500e+11 0.510 02620.0 !8 c2h2+me2j=mb3d4j 8.800e+03 2.480 06130.0 !8 h+mb3t=mb3d4j 2.500e+11 0.510 02620.0 !8 ! h+mf24d=mf2d5j 2.500e+11 0.510 02620.0 !8 c2h4+mp2d3j=mf2d5j 8.800e+03 2.480 06130.0 !8 ! ch2o+c4h7co=mf4dmj 1.259e+11 0.000 07595.0 !8 henry, 2003 ch3+ch2=o ch3o+c3h5chco=mf4d2j 5.000e+11 0.000 -01000.0 !8 from mb mechanism c2h3+mp2d=mf4d2j 2.000E+11 0.000 02007.0 !8 Weissman et Benson, 1984 h+mf24d=mf4d2j 2.500e+11 0.510 02620.0 !8 c4h6+ch3oco=mf4d3j 1.055e+11 0.000 07350.0 !8 from mb mechanism h+mf24d=mf4d3j 2.500e+11 0.510 02620.0 !8 c3h4-a+me2j=mf4d4j 8.800e+03 2.480 06130.0 !8 h+mf4t=mf4d4j 2.500e+11 0.510 02620.0 !8 c2h2+mp3j=mf4d5j 8.800e+03 2.480 06130.0 !8 h+mf4t=mf4d5j 2.500e+11 0.510 02620.0 !8 ! h+mh25d=mh2d6j 2.500e+11 0.510 02620.0 !8 c2h4+mb3d2j=mh2d6j 8.800e+03 2.480 06130.0 !8 ! h+mh35d=mh3d6j 2.500e+11 0.510 02620.0 !8 c2h4+mb3d3j=mh3d6j 8.800e+03 2.480 06130.0 !8 ! ch2o+c5h9co=mh5dmj 1.259e+11 0.000 07595.0 !8 henry, 2003 ch3+ch2=o ch3o+c4h7chco=mh5d2j 5.000e+11 0.000 -01000.0 !8 from mb mechanism mh5d2j=c3h5-a+mp2d 3.310e+13 0.000 21460.0 !8 gierczak et al., 1986 ch3oco+c5h8-14=mh5d3j 1.055e+11 0.000 07350.0 !8 from mb mechanism c2h3+mb3d=mh5d3j 2.000E+11 0.000 02007.0 !8 Weissman et Benson, 1984 h+mh35d=mh5d3j 2.500e+11 0.510 02620.0 !8 c4h6+me2j=mh5d4j 8.800e+03 2.480 06130.0 !8 h+mh35d=mh5d4j 2.500e+11 0.510 02620.0 !8 c3h4-a+mp3j=mh5d5j 8.800e+03 2.480 06130.0 !8 h+mh5t=mh5d5j 2.500e+11 0.510 02620.0 !8 c2h2+mb4j=mh5d6j 8.800e+03 2.480 06130.0 !8 h+mh5t=mh5d6j 2.500e+11 0.510 02620.0 !8 ! h+ms26d=ms2d7j 2.500e+11 0.510 02620.0 !8 c2h4+mf2d5j=ms2d7j 8.800e+03 2.480 06130.0 !8 ! h+ms36d=ms3d7j 2.500e+11 0.510 02620.0 !8 c2h4+mf4d3j=ms3d7j 8.800e+03 2.480 06130.0 !8 ! h+ms36d=ms4d7j 2.500e+11 0.510 02620.0 !8 c2h4+mf4d5j=ms4d7j 8.800e+03 2.480 06130.0 !8 ! ch2o+c6h11co=ms6dmj 1.259e+11 0.000 07595.0 !8 henry, 2003 ch3+ch2=o ch3o+c5h9chco=ms6d2j 5.000e+11 0.000 -01000.0 !8 from mb mechanism c4h7-14+mp2d=ms6d2j 1.000e+11 0.000 07600.0 !8 from mb mechanism (ch3+mp2d) ch3oco+c6h10-15=ms6d3j 1.055e+11 0.000 07350.0 !8 from mb mechanism ms6d3j=c3h5-a+mb3d 3.310e+13 0.000 21460.0 !8 gierczak et al., 1986 c2h3+mf4d=ms6d4j 2.000E+11 0.000 02007.0 !8 Weissman et Benson, 1984 c5h8-14+me2j=ms6d4j 2.000e+11 0.000 07600.0 !8 from mb mechanism h+ms46d=ms6d4j 2.500e+11 0.510 02620.0 !8 c4h6+mp3j=ms6d5j 8.800e+03 2.480 06130.0 !8 h+ms46d=ms6d5j 2.500e+11 0.510 02620.0 !8 c3h4-a+mb4j=ms6d6j 8.800e+03 2.480 06130.0 !8 h+ms6t=ms6d6j 2.500e+11 0.510 02620.0 !8 c2h2+mf5j=ms6d7j 8.800e+03 2.480 06130.0 !8 h+ms6t=ms6d7j 2.500e+11 0.510 02620.0 !8 ! h+mo27d=mo2d8j 2.500e+11 0.510 02620.0 !8 c2h4+mh2d6j=mo2d8j 8.800e+03 2.480 06130.0 !8 ! h+mo37d=mo3d8j 2.500e+11 0.510 02620.0 !8 c2h4+mh3d6j=mo3d8j 8.800e+03 2.480 06130.0 !8 ! h+mo47d=mo4d8j 2.500e+11 0.510 02620.0 !8 c2h4+mh5d4j=mo4d8j 8.800e+03 2.480 06130.0 !8 ! h+mo57d=mo5d8j 2.500e+11 0.510 02620.0 !8 c2h4+mh5d6j=mo5d8j 8.800e+03 2.480 06130.0 !8 ! ch2o+c7h13co=mo7dmj 1.259e+11 0.000 07595.0 !8 henry, 2003 ch3+ch2=o ch3o+c6h11chco=mo7d2j 5.000e+11 0.000 -01000.0 !8 from mb mechanism c5h9-15+mp2d=mo7d2j 1.000e+11 0.000 07600.0 !8 from mb mechanism (ch3+mp2d) ch3oco+c7h12-16=mo7d3j 1.055e+11 0.000 07350.0 !8 from mb mechanism c4h7-14+mb3d=mo7d3j 8.800e+03 2.480 06130.0 !8 mo7d4j=c3h5-a+mf4d 3.310e+13 0.000 21460.0 !8 gierczak et al., 1986 c6h10-15+me2j=mo7d4j 2.000e+11 0.000 07600.0 !8 from mb mechanism c2h3+mh5d=mo7d5j 2.000E+11 0.000 02007.0 !8 Weissman et Benson, 1984 c5h8-14+mp3j=mo7d5j 8.800e+03 2.480 06130.0 !8 h+mo57d=mo7d5j 2.500e+11 0.510 02620.0 !8 c4h6+mb4j=mo7d6j 8.800e+03 2.480 06130.0 !8 h+mo57d=mo7d6j 2.500e+11 0.510 02620.0 !8 c3h4-a+mf5j=mo7d7j 8.800e+03 2.480 06130.0 !8 h+mo7t=mo7d7j 2.500e+11 0.510 02620.0 !8 c2h2+mh6j=mo7d8j 8.800e+03 2.480 06130.0 !8 h+mo7t=mo7d8j 2.500e+11 0.510 02620.0 !8 ! ch2o+c8h15co=mn8dmj 1.259e+11 0.000 07595.0 !8 henry, 2003 ch3+ch2=o ch3o+c7h13chco=mn8d2j 5.000e+11 0.000 -01000.0 !8 from mb mechanism c6h11-16+mp2d=mn8d2j 1.000e+11 0.000 07600.0 !8 from mb mechanism (ch3+mp2d) ch3oco+c8h14-17=mn8d3j 1.055e+11 0.000 07350.0 !8 from mb mechanism c5h9-15+mb3d=mn8d3j 8.800e+03 2.480 06130.0 !8 c7h12-16+me2j=mn8d4j 2.000e+11 0.000 07600.0 !8 from mb mechanism c4h7-14+mf4d=mn8d4j 8.800e+03 2.480 06130.0 !8 c6h10-15+mp3j=mn8d5j 8.800e+03 2.480 06130.0 !8 mn8d5j=c3h5-a+mh5d 3.310e+13 0.000 21460.0 !8 gierczak et al., 1986 c2h3+ms6d=mn8d6j 2.000E+11 0.000 02007.0 !8 Weissman et Benson, 1984 c5h8-14+mb4j=mn8d6j 8.800e+03 2.480 06130.0 !8 h+mn68d=mn8d6j 2.500e+11 0.510 02620.0 !8 c4h6+mf5j=mn8d7j 8.800e+03 2.480 06130.0 !8 h+mn68d=mn8d7j 2.500e+11 0.510 02620.0 !8 c3h4-a+mh6j=mn8d8j 8.800e+03 2.480 06130.0 !8 h+mn8t=mn8d8j 2.500e+11 0.510 02620.0 !8 c2h2+ms7j=mn8d9j 8.800e+03 2.480 06130.0 !8 h+mn8t=mn8d9j 2.500e+11 0.510 02620.0 !8 ! ch2o+c9h17co=md9dmj 1.259e+11 0.000 07595.0 !8 henry, 2003 ch3+ch2=o ch3o+c8h15chco=md9d2j 5.000e+11 0.000 -01000.0 !8 from mb mechanism c7h13-17+mp2d=md9d2j 1.000e+11 0.000 07600.0 !8 from mb mechanism (ch3+mp2d) ch3oco+c9h16-18=md9d3j 1.055e+11 0.000 07350.0 !8 from mb mechanism c6h11-16+mb3d=md9d3j 8.800e+03 2.480 06130.0 !8 c8h14-17+me2j=md9d4j 2.000e+11 0.000 07600.0 !8 from mb mechanism c5h9-15+mf4d=md9d4j 8.800e+03 2.480 06130.0 !8 c7h12-16+mp3j=md9d5j 8.800e+03 2.480 06130.0 !8 c4h7-14+mh5d=md9d5j 8.800e+03 2.480 06130.0 !8 c6h10-15+mb4j=md9d6j 8.800e+03 2.480 06130.0 !8 md9d6j=c3h5-a+ms6d 3.310e+13 0.000 21460.0 !8 gierczak et al., 1986 c2h3+mo7d=md9d7j 2.000E+11 0.000 02007.0 !8 Weissman et Benson, 1984 c5h8-14+mf5j=md9d7j 8.800e+03 2.480 06130.0 !8 h+md79d=md9d7j 2.500e+11 0.510 02620.0 !8 c4h6+mh6j=md9d8j 8.800e+03 2.480 06130.0 !8 h+md79d=md9d8j 2.500e+11 0.510 02620.0 !8 ms7j+c3h4-a=md9d9j 8.800e+03 2.480 06130.0 !8 h+md9t=md9d9j 2.500e+11 0.510 02620.0 !8 c2h2+mo8j=md9d10j 8.800e+03 2.480 06130.0 !8 h+md9t=md9d10j 2.500e+11 0.510 02620.0 !8 ! ch2o+c9h17co-2=md8dmj 1.259e+11 0.000 07595.0 !8 henry, 2003 ch3+ch2=o ch3o+c8h15chco-2=md8d2j 5.000e+11 0.000 -01000.0 !8 from mb mechanism mp2d+c7h13-27=md8d2j 8.800e+03 2.480 06130.0 !8 ch3oco+c9h16-17=md8d3j 1.055e+11 0.000 07350.0 !8 from mb mechanism mb3d+c6h11-26=md8d3j 8.800e+03 2.480 06130.0 !8 me2j+c8h14-16=md8d4j 8.800e+03 2.480 06130.0 !8 mf4d+c5h9-25=md8d4j 8.800e+03 2.480 06130.0 !8 mp3j+c7h12-15=md8d5j 8.800e+03 2.480 06130.0 !8 c4h7-13+mh5d=md8d5j 8.800e+03 2.480 06130.0 !8 mb4j+c6h10-14=md8d6j 8.800e+03 2.480 06130.0 !8 c3h5-s+ms6d=md8d6j 8.800e+03 2.480 06130.0 !8 mf5j+c5h8-13=md8d7j 8.800e+03 2.480 06130.0 !8 mh6j+c4h6-12=md8d8j 8.800e+03 2.480 06130.0 !8 ch3+mn8t=md8d8j 1.760e+04 2.480 06130.0 !8 c3h4-p+ms7j=md8d9j 8.800e+03 2.480 06130.0 !8 ch2o+c9h17co-3=md7dmj 1.259e+11 0.000 07595.0 !8 henry, 2003 ch3+ch2=o ch3o+c8h15chco-3=md7d2j 5.000e+11 0.000 -01000.0 !8 from mb mechanism mp2d+c7h13-37=md7d2j 8.800e+03 2.480 06130.0 !8 ch3oco+c9h16-16=md7d3j 1.055e+11 0.000 07350.0 !8 from mb mechanism mb3d+c6h11-31=md7d3j 8.800e+03 2.480 06130.0 !8 me2j+c8h14-15=md7d4j 8.800e+03 2.480 06130.0 !8 mf4d+c5h9-13=md7d4j 8.800e+03 2.480 06130.0 !8 mp3j+c7h12-14=md7d5j 8.800e+03 2.480 06130.0 !8 mh5d+c4h7-11=md7d5j 8.800e+03 2.480 06130.0 !8 mb4j+c6h10-13=md7d6j 8.800e+03 2.480 06130.0 !8 ch3+mn68d=md7d6j 1.760e+04 2.480 06130.0 !8 mf5j+c5h8-12=md7d7j 8.800e+03 2.480 06130.0 !8 c2h5+mo7t=md7d7j 8.800e+03 2.480 06130.0 !8 ch3+mn78d=md7d8j 1.760e+04 2.480 06130.0 !8 c4h6-1+mh6j=md7d8j 8.800e+03 2.480 06130.0 !8 c2h4+mo7d8j=md7d10j 8.800e+03 2.480 06130.0 !8 ch2o+c9h17co-4=md6dmj 1.259e+11 0.000 07595.0 !8 henry, 2003 ch3+ch2=o ch3o+c8h15chco-4=md6d2j 5.000e+11 0.000 -01000.0 !8 from mb mechanism mp2d+c7h13-31=md6d2j 8.800e+03 2.480 06130.0 !8 ch3oco+c9h16-15=md6d3j 1.055e+11 0.000 07350.0 !8 from mb mechanism mb3d+c6h11-13=md6d3j 8.800e+03 2.480 06130.0 !8 me2j+c8h14-15=md6d4j 8.800e+03 2.480 06130.0 !8 mf4d+c5h9-11=md6d4j 8.800e+03 2.480 06130.0 !8 mp3j+c7h12-14=md6d5j 8.800e+03 2.480 06130.0 !8 c2h5+mo57d=md6d5j 8.800e+03 2.480 06130.0 !8 mb4j+c6h10-12=md6d6j 8.800e+03 2.480 06130.0 !8 nc3h7+ms6t=md6d6j 8.800e+03 2.480 06130.0 !8 mf5j+c5h8-1=md6d7j 8.800e+03 2.480 06130.0 !8 c2h5+mo67d=md6d7j 8.800e+03 2.480 06130.0 !8 c3h6+ms6d7j=md6d9j 8.800e+03 2.480 06130.0 !8 c2h4+mo7d6j=md6d10j 8.800e+03 2.480 06130.0 !8 ch2o+c9h17co-5=md5dmj 1.259e+11 0.000 07595.0 !8 henry, 2003 ch3+ch2=o ch3o+c8h15chco-5=md5d2j 5.000e+11 0.000 -01000.0 !8 from mb mechanism mp2d+c7h13-13=md5d2j 8.800e+03 2.480 06130.0 !8 ch3oco+c9h16-14=md5d3j 1.055e+11 0.000 07350.0 !8 from mb mechanism mb3d+c6h11-11=md5d3j 8.800e+03 2.480 06130.0 !8 me2j+c8h14-13=md5d4j 8.800e+03 2.480 06130.0 !8 nc3h7+ms46d=md5d4j 8.800e+03 2.480 06130.0 !8 mp3j+c7h12-12=md5d5j 8.800e+03 2.480 06130.0 !8 pc4h9+mh5t=md5d5j 8.800e+03 2.480 06130.0 !8 mb4j+c6h10-1=md5d6j 8.800e+03 2.480 06130.0 !8 nc3h7+ms56d=md5d6j 8.800e+03 2.480 06130.0 !8 ch3+mn58d=md5d8j 1.760e+04 2.480 06130.0 !8 c4h8-1+mh5d6j=md5d8j 8.800e+03 2.480 06130.0 !8 c3h6+ms6d5j=md5d9j 8.800e+03 2.480 06130.0 !8 c2h4+mo5d8j=md5d10j 8.800e+03 2.480 06130.0 !8 ch2o+c9h17co-6=md4dmj 1.259e+11 0.000 07595.0 !8 henry, 2003 ch3+ch2=o ch3o+c8h15chco-6=md4d2j 5.000e+11 0.000 -01000.0 !8 from mb mechanism mp2d+c7h13-11=md4d2j 8.800e+03 2.480 06130.0 !8 ch3oco+c9h16-13=md4d3j 1.055e+11 0.000 07350.0 !8 from mb mechanism pc4h9+mh35d=md4d3j 8.800e+03 2.480 06130.0 !8 me2j+c8h14-12=md4d4j 8.800e+03 2.480 06130.0 !8 c5h11-1+mf4t=md4d4j 8.800e+03 2.480 06130.0 !8 mp3j+c7h12-1=md4d5j 8.800e+03 2.480 06130.0 !8 pc4h9+mh45d=md4d5j 8.800e+03 2.480 06130.0 !8 mf4d5j+c5h10-1=md4d7j 8.800e+03 2.480 06130.0 !8 c2h5+mo47d=md4d7j 8.800e+03 2.480 06130.0 !8 ch3+mn48d=md4d8j 1.760e+04 2.480 06130.0 !8 c4h8-1+mh5d4j=md4d8j 8.800e+03 2.480 06130.0 !8 c3h6+ms4d7j=md4d9j 8.800e+03 2.480 06130.0 !8 c2h4+mo4d8j=md4d10j 8.800e+03 2.480 06130.0 !8 ch2o+c9h17co-7=md3dmj 1.259e+11 0.000 07595.0 !8 henry, 2003 ch3+ch2=o ch3o+c8h15chco-7=md3d2j 5.000e+11 0.000 -01000.0 !8 from mb mechanism c5h11-1+mf24d=md3d2j 8.800e+03 2.480 06130.0 !8 ch3oco+c9h16-12=md3d3j 1.055e+11 0.000 07350.0 !8 from mb mechanism c6h13-1+mb3t=md3d3j 8.800e+03 2.480 06130.0 !8 me2j+c8h14-1=md3d4j 8.800e+03 2.480 06130.0 !8 c5h11-1+mf34d=md3d4j 8.800e+03 2.480 06130.0 !8 c6h12-1+mb3d4j=md3d6j 8.800e+03 2.480 06130.0 !8 nc3h7+ms36d=md3d6j 8.800e+03 2.480 06130.0 !8 c2h5+mo37d=md3d7j 8.800e+03 2.480 06130.0 !8 c5h10-1+mf4d3j=md3d7j 8.800e+03 2.480 06130.0 !8 ch3+mn38d=md3d8j 1.760e+04 2.480 06130.0 !8 c4h8-1+mh3d6j=md3d8j 8.800e+03 2.480 06130.0 !8 c3h6+ms3d7j=md3d9j 8.800e+03 2.480 06130.0 !8 c2h4+mo3d8j=md3d10j 8.800e+03 2.480 06130.0 !8 ch2o+c9h17co-8=md2dmj 1.259e+11 0.000 07595.0 !8 henry, 2003 ch3+ch2=o ch3o+c8h15chco-8=md2d2j 5.000e+11 0.000 -01000.0 !8 from mb mechanism mp2t+c7h15-1=md2d2j 8.800e+03 2.480 06130.0 !8 ch3oco+c9h16-1=md2d3j 1.055e+11 0.000 07350.0 !8 from mb mechanism c6h13-1+mb23d=md2d3j 8.800e+03 2.480 06130.0 !8 c7h14-1+mp2d3j=md2d5j 8.800e+03 2.480 06130.0 !8 pc4h9+mh25d=md2d5j 8.800e+03 2.480 06130.0 !8 c6h12-1+mb3d2j=md2d6j 8.800e+03 2.480 06130.0 !8 nc3h7+ms26d=md2d6j 8.800e+03 2.480 06130.0 !8 c5h10-1+mf2d5j=md2d7j 8.800e+03 2.480 06130.0 !8 c2h5+mo27d=md2d7j 8.800e+03 2.480 06130.0 !8 c4h8-1+mh2d6j=md2d8j 8.800e+03 2.480 06130.0 !8 ch3+mn28d=md2d8j 1.760e+04 2.480 06130.0 !8 c3h6+ms2d7j=md2d9j 8.800e+03 2.480 06130.0 !8 c2h4+mo2d8j=md2d10j 8.800e+03 2.480 06130.0 !8 ! c2h3chco+h=c3h5co 1.000e+13 0.000 02900.0 !8 from mb mechanism ch2co+c2h3=c3h5co 1.000e+11 0.000 07600.0 !8 from mb mechanism c3h5-a+co=c3h5co 1.510e+11 0.000 04810.0 !8 ! c3h5chco+h=c4h7co 1.000e+13 0.000 02900.0 !8 from mb mechanism ch2co+c3h5-a=c4h7co 1.000e+11 0.000 07600.0 !8 from mb mechanism c4h7-14+co=c4h7co 1.510e+11 0.000 04810.0 !8 ! c4h7chco+h=c5h9co 1.000e+13 0.000 02900.0 !8 from mb mechanism ch2co+c4h7-14=c5h9co 1.000e+11 0.000 07600.0 !8 from mb mechanism c5h9-15+co=c5h9co 1.510e+11 0.000 04810.0 !8 ! c5h9chco+h=c6h11co 1.000e+13 0.000 02900.0 !8 from mb mechanism ch2co+c5h9-15=c6h11co 1.000e+11 0.000 07600.0 !8 from mb mechanism c6h11-16+co=c6h11co 1.510e+11 0.000 04810.0 !8 ! c6h11chco+h=c7h13co 1.000e+13 0.000 02900.0 !8 from mb mechanism ch2co+c6h11-15=c7h13co 1.000e+11 0.000 07600.0 !8 from mb mechanism c7h13-17+co=c7h13co 1.510e+11 0.000 04810.0 !8 ! c7h13chco+h=c8h15co 1.000e+13 0.000 02900.0 !8 from mb mechanism ch2co+c7h13-16=c8h15co 1.000e+11 0.000 07600.0 !8 from mb mechanism c8h15-18+co=c8h15co 1.510e+11 0.000 04810.0 !8 ! c8h15chco+h=c9h17co 1.000e+13 0.000 02900.0 !8 from mb mechanism ch2co+c8h15-17=c9h17co 1.000e+11 0.000 07600.0 !8 from mb mechanism c9h17-19+co=c9h17co 1.510e+11 0.000 04810.0 !8 c2h3+co2=peaoj 4.760e+07 1.540 34700.0 !8 glaude et al., 2005 ! ch2co+c8h15-28=c9h17co-2 1.000e+11 0.000 07600.0 !8 from mb mechanism ch2co+c8h15-38=c9h17co-3 1.000e+11 0.000 07600.0 !8 from mb mechanism ch2co+c8h15-41=c9h17co-4 1.000e+11 0.000 07600.0 !8 from mb mechanism ch2co+c8h15-31=c9h17co-5 1.000e+11 0.000 07600.0 !8 from mb mechanism ch2co+c8h15-13=c9h17co-6 1.000e+11 0.000 07600.0 !8 from mb mechanism ch2co+c8h15-11=c9h17co-7 1.000e+11 0.000 07600.0 !8 from mb mechanism ! !c2h4+c5h9-25=c7h13-27 8.800e+03 2.480 06130.0 !8 !h+c7h12-15=c7h13-27 2.500e+11 0.510 02620.0 !8 !c2h4+c5h9-13=c7h13-37 8.800e+03 2.480 06130.0 !8 !h+c7h12-14=c7h13-37 2.500e+11 0.510 02620.0 !8 !c2h4+c5h9-11=c7h13-31 8.800e+03 2.480 06130.0 !8 !h+c7h12-13=c7h13-31 2.500e+11 0.510 02620.0 !8 c2h4+c4h7-13=c6h11-26 8.800e+03 2.480 06130.0 !8 h+c6h10-14=c6h11-26 2.500e+11 0.510 02620.0 !8 c2h4+c4h7-11=c6h11-31 8.800e+03 2.480 06130.0 !8 h+c6h10-13=c6h11-31 2.500e+11 0.510 02620.0 !8 c2h4+c3h5-s=c5h9-25 8.800e+03 2.480 06130.0 !8 h+c5h8-13=c5h9-25 2.500e+11 0.510 02620.0 !8 ! !Isomerizations ! mb3dmj=mb3d2j 3.670E+12 -0.600 15300.0 !8 1,4 p->a Matheu et al., 2002 ! mf4dmj=mf4d2j 7.850E+11 -0.120 18300.0 !8 1,4 p->t Matheu et al., 2002 mf4dmj=mf4d3j 3.670E+12 -0.600 04900.0 !8 1,5 p->a correlation Matheu et all., 2002 mf4d2j=mf4d3j 3.560E+10 1.880 32400.0 !8 1,2 t->a correlation Matheu et all., 2002 ! mh5dmj=mh5d2j 7.850E+11 -0.120 18300.0 !8 1,4 p->t Matheu et al., 2002 mh5dmj=mh5d3j 1.820E+02 2.550 10960.0 !8 1,5 p->s Tsang, 2007 all., 2002 mh5d3j=mh5d2j 3.560E+10 0.880 37700.0 !8 1,2 s->t Matheu et al., 2002 mh5d2j=mh5d4j 3.800E+10 0.670 30600.0 !8 1,3 s->a correlation Matheu et all., 2002 mh5d3j=mh5d4j 3.560E+10 0.880 31500.0 !8 1.2 s->a Matheu et al., 2002 ! ms6dmj=ms6d2j 7.850E+11 -0.120 18300.0 !8 1,4 p->t Matheu et al., 2002 ms6dmj=ms6d3j 1.820E+02 2.550 10960.0 !8 1,5 p->s Tsang, 2007 all., 2002 ms6d3j=ms6d2j 3.560E+10 0.880 37700.0 !8 1,2 s->t Matheu et al., 2002 ms6d4j=ms6d2j 3.800E+10 0.670 36100.0 !8 1,3 s->t Matheu et al., 2002 ms6d2j=ms6d5j 7.850E+11 0.880 11800.0 !8 1,4 t->a correlation Matheu et all., 2002 ms6d3j=ms6d4j 3.560E+10 0.880 39100.0 !8 1.2 s->s Matheu et al., 2002 ms6d3j=ms6d5j 3.800E+10 0.670 30600.0 !8 1,3 s->a correlation Matheu et all., 2002 ms6d4j=ms6d5j 3.560E+10 0.880 31500.0 !8 1.2 s->a Matheu et al., 2002 ! mo7dmj=mo7d2j 7.850E+11 -0.120 18300.0 !8 1,4 p->t Matheu et al., 2002 mo7dmj=mo7d3j 1.820E+02 2.550 10960.0 !8 1,5 p->s Tsang, 2007 all., 2002 mo7d3j=mo7d2j 3.560E+10 0.880 37700.0 !8 1,2 s->t Matheu et al., 2002 mo7d4j=mo7d2j 3.800E+10 0.670 36100.0 !8 1,3 s->t Matheu et al., 2002 mo7d5j=mo7d2j 3.800E+10 0.670 36100.0 !8 1,4 s->t Matheu et al., 2002 mo7d2j=mo7d6j 3.670E+12 -0.600 04000.0 !8 1.5 t->a correlation Matheu et all., 2002 mo7d3j=mo7d4j 3.560E+10 0.880 39100.0 !8 1.2 s->s Matheu et al., 2002 mo7d3j=mo7d5j 3.800E+10 0.670 38200.0 !8 1,3 s->s Matheu et al., 2002 mo7d3j=mo7d6j 7.850E+11 -0.120 15900.0 !8 1,4 s->a correlation Matheu et all., 2002 mo7d4j=mo7d5j 3.560E+10 0.880 39100.0 !8 1.2 s->s Matheu et al., 2002 mo7d4j=mo7d6j 3.800E+10 0.670 30600.0 !8 1,3 s->a correlation Matheu et all., 2002 mo7d5j=mo7d6j 3.560E+10 0.880 31500.0 !8 1.2 s->a Matheu et al., 2002 ! mn8dmj=mn8d2j 7.850E+11 -0.120 18300.0 !8 1,4 p->t Matheu et al., 2002 mn8dmj=mn8d3j 1.820E+02 2.550 10960.0 !8 1,5 p->s Tsang, 2007 all., 2002 mn8d3j=mn8d2j 3.560E+10 0.880 37700.0 !8 1,2 s->t Matheu et al., 2002 mn8d4j=mn8d2j 3.800E+10 0.670 36100.0 !8 1,3 s->t Matheu et al., 2002 mn8d5j=mn8d2j 3.800E+10 0.670 36100.0 !8 1,4 s->t Matheu et al., 2002 mn8d6j=mn8d2j 3.670E+12 0.400 10500.0 !8 1,5 s->t correlation Matheu et all., 2002 mn8d3j=mn8d4j 3.560E+10 0.880 39100.0 !8 1.2 s->s Matheu et al., 2002 mn8d3j=mn8d5j 3.800E+10 0.670 38200.0 !8 1,3 s->s Matheu et al., 2002 mn8d3j=mn8d6j 7.850E+11 -0.120 23500.0 !8 1,4 s->s Matheu et al., 2002 mn8d3j=mn8d7j 3.670E+12 -0.600 07100.0 !8 1,5 s->a correlation Matheu et all., 2002 mn8d4j=mn8d5j 3.560E+10 0.880 39100.0 !8 1.2 s->s Matheu et al., 2002 mn8d4j=mn8d6j 3.800E+10 0.670 38200.0 !8 1,3 s->s Matheu et al., 2002 mn8d4j=mn8d7j 7.850E+11 -0.120 15900.0 !8 1,4 s->a correlation Matheu et all., 2002 mn8d5j=mn8d6j 3.560E+10 0.880 39100.0 !8 1.2 s->s Matheu et al., 2002 mn8d5j=mn8d7j 3.800E+10 0.670 30600.0 !8 1,3 s->a correlation Matheu et all., 2002 mn8d6j=mn8d7j 3.560E+10 0.880 31500.0 !8 1.2 s->a Matheu et al., 2002 ! md9dmj=md9d2j 7.850E+11 -0.120 18300.0 !8 1,4 p->t Matheu et al., 2002 md9dmj=md9d3j 1.820E+02 2.550 10960.0 !8 1,5 p->s Tsang, 2007 all., 2002 md9d3j=md9d2j 3.560E+10 0.880 37700.0 !8 1,2 s->t Matheu et al., 2002 md9d4j=md9d2j 3.800E+10 0.670 36100.0 !8 1,3 s->t Matheu et al., 2002 md9d5j=md9d2j 3.800E+10 0.670 36100.0 !8 1,4 s->t Matheu et al., 2002 md9d6j=md9d2j 3.670E+12 0.400 10500.0 !8 1,5 s->t correlation Matheu et all., 2002 md9d3j=md9d4j 3.560E+10 0.880 39100.0 !8 1.2 s->s Matheu et al., 2002 md9d3j=md9d5j 3.800E+10 0.670 38200.0 !8 1,3 s->s Matheu et al., 2002 md9d3j=md9d6j 7.850E+11 -0.120 23500.0 !8 1,4 s->s Matheu et al., 2002 md9d3j=md9d7j 3.670E+12 -0.600 14700.0 !8 1,5 s->s correlation Matheu et all., 2002 md9d4j=md9d5j 3.560E+10 0.880 39100.0 !8 1.2 s->s Matheu et al., 2002 md9d4j=md9d6j 3.800E+10 0.670 38200.0 !8 1,3 s->s Matheu et al., 2002 md9d4j=md9d7j 7.850E+11 -0.120 23500.0 !8 1,4 s->s Matheu et al., 2002 md9d4j=md9d8j 3.670E+12 -0.600 07100.0 !8 1,5 s->a correlation Matheu et all., 2002 md9d5j=md9d6j 3.560E+10 0.880 39100.0 !8 1.2 s->s Matheu et al., 2002 md9d5j=md9d7j 3.800E+10 0.670 38200.0 !8 1,3 s->s Matheu et al., 2002 md9d5j=md9d8j 7.850E+11 -0.120 15900.0 !8 1,4 s->a correlation Matheu et all., 2002 md9d6j=md9d7j 3.560E+10 0.880 39100.0 !8 1.2 s->s Matheu et al., 2002 md9d6j=md9d8j 3.800E+10 0.670 30600.0 !8 1,3 s->a correlation Matheu et all., 2002 md9d7j=md9d8j 3.560E+10 0.880 31500.0 !8 1.2 s->a Matheu et al., 2002 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 9/olefin decomposition ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! !9a/Unimoleular decomposition c9h18-1=c3h5-a+c6h13-1 2.500E+16 0.000 71000.0 !9 Edelson et Allara, 1980 c9h17-13+h=c9h18-1 1.000E+14 0.000 00000.0 !9 c8h16-1=c3h5-a+c5h11-1 2.500E+16 0.000 71000.0 !9 Edelson et Allara, 1980 c8h15-13+h=c8h16-1 1.000E+14 0.000 00000.0 !9 !c7h14-1=c3h5-a+pc4h9 2.500E+16 0.000 71000.0 !9 Edelson et Allara, 1980 !c7h13-13+h=c7h14-1 1.000E+14 0.000 00000.0 !9 !c3h5-a+nc3h7=c6h12-1 2.500E+16 0.000 71000.0 !9 Edelson et Allara, 1980 !c6h11-13+h=c6h12-1 1.000E+14 0.000 00000.0 !9 !c3h5-a+c2h5=c5h10-1 2.500E+16 0.000 71000.0 !9 Edelson et Allara, 1980 !c5h9-13+h=c5h10-1 1.000E+14 0.000 00000.0 !9 !c3h5-a+ch3=c4h8-1 1.350e+13 0.000 00000.0 !9 !c4h7-13+h=c4h8-1 1.000E+14 0.000 00000.0 !9 ! md9d=c3h5-a+ms7j 2.500E+16 0.000 71000.0 !9 Edelson et Allara, 1980 mn8d=c3h5-a+mh6j 2.500E+16 0.000 71000.0 !9 Edelson et Allara, 1980 mo7d=c3h5-a+mf5j 2.500E+16 0.000 71000.0 !9 Edelson et Allara, 1980 ms6d=c3h5-a+mb4j 2.500E+16 0.000 71000.0 !9 Edelson et Allara, 1980 mh5d=c3h5-a+mp3j 2.500E+16 0.000 71000.0 !9 Edelson et Allara, 1980 mf4d=c3h5-a+me2j 2.500E+16 0.000 71000.0 !9 Edelson et Allara, 1980 ! ! !9b/molecular decomposition and elimination !1-olefins c9h18-1=c3h6+c6h12-1 3.980e+12 0.000 57630.0 !9 King, 1979 c8h16-1=c3h6+c5h10-1 3.980e+12 0.000 57630.0 !9 King, 1979 !c7h14-1=c3h6+c4h8-1 3.980e+12 0.000 57630.0 !9 King, 1979 !c6h12-1=c3h6+c3h6 3.980e+12 0.000 57630.0 !9 King, 1979 !c5h10-1=c3h6+c2h4 3.980e+12 0.000 57630.0 !9 King, 1979 ! ! !esters md9d=c3h6+ms6d 3.980e+12 0.000 57630.0 !9 King, 1979 mn8d=c3h6+mh5d 3.980e+12 0.000 57630.0 !9 King, 1979 mo7d=c3h6+mf4d 3.980e+12 0.000 57630.0 !9 King, 1979 ms6d=c3h6+mb3d 3.980e+12 0.000 57630.0 !9 King, 1979 mh5d=c3h6+mp2d 3.980e+12 0.000 57630.0 !9 King, 1979 ! md9d=me+c8h14-17 3.980e+12 0.000 68000.0 !9 A from retroene of olefin and Ea from Metcalfe et al., 2007 mn8d=me+c7h12-16 3.980e+12 0.000 68000.0 !9 A from retroene of olefin and Ea from Metcalfe et al., 2007 mo7d=me+c6h10-15 3.980e+12 0.000 68000.0 !9 A from retroene of olefin and Ea from Metcalfe et al., 2007 ms6d=me+c5h8-14 3.980e+12 0.000 68000.0 !9 A from retroene of olefin and Ea from Metcalfe et al., 2007 mh5d=me+c4h6 3.980e+12 0.000 68000.0 !9 A from retroene of olefin and Ea from Metcalfe et al., 2007 mf4d=me+c3h4-a 3.980e+12 0.000 68000.0 !9 A from retroene of olefin and Ea from Metcalfe et al., 2007 mb3d=me+c2h2 3.980e+12 0.000 68000.0 !9 A from retroene of olefin and Ea from Metcalfe et al., 2007 ! c2h3co+ch3o=mp2d 3.000e+13 0.000 00000.0 !9 ch3+peaoj=mp2d 3.000e+13 0.000 00000.0 !9 c2h3+ch3oco=mp2d 1.810e+13 0.000 00000.0 !9 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! ! ! Low temperature mechanism ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! !!!!!!!!!!!!!!!!!!!!!!!! ! 10/R+o2 addition ! !!!!!!!!!!!!!!!!!!!!!!!! ! !alkyl radicals c9h19-1+o2=c9h19o2-1 4.520e+12 0.000 00000.0 !10 c9h19-2+o2=c9h19o2-2 7.540e+12 0.000 00000.0 !10 c9h19-3+o2=c9h19o2-3 7.540e+12 0.000 00000.0 !10 c9h19-4+o2=c9h19o2-4 7.540e+12 0.000 00000.0 !10 c9h19-5+o2=c9h19o2-5 7.540e+12 0.000 00000.0 !10 c8h17-1+o2=c8h17o2-1 4.520e+12 0.000 00000.0 !10 c8h17-2+o2=c8h17o2-2 7.540e+12 0.000 00000.0 !10 c8h17-3+o2=c8h17o2-3 7.540e+12 0.000 00000.0 !10 c8h17-4+o2=c8h17o2-4 7.540e+12 0.000 00000.0 !10 !c7h15-1+o2=c7h15o2-1 4.520e+12 0.000 00000.0 !10 !c7h15-2+o2=c7h15o2-2 7.540e+12 0.000 00000.0 !10 !c7h15-3+o2=c7h15o2-3 7.540e+12 0.000 00000.0 !10 !c7h15-4+o2=c7h15o2-4 7.540e+12 0.000 00000.0 !10 !c6h13-1+o2=c6h13o2-1 4.520e+12 0.000 00000.0 !10 !c6h13-2+o2=c6h13o2-2 7.540e+12 0.000 00000.0 !10 !c6h13-3+o2=c6h13o2-3 7.540e+12 0.000 00000.0 !10 !c5h11-1+o2=c5h11o2-1 4.520e+12 0.000 00000.0 !10 !c5h11-2+o2=c5h11o2-2 7.540e+12 0.000 00000.0 !10 !c5h11-3+o2=c5h11o2-3 7.540e+12 0.000 00000.0 !10 !pc4h9+o2=pc4h9o2 4.520e+12 0.000 00000.0 !10 !sc4h9+o2=sc4h9o2 7.540e+12 0.000 00000.0 !10 ! ! md10j+o2=md10o2 4.520e+12 0.000 00000.0 !10 md9j+o2=md9o2 7.540e+12 0.000 00000.0 !10 md8j+o2=md8o2 7.540e+12 0.000 00000.0 !10 md7j+o2=md7o2 7.540e+12 0.000 00000.0 !10 md6j+o2=md6o2 7.540e+12 0.000 00000.0 !10 md5j+o2=md5o2 7.540e+12 0.000 00000.0 !10 md4j+o2=md4o2 7.540e+12 0.000 00000.0 !10 md3j+o2=md3o2 7.540e+12 0.000 00000.0 !10 md2j+o2=md2o2 7.540e+12 0.000 00000.0 !10 mdmj+o2=mdmo2 4.520e+12 0.000 00000.0 !10 ! mn9j+o2=mn9o2 4.520e+12 0.000 00000.0 !10 mn8j+o2=mn8o2 7.540e+12 0.000 00000.0 !10 mn7j+o2=mn7o2 7.540e+12 0.000 00000.0 !10 mn6j+o2=mn6o2 7.540e+12 0.000 00000.0 !10 mn5j+o2=mn5o2 7.540e+12 0.000 00000.0 !10 mn4j+o2=mn4o2 7.540e+12 0.000 00000.0 !10 mn3j+o2=mn3o2 7.540e+12 0.000 00000.0 !10 mn2j+o2=mn2o2 7.540e+12 0.000 00000.0 !10 mnmj+o2=mnmo2 4.520e+12 0.000 00000.0 !10 ! mo8j+o2=mo8o2 4.520e+12 0.000 00000.0 !10 mo7j+o2=mo7o2 7.540e+12 0.000 00000.0 !10 mo6j+o2=mo6o2 7.540e+12 0.000 00000.0 !10 mo5j+o2=mo5o2 7.540e+12 0.000 00000.0 !10 mo4j+o2=mo4o2 7.540e+12 0.000 00000.0 !10 mo3j+o2=mo3o2 7.540e+12 0.000 00000.0 !10 mo2j+o2=mo2o2 7.540e+12 0.000 00000.0 !10 mojm+o2=mamo2 4.520e+12 0.000 00000.0 !10 ! ms7j+o2=ms7o2 4.520e+12 0.000 00000.0 !10 ms6j+o2=ms6o2 7.540e+12 0.000 00000.0 !10 ms5j+o2=ms5o2 7.540e+12 0.000 00000.0 !10 ms4j+o2=ms4o2 7.540e+12 0.000 00000.0 !10 ms3j+o2=ms3o2 7.540e+12 0.000 00000.0 !10 ms2j+o2=ms2o2 7.540e+12 0.000 00000.0 !10 msmj+o2=msmo2 4.520e+12 0.000 00000.0 !10 ! mh6j+o2=mh6o2 4.520e+12 0.000 00000.0 !10 mh5j+o2=mh5o2 7.540e+12 0.000 00000.0 !10 mh4j+o2=mh4o2 7.540e+12 0.000 00000.0 !10 mh3j+o2=mh3o2 7.540e+12 0.000 00000.0 !10 mh2j+o2=mh2o2 7.540e+12 0.000 00000.0 !10 mhmj+o2=mhmo2 4.520e+12 0.000 00000.0 !10 ! mf5j+o2=mf5o2 4.520e+12 0.000 00000.0 !10 mf4j+o2=mf4o2 7.540e+12 0.000 00000.0 !10 mf3j+o2=mf3o2 7.540e+12 0.000 00000.0 !10 mf2j+o2=mf2o2 7.540e+12 0.000 00000.0 !10 mfmj+o2=mfmo2 4.520e+12 0.000 00000.0 !10 ! mb4j+o2=mb4o2 4.520e+12 0.000 00000.0 !10 mb3j+o2=mb3o2 7.540e+12 0.000 00000.0 !10 mb2j+o2=mb2o2 7.540e+12 0.000 00000.0 !10 mbmj+o2=mbmo2 4.520e+12 0.000 00000.0 !10 ! mp3j+o2=mp3o2 4.520e+12 0.000 00000.0 !10 mp2j+o2=mp2o2 7.540e+12 0.000 00000.0 !10 mpmj+o2=mpmo2 4.520e+12 0.000 00000.0 !10 ! me2j+o2=me2o2 4.520e+12 0.000 00000.0 !10 memj+o2=memo2 4.520e+12 0.000 00000.0 !10 ! ch3oco+o2=ch3ocooo 4.520e+12 0.000 00000.0 !10 c9h19co+o2=c9h19cooo 4.520e+12 0.000 00000.0 !10 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!! ! 11/R+R'O2=RO+R'O ! !!!!!!!!!!!!!!!!!!!!!!!! ! md10o2+md10j=md10o+md10o 7.000E+12 0.000 -01000.0 !11 md9o2+md10j=md9o+md10o 7.000E+12 0.000 -01000.0 !11 md8o2+md10j=md8o+md10o 7.000E+12 0.000 -01000.0 !11 md7o2+md10j=md7o+md10o 7.000E+12 0.000 -01000.0 !11 md6o2+md10j=md6o+md10o 7.000E+12 0.000 -01000.0 !11 md5o2+md10j=md5o+md10o 7.000E+12 0.000 -01000.0 !11 md4o2+md10j=md4o+md10o 7.000E+12 0.000 -01000.0 !11 md3o2+md10j=md3o+md10o 7.000E+12 0.000 -01000.0 !11 md2o2+md10j=md2o+md10o 7.000E+12 0.000 -01000.0 !11 mdmo2+md10j=mdmo+md10o 7.000E+12 0.000 -01000.0 !11 ! md10o2+md9j=md10o+md9o 7.000E+12 0.000 -01000.0 !11 md9o2+md9j=md9o+md9o 7.000E+12 0.000 -01000.0 !11 md8o2+md9j=md8o+md9o 7.000E+12 0.000 -01000.0 !11 md7o2+md9j=md7o+md9o 7.000E+12 0.000 -01000.0 !11 md6o2+md9j=md6o+md9o 7.000E+12 0.000 -01000.0 !11 md5o2+md9j=md5o+md9o 7.000E+12 0.000 -01000.0 !11 md4o2+md9j=md4o+md9o 7.000E+12 0.000 -01000.0 !11 md3o2+md9j=md3o+md9o 7.000E+12 0.000 -01000.0 !11 md2o2+md9j=md2o+md9o 7.000E+12 0.000 -01000.0 !11 mdmo2+md9j=mdmo+md9o 7.000E+12 0.000 -01000.0 !11 ! md10o2+md8j=md10o+md8o 7.000E+12 0.000 -01000.0 !11 md9o2+md8j=md9o+md8o 7.000E+12 0.000 -01000.0 !11 md8o2+md8j=md8o+md8o 7.000E+12 0.000 -01000.0 !11 md7o2+md8j=md7o+md8o 7.000E+12 0.000 -01000.0 !11 md6o2+md8j=md6o+md8o 7.000E+12 0.000 -01000.0 !11 md5o2+md8j=md5o+md8o 7.000E+12 0.000 -01000.0 !11 md4o2+md8j=md4o+md8o 7.000E+12 0.000 -01000.0 !11 md3o2+md8j=md3o+md8o 7.000E+12 0.000 -01000.0 !11 md2o2+md8j=md2o+md8o 7.000E+12 0.000 -01000.0 !11 mdmo2+md8j=mdmo+md8o 7.000E+12 0.000 -01000.0 !11 ! md10o2+md7j=md10o+md7o 7.000E+12 0.000 -01000.0 !11 md9o2+md7j=md9o+md7o 7.000E+12 0.000 -01000.0 !11 md8o2+md7j=md8o+md7o 7.000E+12 0.000 -01000.0 !11 md7o2+md7j=md7o+md7o 7.000E+12 0.000 -01000.0 !11 md6o2+md7j=md6o+md7o 7.000E+12 0.000 -01000.0 !11 md5o2+md7j=md5o+md7o 7.000E+12 0.000 -01000.0 !11 md4o2+md7j=md4o+md7o 7.000E+12 0.000 -01000.0 !11 md3o2+md7j=md3o+md7o 7.000E+12 0.000 -01000.0 !11 md2o2+md7j=md2o+md7o 7.000E+12 0.000 -01000.0 !11 mdmo2+md7j=mdmo+md7o 7.000E+12 0.000 -01000.0 !11 ! md10o2+md6j=md10o+md6o 7.000E+12 0.000 -01000.0 !11 md9o2+md6j=md9o+md6o 7.000E+12 0.000 -01000.0 !11 md8o2+md6j=md8o+md6o 7.000E+12 0.000 -01000.0 !11 md7o2+md6j=md7o+md6o 7.000E+12 0.000 -01000.0 !11 md6o2+md6j=md6o+md6o 7.000E+12 0.000 -01000.0 !11 md5o2+md6j=md5o+md6o 7.000E+12 0.000 -01000.0 !11 md4o2+md6j=md4o+md6o 7.000E+12 0.000 -01000.0 !11 md3o2+md6j=md3o+md6o 7.000E+12 0.000 -01000.0 !11 md2o2+md6j=md2o+md6o 7.000E+12 0.000 -01000.0 !11 mdmo2+md6j=mdmo+md6o 7.000E+12 0.000 -01000.0 !11 ! md10o2+md5j=md10o+md5o 7.000E+12 0.000 -01000.0 !11 md9o2+md5j=md9o+md5o 7.000E+12 0.000 -01000.0 !11 md8o2+md5j=md8o+md5o 7.000E+12 0.000 -01000.0 !11 md7o2+md5j=md7o+md5o 7.000E+12 0.000 -01000.0 !11 md6o2+md5j=md6o+md5o 7.000E+12 0.000 -01000.0 !11 md5o2+md5j=md5o+md5o 7.000E+12 0.000 -01000.0 !11 md4o2+md5j=md4o+md5o 7.000E+12 0.000 -01000.0 !11 md3o2+md5j=md3o+md5o 7.000E+12 0.000 -01000.0 !11 md2o2+md5j=md2o+md5o 7.000E+12 0.000 -01000.0 !11 mdmo2+md5j=mdmo+md5o 7.000E+12 0.000 -01000.0 !11 ! md10o2+md4j=md10o+md4o 7.000E+12 0.000 -01000.0 !11 md9o2+md4j=md9o+md4o 7.000E+12 0.000 -01000.0 !11 md8o2+md4j=md8o+md4o 7.000E+12 0.000 -01000.0 !11 md7o2+md4j=md7o+md4o 7.000E+12 0.000 -01000.0 !11 md6o2+md4j=md6o+md4o 7.000E+12 0.000 -01000.0 !11 md5o2+md4j=md5o+md4o 7.000E+12 0.000 -01000.0 !11 md4o2+md4j=md4o+md4o 7.000E+12 0.000 -01000.0 !11 md3o2+md4j=md3o+md4o 7.000E+12 0.000 -01000.0 !11 md2o2+md4j=md2o+md4o 7.000E+12 0.000 -01000.0 !11 mdmo2+md4j=mdmo+md4o 7.000E+12 0.000 -01000.0 !11 ! md10o2+md3j=md10o+md3o 7.000E+12 0.000 -01000.0 !11 md9o2+md3j=md9o+md3o 7.000E+12 0.000 -01000.0 !11 md8o2+md3j=md8o+md3o 7.000E+12 0.000 -01000.0 !11 md7o2+md3j=md7o+md3o 7.000E+12 0.000 -01000.0 !11 md6o2+md3j=md6o+md3o 7.000E+12 0.000 -01000.0 !11 md5o2+md3j=md5o+md3o 7.000E+12 0.000 -01000.0 !11 md4o2+md3j=md4o+md3o 7.000E+12 0.000 -01000.0 !11 md3o2+md3j=md3o+md3o 7.000E+12 0.000 -01000.0 !11 md2o2+md3j=md2o+md3o 7.000E+12 0.000 -01000.0 !11 mdmo2+md3j=mdmo+md3o 7.000E+12 0.000 -01000.0 !11 ! md10o2+md2j=md10o+md2o 7.000E+12 0.000 -01000.0 !11 md9o2+md2j=md9o+md2o 7.000E+12 0.000 -01000.0 !11 md8o2+md2j=md8o+md2o 7.000E+12 0.000 -01000.0 !11 md7o2+md2j=md7o+md2o 7.000E+12 0.000 -01000.0 !11 md6o2+md2j=md6o+md2o 7.000E+12 0.000 -01000.0 !11 md5o2+md2j=md5o+md2o 7.000E+12 0.000 -01000.0 !11 md4o2+md2j=md4o+md2o 7.000E+12 0.000 -01000.0 !11 md3o2+md2j=md3o+md2o 7.000E+12 0.000 -01000.0 !11 md2o2+md2j=md2o+md2o 7.000E+12 0.000 -01000.0 !11 mdmo2+md2j=mdmo+md2o 7.000E+12 0.000 -01000.0 !11 ! md10o2+mdmj=md10o+mdmo 7.000E+12 0.000 -01000.0 !11 md9o2+mdmj=md9o+mdmo 7.000E+12 0.000 -01000.0 !11 md8o2+mdmj=md8o+mdmo 7.000E+12 0.000 -01000.0 !11 md7o2+mdmj=md7o+mdmo 7.000E+12 0.000 -01000.0 !11 md6o2+mdmj=md6o+mdmo 7.000E+12 0.000 -01000.0 !11 md5o2+mdmj=md5o+mdmo 7.000E+12 0.000 -01000.0 !11 md4o2+mdmj=md4o+mdmo 7.000E+12 0.000 -01000.0 !11 md3o2+mdmj=md3o+mdmo 7.000E+12 0.000 -01000.0 !11 md2o2+mdmj=md2o+mdmo 7.000E+12 0.000 -01000.0 !11 mdmo2+mdmj=mdmo+mdmo 7.000E+12 0.000 -01000.0 !11 ! md10o2+mn9j=md10o+mn9o 7.000E+12 0.000 -01000.0 !11 md9o2+mn9j=md9o+mn9o 7.000E+12 0.000 -01000.0 !11 md8o2+mn9j=md8o+mn9o 7.000E+12 0.000 -01000.0 !11 md7o2+mn9j=md7o+mn9o 7.000E+12 0.000 -01000.0 !11 md6o2+mn9j=md6o+mn9o 7.000E+12 0.000 -01000.0 !11 md5o2+mn9j=md5o+mn9o 7.000E+12 0.000 -01000.0 !11 md4o2+mn9j=md4o+mn9o 7.000E+12 0.000 -01000.0 !11 md3o2+mn9j=md3o+mn9o 7.000E+12 0.000 -01000.0 !11 md2o2+mn9j=md2o+mn9o 7.000E+12 0.000 -01000.0 !11 mdmo2+mn9j=mdmo+mn9o 7.000E+12 0.000 -01000.0 !11 ! md10o2+mo8j=md10o+mo8o 7.000E+12 0.000 -01000.0 !11 md9o2+mo8j=md9o+mo8o 7.000E+12 0.000 -01000.0 !11 md8o2+mo8j=md8o+mo8o 7.000E+12 0.000 -01000.0 !11 md7o2+mo8j=md7o+mo8o 7.000E+12 0.000 -01000.0 !11 md6o2+mo8j=md6o+mo8o 7.000E+12 0.000 -01000.0 !11 md5o2+mo8j=md5o+mo8o 7.000E+12 0.000 -01000.0 !11 md4o2+mo8j=md4o+mo8o 7.000E+12 0.000 -01000.0 !11 md3o2+mo8j=md3o+mo8o 7.000E+12 0.000 -01000.0 !11 md2o2+mo8j=md2o+mo8o 7.000E+12 0.000 -01000.0 !11 mdmo2+mo8j=mdmo+mo8o 7.000E+12 0.000 -01000.0 !11 ! md10o2+ms7j=md10o+ms7o 7.000E+12 0.000 -01000.0 !11 md9o2+ms7j=md9o+ms7o 7.000E+12 0.000 -01000.0 !11 md8o2+ms7j=md8o+ms7o 7.000E+12 0.000 -01000.0 !11 md7o2+ms7j=md7o+ms7o 7.000E+12 0.000 -01000.0 !11 md6o2+ms7j=md6o+ms7o 7.000E+12 0.000 -01000.0 !11 md5o2+ms7j=md5o+ms7o 7.000E+12 0.000 -01000.0 !11 md4o2+ms7j=md4o+ms7o 7.000E+12 0.000 -01000.0 !11 md3o2+ms7j=md3o+ms7o 7.000E+12 0.000 -01000.0 !11 md2o2+ms7j=md2o+ms7o 7.000E+12 0.000 -01000.0 !11 mdmo2+ms7j=mdmo+ms7o 7.000E+12 0.000 -01000.0 !11 ! md10o2+mh6j=md10o+mh6o 7.000E+12 0.000 -01000.0 !11 md9o2+mh6j=md9o+mh6o 7.000E+12 0.000 -01000.0 !11 md8o2+mh6j=md8o+mh6o 7.000E+12 0.000 -01000.0 !11 md7o2+mh6j=md7o+mh6o 7.000E+12 0.000 -01000.0 !11 md6o2+mh6j=md6o+mh6o 7.000E+12 0.000 -01000.0 !11 md5o2+mh6j=md5o+mh6o 7.000E+12 0.000 -01000.0 !11 md4o2+mh6j=md4o+mh6o 7.000E+12 0.000 -01000.0 !11 md3o2+mh6j=md3o+mh6o 7.000E+12 0.000 -01000.0 !11 md2o2+mh6j=md2o+mh6o 7.000E+12 0.000 -01000.0 !11 mdmo2+mh6j=mdmo+mh6o 7.000E+12 0.000 -01000.0 !11 ! md10o2+mf5j=md10o+mf5o 7.000E+12 0.000 -01000.0 !11 md9o2+mf5j=md9o+mf5o 7.000E+12 0.000 -01000.0 !11 md8o2+mf5j=md8o+mf5o 7.000E+12 0.000 -01000.0 !11 md7o2+mf5j=md7o+mf5o 7.000E+12 0.000 -01000.0 !11 md6o2+mf5j=md6o+mf5o 7.000E+12 0.000 -01000.0 !11 md5o2+mf5j=md5o+mf5o 7.000E+12 0.000 -01000.0 !11 md4o2+mf5j=md4o+mf5o 7.000E+12 0.000 -01000.0 !11 md3o2+mf5j=md3o+mf5o 7.000E+12 0.000 -01000.0 !11 md2o2+mf5j=md2o+mf5o 7.000E+12 0.000 -01000.0 !11 mdmo2+mf5j=mdmo+mf5o 7.000E+12 0.000 -01000.0 !11 ! md10o2+mb4j=md10o+mb4o 7.000E+12 0.000 -01000.0 !11 md9o2+mb4j=md9o+mb4o 7.000E+12 0.000 -01000.0 !11 md8o2+mb4j=md8o+mb4o 7.000E+12 0.000 -01000.0 !11 md7o2+mb4j=md7o+mb4o 7.000E+12 0.000 -01000.0 !11 md6o2+mb4j=md6o+mb4o 7.000E+12 0.000 -01000.0 !11 md5o2+mb4j=md5o+mb4o 7.000E+12 0.000 -01000.0 !11 md4o2+mb4j=md4o+mb4o 7.000E+12 0.000 -01000.0 !11 md3o2+mb4j=md3o+mb4o 7.000E+12 0.000 -01000.0 !11 md2o2+mb4j=md2o+mb4o 7.000E+12 0.000 -01000.0 !11 mdmo2+mb4j=mdmo+mb4o 7.000E+12 0.000 -01000.0 !11 ! md10o2+mp3j=md10o+mp3o 7.000E+12 0.000 -01000.0 !11 md9o2+mp3j=md9o+mp3o 7.000E+12 0.000 -01000.0 !11 md8o2+mp3j=md8o+mp3o 7.000E+12 0.000 -01000.0 !11 md7o2+mp3j=md7o+mp3o 7.000E+12 0.000 -01000.0 !11 md6o2+mp3j=md6o+mp3o 7.000E+12 0.000 -01000.0 !11 md5o2+mp3j=md5o+mp3o 7.000E+12 0.000 -01000.0 !11 md4o2+mp3j=md4o+mp3o 7.000E+12 0.000 -01000.0 !11 md3o2+mp3j=md3o+mp3o 7.000E+12 0.000 -01000.0 !11 md2o2+mp3j=md2o+mp3o 7.000E+12 0.000 -01000.0 !11 mdmo2+mp3j=mdmo+mp3o 7.000E+12 0.000 -01000.0 !11 ! md10o2+me2j=md10o+me2o 7.000E+12 0.000 -01000.0 !11 md9o2+me2j=md9o+me2o 7.000E+12 0.000 -01000.0 !11 md8o2+me2j=md8o+me2o 7.000E+12 0.000 -01000.0 !11 md7o2+me2j=md7o+me2o 7.000E+12 0.000 -01000.0 !11 md6o2+me2j=md6o+me2o 7.000E+12 0.000 -01000.0 !11 md5o2+me2j=md5o+me2o 7.000E+12 0.000 -01000.0 !11 md4o2+me2j=md4o+me2o 7.000E+12 0.000 -01000.0 !11 md3o2+me2j=md3o+me2o 7.000E+12 0.000 -01000.0 !11 md2o2+me2j=md2o+me2o 7.000E+12 0.000 -01000.0 !11 mdmo2+me2j=mdmo+me2o 7.000E+12 0.000 -01000.0 !11 ! md10o2+ch3=md10o+ch3o 7.000E+12 0.000 -01000.0 !11 md9o2+ch3=md9o+ch3o 7.000E+12 0.000 -01000.0 !11 md8o2+ch3=md8o+ch3o 7.000E+12 0.000 -01000.0 !11 md7o2+ch3=md7o+ch3o 7.000E+12 0.000 -01000.0 !11 md6o2+ch3=md6o+ch3o 7.000E+12 0.000 -01000.0 !11 md5o2+ch3=md5o+ch3o 7.000E+12 0.000 -01000.0 !11 md4o2+ch3=md4o+ch3o 7.000E+12 0.000 -01000.0 !11 md3o2+ch3=md3o+ch3o 7.000E+12 0.000 -01000.0 !11 md2o2+ch3=md2o+ch3o 7.000E+12 0.000 -01000.0 !11 mdmo2+ch3=mdmo+ch3o 7.000E+12 0.000 -01000.0 !11 ! md10o2+c2h5=md10o+c2h5o 7.000E+12 0.000 -01000.0 !11 md9o2+c2h5=md9o+c2h5o 7.000E+12 0.000 -01000.0 !11 md8o2+c2h5=md8o+c2h5o 7.000E+12 0.000 -01000.0 !11 md7o2+c2h5=md7o+c2h5o 7.000E+12 0.000 -01000.0 !11 md6o2+c2h5=md6o+c2h5o 7.000E+12 0.000 -01000.0 !11 md5o2+c2h5=md5o+c2h5o 7.000E+12 0.000 -01000.0 !11 md4o2+c2h5=md4o+c2h5o 7.000E+12 0.000 -01000.0 !11 md3o2+c2h5=md3o+c2h5o 7.000E+12 0.000 -01000.0 !11 md2o2+c2h5=md2o+c2h5o 7.000E+12 0.000 -01000.0 !11 mdmo2+c2h5=mdmo+c2h5o 7.000E+12 0.000 -01000.0 !11 ! md10o2+nc3h7=md10o+nc3h7o 7.000E+12 0.000 -01000.0 !11 md9o2+nc3h7=md9o+nc3h7o 7.000E+12 0.000 -01000.0 !11 md8o2+nc3h7=md8o+nc3h7o 7.000E+12 0.000 -01000.0 !11 md7o2+nc3h7=md7o+nc3h7o 7.000E+12 0.000 -01000.0 !11 md6o2+nc3h7=md6o+nc3h7o 7.000E+12 0.000 -01000.0 !11 md5o2+nc3h7=md5o+nc3h7o 7.000E+12 0.000 -01000.0 !11 md4o2+nc3h7=md4o+nc3h7o 7.000E+12 0.000 -01000.0 !11 md3o2+nc3h7=md3o+nc3h7o 7.000E+12 0.000 -01000.0 !11 md2o2+nc3h7=md2o+nc3h7o 7.000E+12 0.000 -01000.0 !11 mdmo2+nc3h7=mdmo+nc3h7o 7.000E+12 0.000 -01000.0 !11 ! md10o2+pc4h9=md10o+pc4h9o 7.000E+12 0.000 -01000.0 !11 md9o2+pc4h9=md9o+pc4h9o 7.000E+12 0.000 -01000.0 !11 md8o2+pc4h9=md8o+pc4h9o 7.000E+12 0.000 -01000.0 !11 md7o2+pc4h9=md7o+pc4h9o 7.000E+12 0.000 -01000.0 !11 md6o2+pc4h9=md6o+pc4h9o 7.000E+12 0.000 -01000.0 !11 md5o2+pc4h9=md5o+pc4h9o 7.000E+12 0.000 -01000.0 !11 md4o2+pc4h9=md4o+pc4h9o 7.000E+12 0.000 -01000.0 !11 md3o2+pc4h9=md3o+pc4h9o 7.000E+12 0.000 -01000.0 !11 md2o2+pc4h9=md2o+pc4h9o 7.000E+12 0.000 -01000.0 !11 mdmo2+pc4h9=mdmo+pc4h9o 7.000E+12 0.000 -01000.0 !11 ! md10o2+c5h11-1=md10o+c5h11o-1 7.000E+12 0.000 -01000.0 !11 md9o2+c5h11-1=md9o+c5h11o-1 7.000E+12 0.000 -01000.0 !11 md8o2+c5h11-1=md8o+c5h11o-1 7.000E+12 0.000 -01000.0 !11 md7o2+c5h11-1=md7o+c5h11o-1 7.000E+12 0.000 -01000.0 !11 md6o2+c5h11-1=md6o+c5h11o-1 7.000E+12 0.000 -01000.0 !11 md5o2+c5h11-1=md5o+c5h11o-1 7.000E+12 0.000 -01000.0 !11 md4o2+c5h11-1=md4o+c5h11o-1 7.000E+12 0.000 -01000.0 !11 md3o2+c5h11-1=md3o+c5h11o-1 7.000E+12 0.000 -01000.0 !11 md2o2+c5h11-1=md2o+c5h11o-1 7.000E+12 0.000 -01000.0 !11 mdmo2+c5h11-1=mdmo+c5h11o-1 7.000E+12 0.000 -01000.0 !11 ! md10o2+c6h13-1=md10o+c6h13o-1 7.000E+12 0.000 -01000.0 !11 md9o2+c6h13-1=md9o+c6h13o-1 7.000E+12 0.000 -01000.0 !11 md8o2+c6h13-1=md8o+c6h13o-1 7.000E+12 0.000 -01000.0 !11 md7o2+c6h13-1=md7o+c6h13o-1 7.000E+12 0.000 -01000.0 !11 md6o2+c6h13-1=md6o+c6h13o-1 7.000E+12 0.000 -01000.0 !11 md5o2+c6h13-1=md5o+c6h13o-1 7.000E+12 0.000 -01000.0 !11 md4o2+c6h13-1=md4o+c6h13o-1 7.000E+12 0.000 -01000.0 !11 md3o2+c6h13-1=md3o+c6h13o-1 7.000E+12 0.000 -01000.0 !11 md2o2+c6h13-1=md2o+c6h13o-1 7.000E+12 0.000 -01000.0 !11 mdmo2+c6h13-1=mdmo+c6h13o-1 7.000E+12 0.000 -01000.0 !11 ! md10o2+c7h15-1=md10o+c7h15o-1 7.000E+12 0.000 -01000.0 !11 md9o2+c7h15-1=md9o+c7h15o-1 7.000E+12 0.000 -01000.0 !11 md8o2+c7h15-1=md8o+c7h15o-1 7.000E+12 0.000 -01000.0 !11 md7o2+c7h15-1=md7o+c7h15o-1 7.000E+12 0.000 -01000.0 !11 md6o2+c7h15-1=md6o+c7h15o-1 7.000E+12 0.000 -01000.0 !11 md5o2+c7h15-1=md5o+c7h15o-1 7.000E+12 0.000 -01000.0 !11 md4o2+c7h15-1=md4o+c7h15o-1 7.000E+12 0.000 -01000.0 !11 md3o2+c7h15-1=md3o+c7h15o-1 7.000E+12 0.000 -01000.0 !11 md2o2+c7h15-1=md2o+c7h15o-1 7.000E+12 0.000 -01000.0 !11 mdmo2+c7h15-1=mdmo+c7h15o-1 7.000E+12 0.000 -01000.0 !11 ! md10o2+c8h17-1=md10o+c8h17o-1 7.000E+12 0.000 -01000.0 !11 md9o2+c8h17-1=md9o+c8h17o-1 7.000E+12 0.000 -01000.0 !11 md8o2+c8h17-1=md8o+c8h17o-1 7.000E+12 0.000 -01000.0 !11 md7o2+c8h17-1=md7o+c8h17o-1 7.000E+12 0.000 -01000.0 !11 md6o2+c8h17-1=md6o+c8h17o-1 7.000E+12 0.000 -01000.0 !11 md5o2+c8h17-1=md5o+c8h17o-1 7.000E+12 0.000 -01000.0 !11 md4o2+c8h17-1=md4o+c8h17o-1 7.000E+12 0.000 -01000.0 !11 md3o2+c8h17-1=md3o+c8h17o-1 7.000E+12 0.000 -01000.0 !11 md2o2+c8h17-1=md2o+c8h17o-1 7.000E+12 0.000 -01000.0 !11 mdmo2+c8h17-1=mdmo+c8h17o-1 7.000E+12 0.000 -01000.0 !11 ! md10o2+c9h19-1=md10o+c9h19o-1 7.000E+12 0.000 -01000.0 !11 md9o2+c9h19-1=md9o+c9h19o-1 7.000E+12 0.000 -01000.0 !11 md8o2+c9h19-1=md8o+c9h19o-1 7.000E+12 0.000 -01000.0 !11 md7o2+c9h19-1=md7o+c9h19o-1 7.000E+12 0.000 -01000.0 !11 md6o2+c9h19-1=md6o+c9h19o-1 7.000E+12 0.000 -01000.0 !11 md5o2+c9h19-1=md5o+c9h19o-1 7.000E+12 0.000 -01000.0 !11 md4o2+c9h19-1=md4o+c9h19o-1 7.000E+12 0.000 -01000.0 !11 md3o2+c9h19-1=md3o+c9h19o-1 7.000E+12 0.000 -01000.0 !11 md2o2+c9h19-1=md2o+c9h19o-1 7.000E+12 0.000 -01000.0 !11 mdmo2+c9h19-1=mdmo+c9h19o-1 7.000E+12 0.000 -01000.0 !11 ! ! ! !!!!!!!!!!!!!!! ! 11b/R+H ! !!!!!!!!!!!!!!! ! !written for some ROO radicals and carboxyl radicals (carboxylic acids observed experimentally) ! md10o2+h=md10ooh 1.000E+14 0.000 00000.0 !11b md9o2+h=md9ooh 1.000E+14 0.000 00000.0 !11b md8o2+h=md8ooh 1.000E+14 0.000 00000.0 !11b md7o2+h=md7ooh 1.000E+14 0.000 00000.0 !11b md6o2+h=md6ooh 1.000E+14 0.000 00000.0 !11b md5o2+h=md5ooh 1.000E+14 0.000 00000.0 !11b md4o2+h=md4ooh 1.000E+14 0.000 00000.0 !11b md3o2+h=md3ooh 1.000E+14 0.000 00000.0 !11b md2o2+h=md2ooh 1.000E+14 0.000 00000.0 !11b mdmo2+h=mdmooh 1.000E+14 0.000 00000.0 !11b ! eaoj+h=ea 1.000E+14 0.000 00000.0 !11b paoj+h=pa 1.000E+14 0.000 00000.0 !11b baoj+h=ba 1.000E+14 0.000 00000.0 !11b faoj+h=fa 1.000E+14 0.000 00000.0 !11b haoj+h=ha 1.000E+14 0.000 00000.0 !11b saoj+h=sa 1.000E+14 0.000 00000.0 !11b oaoj+h=oa 1.000E+14 0.000 00000.0 !11b naoj+h=na 1.000E+14 0.000 00000.0 !11b daoj+h=da 1.000E+14 0.000 00000.0 !11b ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 12-I/ro2 isomerization to qooh ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! c9h19o2-1=c9h18ooh1-2 2.000e+11 0.000 26850.0 !12-I 5s c9h19o2-1=c9h18ooh1-3 2.500e+10 0.000 20850.0 !12-I 6s c9h19o2-1=c9h18ooh1-4 3.125e+09 0.000 19050.0 !12-I 7s c9h19o2-1=c9h18ooh1-5 3.912e+08 0.000 22050.0 !12-I 8s c9h19o2-2=c9h18ooh2-1 3.000e+11 0.000 29400.0 !12-I 5p c9h19o2-2=c9h18ooh2-3 2.000e+11 0.000 26850.0 !12-I 5s c9h19o2-2=c9h18ooh2-4 2.500e+10 0.000 20850.0 !12-I 6s c9h19o2-2=c9h18ooh2-5 3.125e+09 0.000 19050.0 !12-I 7s c9h19o2-2=c9h18ooh2-6 3.912e+08 0.000 22050.0 !12-I 8s c9h19o2-3=c9h18ooh3-1 3.750e+10 0.000 24400.0 !12-I 6p c9h19o2-3=c9h18ooh3-2 2.000e+11 0.000 26850.0 !12-I 5s c9h19o2-3=c9h18ooh3-4 2.000e+11 0.000 26850.0 !12-I 5s c9h19o2-3=c9h18ooh3-5 2.500e+10 0.000 20850.0 !12-I 6s c9h19o2-3=c9h18ooh3-6 3.125e+09 0.000 19050.0 !12-I 7s c9h19o2-3=c9h18ooh3-7 3.912e+08 0.000 22050.0 !12-I 8s c9h19o2-4=c9h18ooh4-1 9.376e+09 0.000 22350.0 !12-I 7p c9h19o2-4=c9h18ooh4-2 2.500e+10 0.000 20850.0 !12-I 6s c9h19o2-4=c9h18ooh4-3 2.000e+11 0.000 26850.0 !12-I 5s c9h19o2-4=c9h18ooh4-5 2.000e+11 0.000 26850.0 !12-I 5s c9h19o2-4=c9h18ooh4-6 2.500e+10 0.000 20850.0 !12-I 6s c9h19o2-4=c9h18ooh4-7 3.125e+09 0.000 19050.0 !12-I 7s c9h19o2-4=c9h18ooh4-8 3.912e+08 0.000 22050.0 !12-I 8s c9h19o2-5=c9h18ooh5-1 1.172e+09 0.000 25550.0 !12-I 8p c9h19o2-5=c9h18ooh5-2 6.250e+09 0.000 19050.0 !12-I 7s c9h19o2-5=c9h18ooh5-3 5.000e+10 0.000 20850.0 !12-I 6s c9h19o2-5=c9h18ooh5-4 4.000e+11 0.000 26850.0 !12-I 5s ! c8h17o2-1=c8h16ooh1-2 2.000e+11 0.000 26850.0 !12-I 5s c8h17o2-1=c8h16ooh1-3 2.500e+10 0.000 20850.0 !12-I 6s c8h17o2-1=c8h16ooh1-4 3.125e+09 0.000 19050.0 !12-I 7s c8h17o2-1=c8h16ooh1-5 3.912e+08 0.000 22050.0 !12-I 8s c8h17o2-2=c8h16ooh2-1 3.000e+11 0.000 29400.0 !12-I 5p c8h17o2-2=c8h16ooh2-3 2.000e+11 0.000 26850.0 !12-I 5s c8h17o2-2=c8h16ooh2-4 2.500e+10 0.000 20850.0 !12-I 6s c8h17o2-2=c8h16ooh2-5 3.125e+09 0.000 19050.0 !12-I 7s c8h17o2-2=c8h16ooh2-6 3.912e+08 0.000 22050.0 !12-I 8s c8h17o2-3=c8h16ooh3-1 3.750e+10 0.000 24400.0 !12-I 6p c8h17o2-3=c8h16ooh3-2 2.000e+11 0.000 26850.0 !12-I 5s c8h17o2-3=c8h16ooh3-4 2.000e+11 0.000 26850.0 !12-I 5s c8h17o2-3=c8h16ooh3-5 2.500e+10 0.000 20850.0 !12-I 6s c8h17o2-3=c8h16ooh3-6 3.125e+09 0.000 19050.0 !12-I 7s c8h17o2-3=c8h16ooh3-7 3.912e+08 0.000 22050.0 !12-I 8s c8h17o2-4=c8h16ooh4-1 9.376e+09 0.000 22350.0 !12-I 7p c8h17o2-4=c8h16ooh4-2 2.500e+10 0.000 20850.0 !12-I 6s c8h17o2-4=c8h16ooh4-3 2.000e+11 0.000 26850.0 !12-I 5s c8h17o2-4=c8h16ooh4-5 2.000e+11 0.000 26850.0 !12-I 5s c8h17o2-4=c8h16ooh4-6 2.500e+10 0.000 20850.0 !12-I 6s c8h17o2-4=c8h16ooh4-7 3.125e+09 0.000 19050.0 !12-I 7s c8h17o2-4=c8h16ooh4-8 5.860e+08 0.000 25550.0 !12-I 8p ! !c7h15o2-1=c7h14ooh1-2 2.000e+11 0.000 26850.0 !12-I 5s !c7h15o2-1=c7h14ooh1-3 2.500e+10 0.000 20850.0 !12-I 6s !c7h15o2-1=c7h14ooh1-4 3.125e+09 0.000 19050.0 !12-I 7s !c7h15o2-1=c7h14ooh1-5 3.912e+08 0.000 22050.0 !12-I 8s !c7h15o2-2=c7h14ooh2-1 3.000e+11 0.000 29400.0 !12-I 5p !c7h15o2-2=c7h14ooh2-3 2.000e+11 0.000 26850.0 !12-I 5s !c7h15o2-2=c7h14ooh2-4 2.500e+10 0.000 20850.0 !12-I 6s !c7h15o2-2=c7h14ooh2-5 3.125e+09 0.000 19050.0 !12-I 7s !c7h15o2-2=c7h14ooh2-6 3.912e+08 0.000 22050.0 !12-I 8s !c7h15o2-3=c7h14ooh3-1 3.750e+10 0.000 24400.0 !12-I 6p !c7h15o2-3=c7h14ooh3-2 2.000e+11 0.000 26850.0 !12-I 5s !c7h15o2-3=c7h14ooh3-4 2.000e+11 0.000 26850.0 !12-I 5s !c7h15o2-3=c7h14ooh3-5 2.500e+10 0.000 20850.0 !12-I 6s !c7h15o2-3=c7h14ooh3-6 3.125e+09 0.000 19050.0 !12-I 7s !c7h15o2-3=c7h14ooh3-7 5.860e+08 0.000 25550.0 !12-I 8p !c7h15o2-4=c7h14ooh4-1 9.376e+09 0.000 22350.0 !12-I 7p !c7h15o2-4=c7h14ooh4-2 5.000e+10 0.000 20850.0 !12-I 6s !c7h15o2-4=c7h14ooh4-3 4.000e+11 0.000 26850.0 !12-I 5s ! !c6h13o2-1=c6h12ooh1-2 2.000e+11 0.000 26850.0 !12-I 5s !c6h13o2-1=c6h12ooh1-3 2.500e+10 0.000 20850.0 !12-I 6s !c6h13o2-1=c6h12ooh1-4 3.125e+09 0.000 19050.0 !12-I 7s !c6h13o2-1=c6h12ooh1-5 3.912e+08 0.000 22050.0 !12-I 8s !c6h13o2-2=c6h12ooh2-1 3.000e+11 0.000 29400.0 !12-I 5p !c6h13o2-2=c6h12ooh2-3 2.000e+11 0.000 26850.0 !12-I 5s !c6h13o2-2=c6h12ooh2-4 2.500e+10 0.000 20850.0 !12-I 6s !c6h13o2-2=c6h12ooh2-5 3.125e+09 0.000 19050.0 !12-I 7s !c6h13o2-2=c6h12ooh2-6 5.860e+08 0.000 25550.0 !12-I 8p !c6h13o2-3=c6h12ooh3-1 3.750e+10 0.000 24400.0 !12-I 6p !c6h13o2-3=c6h12ooh3-2 2.000e+11 0.000 26850.0 !12-I 5s !c6h13o2-3=c6h12ooh3-4 2.000e+11 0.000 26850.0 !12-I 5s !c6h13o2-3=c6h12ooh3-5 2.500e+10 0.000 20850.0 !12-I 6s !c6h13o2-3=c6h12ooh3-6 4.688e+09 0.000 22350.0 !12-I 7p ! !c5h11o2-1=c5h10ooh1-2 2.000e+11 0.000 26850.0 !12-I 5s !c5h11o2-1=c5h10ooh1-3 2.500e+10 0.000 20850.0 !12-I 6s !c5h11o2-1=c5h10ooh1-4 3.125e+09 0.000 19050.0 !12-I 7s !c5h11o2-1=c5h10ooh1-5 5.860e+08 0.000 25550.0 !12-I 8p !c5h11o2-2=c5h10ooh2-1 3.000e+11 0.000 29400.0 !12-I 5p !c5h11o2-2=c5h10ooh2-3 2.000e+11 0.000 26850.0 !12-I 5s !c5h11o2-2=c5h10ooh2-4 2.500e+10 0.000 20850.0 !12-I 6s !c5h11o2-2=c5h10ooh2-5 4.688e+09 0.000 22350.0 !12-I 7p !c5h11o2-3=c5h10ooh3-1 7.500e+10 0.000 24400.0 !12-I 6p !c5h11o2-3=c5h10ooh3-2 4.000e+11 0.000 26850.0 !12-I 5s ! !pc4h9o2=c4h8ooh1-2 2.000e+11 0.000 26850.0 !12-I 5s !pc4h9o2=c4h8ooh1-3 2.500e+10 0.000 20850.0 !12-I 6s !pc4h9o2=c4h8ooh1-4 4.688e+09 0.000 22350.0 !12-I 7p !sc4h9o2=c4h8ooh2-1 3.000e+11 0.000 29400.0 !12-I 5p !sc4h9o2=c4h8ooh2-3 2.000e+11 0.000 26850.0 !12-I 5s !sc4h9o2=c4h8ooh2-4 3.750e+10 0.000 24400.0 !12-I 6p ! ! memo2=memooh2j 9.376e+09 0.000 22350.0 !12-I 7p me2o2=me2oohmj 9.376e+09 0.000 22350.0 !12-I 7p ! mpmo2=mpmooh2j 3.125e+09 0.000 19050.0 !12-I 7s mpmo2=mpmooh3j 1.172e+09 0.000 25550.0 !12-I 8p mp2o2=mp2oohmj 9.376e+09 0.000 22350.0 !12-I 7p mp2o2=mp2ooh3j 3.000e+11 0.000 29400.0 !12-I 5p mp3o2=mp3oohmj 1.172e+09 0.000 25550.0 !12-I 8p mp3o2=mp3ooh2j 2.000e+11 0.000 26850.0 !12-I 5s ! mbmo2=mbmooh2j 3.125e+09 0.000 19050.0 !12-I 7s mbmo2=mbmooh3j 3.912e+08 0.000 22050.0 !12-I 8s mb2o2=mb2oohmj 9.376e+09 0.000 22350.0 !12-I 7p mb2o2=mb2ooh3j 2.000e+11 0.000 26850.0 !12-I 5s mb2o2=mb2ooh4j 3.750e+10 0.000 24400.0 !12-I 6p mb3o2=mb3oohmj 1.172e+09 0.000 25550.0 !12-I 8p mb3o2=mb3ooh2j 2.000e+11 0.000 26850.0 !12-I 5s mb3o2=mb3ooh4j 3.000e+11 0.000 29400.0 !12-I 5p mb4o2=mb4ooh3j 2.000e+11 0.000 26850.0 !12-I 5s mb4o2=mb4ooh2j 2.500e+10 0.000 20850.0 !12-I 6s ! mfmo2=mfmooh2j 3.125e+09 0.000 19050.0 !12-I 7s mfmo2=mfmooh3j 3.912e+08 0.000 22050.0 !12-I 8s mf2o2=mf2oohmj 9.376e+09 0.000 22350.0 !12-I 7p mf2o2=mf2ooh3j 2.000e+11 0.000 26850.0 !12-I 5s mf2o2=mf2ooh4j 2.500e+10 0.000 20850.0 !12-I 6s mf2o2=mf2ooh5j 9.376e+09 0.000 22350.0 !12-I 7p mf3o2=mf3oohmj 1.172e+09 0.000 25550.0 !12-I 8p mf3o2=mf3ooh2j 2.000e+11 0.000 26850.0 !12-I 5s mf3o2=mf3ooh4j 2.000e+11 0.000 26850.0 !12-I 5s mf3o2=mf3ooh5j 3.750e+10 0.000 24400.0 !12-I 6p mf4o2=mf4ooh3j 2.000e+11 0.000 26850.0 !12-I 5s mf4o2=mf4ooh2j 2.500e+10 0.000 20850.0 !12-I 6s mf4o2=mf4ooh5j 3.000e+11 0.000 29400.0 !12-I 5p mf5o2=mf5ooh4j 2.000e+11 0.000 26850.0 !12-I 5s mf5o2=mf5ooh3j 2.500e+10 0.000 20850.0 !12-I 6s mf5o2=mf5ooh2j 3.125e+09 0.000 19050.0 !12-I 7s ! mhmo2=mhmooh2j 3.125e+09 0.000 19050.0 !12-I 7s mhmo2=mhmooh3j 3.912e+08 0.000 22050.0 !12-I 8s mh2o2=mh2oohmj 9.376e+09 0.000 22350.0 !12-I 7p mh2o2=mh2ooh3j 2.000e+11 0.000 26850.0 !12-I 5s mh2o2=mh2ooh4j 2.500e+10 0.000 20850.0 !12-I 6s mh2o2=mh2ooh5j 3.125e+09 0.000 19050.0 !12-I 7s mh2o2=mh2ooh6j 1.172e+09 0.000 25550.0 !12-I 8p mh3o2=mh3oohmj 1.172e+09 0.000 25550.0 !12-I 8p mh3o2=mh3ooh2j 2.000e+11 0.000 26850.0 !12-I 5s mh3o2=mh3ooh4j 2.000e+11 0.000 26850.0 !12-I 5s mh3o2=mh3ooh5j 2.500e+10 0.000 20850.0 !12-I 6s mh3o2=mh3ooh6j 9.376e+09 0.000 22350.0 !12-I 7p mh4o2=mh4ooh3j 2.000e+11 0.000 26850.0 !12-I 5s mh4o2=mh4ooh2j 2.500e+10 0.000 20850.0 !12-I 6s mh4o2=mh4ooh5j 2.000e+11 0.000 26850.0 !12-I 5s mh4o2=mh4ooh6j 3.750e+10 0.000 24400.0 !12-I 6p mh5o2=mh5ooh4j 2.000e+11 0.000 26850.0 !12-I 5s mh5o2=mh5ooh3j 2.500e+10 0.000 20850.0 !12-I 6s mh5o2=mh5ooh2j 3.125e+09 0.000 19050.0 !12-I 7s mh5o2=mh5ooh6j 3.000e+11 0.000 29400.0 !12-I 5p mh6o2=mh6ooh5j 2.000e+11 0.000 26850.0 !12-I 5s mh6o2=mh6ooh4j 2.500e+10 0.000 20850.0 !12-I 6s mh6o2=mh6ooh3j 3.125e+09 0.000 19050.0 !12-I 7s mh6o2=mh6ooh2j 3.912e+08 0.000 22050.0 !12-I 8s ! msmo2=msmooh2j 3.125e+09 0.000 19050.0 !12-I 7s msmo2=msmooh3j 3.912e+08 0.000 22050.0 !12-I 8s ms2o2=ms2oohmj 9.376e+09 0.000 22350.0 !12-I 7p ms2o2=ms2ooh3j 2.000e+11 0.000 26850.0 !12-I 5s ms2o2=ms2ooh4j 2.500e+10 0.000 20850.0 !12-I 6s ms2o2=ms2ooh5j 3.125e+09 0.000 19050.0 !12-I 7s ms2o2=ms2ooh6j 3.912e+08 0.000 22050.0 !12-I 8s ms3o2=ms3oohmj 1.172e+09 0.000 25550.0 !12-I 8p ms3o2=ms3ooh2j 2.000e+11 0.000 26850.0 !12-I 5s ms3o2=ms3ooh4j 2.000e+11 0.000 26850.0 !12-I 5s ms3o2=ms3ooh5j 2.500e+10 0.000 20850.0 !12-I 6s ms3o2=ms3ooh6j 3.125e+09 0.000 19050.0 !12-I 7s ms3o2=ms3ooh7j 1.172e+09 0.000 25550.0 !12-I 8p ms4o2=ms4ooh3j 2.000e+11 0.000 26850.0 !12-I 5s ms4o2=ms4ooh2j 2.500e+10 0.000 20850.0 !12-I 6s ms4o2=ms4ooh5j 2.000e+11 0.000 26850.0 !12-I 5s ms4o2=ms4ooh6j 2.500e+10 0.000 20850.0 !12-I 6s ms4o2=ms4ooh7j 9.376e+09 0.000 22350.0 !12-I 7p ms5o2=ms5ooh4j 2.000e+11 0.000 26850.0 !12-I 5s ms5o2=ms5ooh3j 2.500e+10 0.000 20850.0 !12-I 6s ms5o2=ms5ooh2j 3.125e+09 0.000 19050.0 !12-I 7s ms5o2=ms5ooh6j 2.000e+11 0.000 26850.0 !12-I 5s ms5o2=ms5ooh7j 3.750e+10 0.000 24400.0 !12-I 6p ms6o2=ms6ooh5j 2.000e+11 0.000 26850.0 !12-I 5s ms6o2=ms6ooh4j 2.500e+10 0.000 20850.0 !12-I 6s ms6o2=ms6ooh3j 3.125e+09 0.000 19050.0 !12-I 7s ms6o2=ms6ooh2j 3.912e+08 0.000 22050.0 !12-I 8s ms6o2=ms6ooh7j 3.000e+11 0.000 29400.0 !12-I 5p ms7o2=ms7ooh6j 2.000e+11 0.000 26850.0 !12-I 5s ms7o2=ms7ooh5j 2.500e+10 0.000 20850.0 !12-I 6s ms7o2=ms7ooh4j 3.125e+09 0.000 19050.0 !12-I 7s ms7o2=ms7ooh3j 3.912e+08 0.000 22050.0 !12-I 8s ! mamo2=mamooh2j 3.125e+09 0.000 19050.0 !12-I 7s mamo2=mamooh3j 3.912e+08 0.000 22050.0 !12-I 8s mo2o2=mo2oohmj 9.376e+09 0.000 22350.0 !12-I 7p mo2o2=mo2ooh3j 2.000e+11 0.000 26850.0 !12-I 5s mo2o2=mo2ooh4j 2.500e+10 0.000 20850.0 !12-I 6s mo2o2=mo2ooh5j 3.125e+09 0.000 19050.0 !12-I 7s mo2o2=mo2ooh6j 3.912e+08 0.000 22050.0 !12-I 8s mo3o2=mo3oohmj 1.172e+09 0.000 25550.0 !12-I 8p mo3o2=mo3ooh2j 2.000e+11 0.000 26850.0 !12-I 5s mo3o2=mo3ooh4j 2.000e+11 0.000 26850.0 !12-I 5s mo3o2=mo3ooh5j 2.500e+10 0.000 20850.0 !12-I 6s mo3o2=mo3ooh6j 3.125e+09 0.000 19050.0 !12-I 7s mo3o2=mo3ooh7j 3.912e+08 0.000 22050.0 !12-I 8s mo4o2=mo4ooh3j 2.000e+11 0.000 26850.0 !12-I 5s mo4o2=mo4ooh2j 2.500e+10 0.000 20850.0 !12-I 6s mo4o2=mo4ooh5j 2.000e+11 0.000 26850.0 !12-I 5s mo4o2=mo4ooh6j 2.500e+10 0.000 20850.0 !12-I 6s mo4o2=mo4ooh7j 3.125e+09 0.000 19050.0 !12-I 7s mo4o2=mo4ooh8j 1.172e+09 0.000 25550.0 !12-I 8p mo5o2=mo5ooh4j 2.000e+11 0.000 26850.0 !12-I 5s mo5o2=mo5ooh3j 2.500e+10 0.000 20850.0 !12-I 6s mo5o2=mo5ooh2j 3.125e+09 0.000 19050.0 !12-I 7s mo5o2=mo5ooh6j 2.000e+11 0.000 26850.0 !12-I 5s mo5o2=mo5ooh7j 2.500e+10 0.000 20850.0 !12-I 6s mo5o2=mo5ooh8j 9.376e+09 0.000 22350.0 !12-I 7p mo6o2=mo6ooh5j 2.000e+11 0.000 26850.0 !12-I 5s mo6o2=mo6ooh4j 2.500e+10 0.000 20850.0 !12-I 6s mo6o2=mo6ooh3j 3.125e+09 0.000 19050.0 !12-I 7s mo6o2=mo6ooh2j 3.912e+08 0.000 22050.0 !12-I 8s mo6o2=mo6ooh7j 2.000e+11 0.000 26850.0 !12-I 5s mo6o2=mo6ooh8j 3.750e+10 0.000 24400.0 !12-I 6p mo7o2=mo7ooh6j 2.000e+11 0.000 26850.0 !12-I 5s mo7o2=mo7ooh5j 2.500e+10 0.000 20850.0 !12-I 6s mo7o2=mo7ooh4j 3.125e+09 0.000 19050.0 !12-I 7s mo7o2=mo7ooh3j 3.912e+08 0.000 22050.0 !12-I 8s mo7o2=mo7ooh8j 3.000e+11 0.000 29400.0 !12-I 5p mo8o2=mo8ooh7j 2.000e+11 0.000 26850.0 !12-I 5s mo8o2=mo8ooh6j 2.500e+10 0.000 20850.0 !12-I 6s mo8o2=mo8ooh5j 3.125e+09 0.000 19050.0 !12-I 7s mo8o2=mo8ooh4j 3.912e+08 0.000 22050.0 !12-I 8s ! mnmo2=mnmooh2j 3.125e+09 0.000 19050.0 !12-I 7s mnmo2=mnmooh3j 3.912e+08 0.000 22050.0 !12-I 8s mn2o2=mn2oohmj 9.376e+09 0.000 22350.0 !12-I 7p mn2o2=mn2ooh3j 2.000e+11 0.000 26850.0 !12-I 5s mn2o2=mn2ooh4j 2.500e+10 0.000 20850.0 !12-I 6s mn2o2=mn2ooh5j 3.125e+09 0.000 19050.0 !12-I 7s mn2o2=mn2ooh6j 3.912e+08 0.000 22050.0 !12-I 8s mn3o2=mn3oohmj 1.172e+09 0.000 25550.0 !12-I 8p mn3o2=mn3ooh2j 2.000e+11 0.000 26850.0 !12-I 5s mn3o2=mn3ooh4j 2.000e+11 0.000 26850.0 !12-I 5s mn3o2=mn3ooh5j 2.500e+10 0.000 20850.0 !12-I 6s mn3o2=mn3ooh6j 3.125e+09 0.000 19050.0 !12-I 7s mn3o2=mn3ooh7j 3.912e+08 0.000 22050.0 !12-I 8s mn4o2=mn4ooh3j 2.000e+11 0.000 26850.0 !12-I 5s mn4o2=mn4ooh2j 2.500e+10 0.000 20850.0 !12-I 6s mn4o2=mn4ooh5j 2.000e+11 0.000 26850.0 !12-I 5s mn4o2=mn4ooh6j 2.500e+10 0.000 20850.0 !12-I 6s mn4o2=mn4ooh7j 3.125e+09 0.000 19050.0 !12-I 7s mn4o2=mn4ooh8j 3.912e+08 0.000 22050.0 !12-I 8s mn5o2=mn5ooh4j 2.000e+11 0.000 26850.0 !12-I 5s mn5o2=mn5ooh3j 2.500e+10 0.000 20850.0 !12-I 6s mn5o2=mn5ooh2j 3.125e+09 0.000 19050.0 !12-I 7s mn5o2=mn5ooh6j 2.000e+11 0.000 26850.0 !12-I 5s mn5o2=mn5ooh7j 2.500e+10 0.000 20850.0 !12-I 6s mn5o2=mn5ooh8j 3.125e+09 0.000 19050.0 !12-I 7s mn5o2=mn5ooh9j 1.172e+09 0.000 25550.0 !12-I 8p mn6o2=mn6ooh5j 2.000e+11 0.000 26850.0 !12-I 5s mn6o2=mn6ooh4j 2.500e+10 0.000 20850.0 !12-I 6s mn6o2=mn6ooh3j 3.125e+09 0.000 19050.0 !12-I 7s mn6o2=mn6ooh2j 3.912e+08 0.000 22050.0 !12-I 8s mn6o2=mn6ooh7j 2.000e+11 0.000 26850.0 !12-I 5s mn6o2=mn6ooh8j 2.500e+10 0.000 20850.0 !12-I 6s mn6o2=mn6ooh9j 9.376e+09 0.000 22350.0 !12-I 7p mn7o2=mn7ooh6j 2.000e+11 0.000 26850.0 !12-I 5s mn7o2=mn7ooh5j 2.500e+10 0.000 20850.0 !12-I 6s mn7o2=mn7ooh4j 3.125e+09 0.000 19050.0 !12-I 7s mn7o2=mn7ooh3j 3.912e+08 0.000 22050.0 !12-I 8s mn7o2=mn7ooh8j 2.000e+11 0.000 26850.0 !12-I 5s mn7o2=mn7ooh9j 3.750e+10 0.000 24400.0 !12-I 6p mn8o2=mn8ooh7j 2.000e+11 0.000 26850.0 !12-I 5s mn8o2=mn8ooh6j 2.500e+10 0.000 20850.0 !12-I 6s mn8o2=mn8ooh5j 3.125e+09 0.000 19050.0 !12-I 7s mn8o2=mn8ooh4j 3.912e+08 0.000 22050.0 !12-I 8s mn8o2=mn8ooh9j 3.000e+11 0.000 29400.0 !12-I 5p mn9o2=mn9ooh8j 2.000e+11 0.000 26850.0 !12-I 5s mn9o2=mn9ooh7j 2.500e+10 0.000 20850.0 !12-I 6s mn9o2=mn9ooh6j 3.125e+09 0.000 19050.0 !12-I 7s mn9o2=mn9ooh5j 3.912e+08 0.000 22050.0 !12-I 8s ! mdmo2=mdmooh2j 3.125e+09 0.000 19050.0 !12-I 7s mdmo2=mdmooh3j 3.912e+08 0.000 22050.0 !12-I 8s md2o2=md2oohmj 9.376e+09 0.000 22350.0 !12-I 7p md2o2=md2ooh3j 2.000e+11 0.000 26850.0 !12-I 5s md2o2=md2ooh4j 2.500e+10 0.000 20850.0 !12-I 6s md2o2=md2ooh5j 3.125e+09 0.000 19050.0 !12-I 7s md2o2=md2ooh6j 3.912e+08 0.000 22050.0 !12-I 8s md3o2=md3oohmj 1.172e+09 0.000 25550.0 !12-I 8p md3o2=md3ooh2j 2.000e+11 0.000 26850.0 !12-I 5s md3o2=md3ooh4j 2.000e+11 0.000 26850.0 !12-I 5s md3o2=md3ooh5j 2.500e+10 0.000 20850.0 !12-I 6s md3o2=md3ooh6j 3.125e+09 0.000 19050.0 !12-I 7s md3o2=md3ooh7j 3.912e+08 0.000 22050.0 !12-I 8s md4o2=md4ooh3j 2.000e+11 0.000 26850.0 !12-I 5s md4o2=md4ooh2j 2.500e+10 0.000 20850.0 !12-I 6s md4o2=md4ooh5j 2.000e+11 0.000 26850.0 !12-I 5s md4o2=md4ooh6j 2.500e+10 0.000 20850.0 !12-I 6s md4o2=md4ooh7j 3.125e+09 0.000 19050.0 !12-I 7s md4o2=md4ooh8j 3.912e+08 0.000 22050.0 !12-I 8s md5o2=md5ooh4j 2.000e+11 0.000 26850.0 !12-I 5s md5o2=md5ooh3j 2.500e+10 0.000 20850.0 !12-I 6s md5o2=md5ooh2j 3.125e+09 0.000 19050.0 !12-I 7s md5o2=md5ooh6j 2.000e+11 0.000 26850.0 !12-I 5s md5o2=md5ooh7j 2.500e+10 0.000 20850.0 !12-I 6s md5o2=md5ooh8j 3.125e+09 0.000 19050.0 !12-I 7s md5o2=md5ooh9j 3.912e+08 0.000 22050.0 !12-I 8s md6o2=md6ooh5j 2.000e+11 0.000 26850.0 !12-I 5s md6o2=md6ooh4j 2.500e+10 0.000 20850.0 !12-I 6s md6o2=md6ooh3j 3.125e+09 0.000 19050.0 !12-I 7s md6o2=md6ooh2j 3.912e+08 0.000 22050.0 !12-I 8s md6o2=md6ooh7j 2.000e+11 0.000 26850.0 !12-I 5s md6o2=md6ooh8j 2.500e+10 0.000 20850.0 !12-I 6s md6o2=md6ooh9j 3.125e+09 0.000 19050.0 !12-I 7s md6o2=md6ooh10j 1.172e+09 0.000 25550.0 !12-I 8p md7o2=md7ooh6j 2.000e+11 0.000 26850.0 !12-I 5s md7o2=md7ooh5j 2.500e+10 0.000 20850.0 !12-I 6s md7o2=md7ooh4j 3.125e+09 0.000 19050.0 !12-I 7s md7o2=md7ooh3j 3.912e+08 0.000 22050.0 !12-I 8s md7o2=md7ooh8j 2.000e+11 0.000 26850.0 !12-I 5s md7o2=md7ooh9j 2.500e+10 0.000 20850.0 !12-I 6s md7o2=md7ooh10j 9.376e+09 0.000 22350.0 !12-I 7p md8o2=md8ooh7j 2.000e+11 0.000 26850.0 !12-I 5s md8o2=md8ooh6j 2.500e+10 0.000 20850.0 !12-I 6s md8o2=md8ooh5j 3.125e+09 0.000 19050.0 !12-I 7s md8o2=md8ooh4j 3.912e+08 0.000 22050.0 !12-I 8s md8o2=md8ooh9j 2.000e+11 0.000 26850.0 !12-I 5s md8o2=md8ooh10j 3.750e+10 0.000 24400.0 !12-I 6p md9o2=md9ooh8j 2.000e+11 0.000 26850.0 !12-I 5s md9o2=md9ooh7j 2.500e+10 0.000 20850.0 !12-I 6s md9o2=md9ooh6j 3.125e+09 0.000 19050.0 !12-I 7s md9o2=md9ooh5j 3.912e+08 0.000 22050.0 !12-I 8s md9o2=md9ooh10j 3.000e+11 0.000 29400.0 !12-I 5p md10o2=md10ooh9j 2.000e+11 0.000 26850.0 !12-I 5s md10o2=md10ooh8j 2.500e+10 0.000 20850.0 !12-I 6s md10o2=md10ooh7j 3.125e+09 0.000 19050.0 !12-I 7s md10o2=md10ooh6j 3.912e+08 0.000 22050.0 !12-I 8s ! ch3ocooo=ch2ocoooh 3.750E+10 0.000 24400.0 !12-I 6p c9h19cooo=c9h18coooh2j 2.000E+11 0.000 26850.0 !12-I 5s c9h19cooo=c9h18coooh3j 2.500E+10 0.000 20850.0 !12-I 6s c9h19cooo=c9h18coooh4j 3.125E+09 0.000 19050.0 !12-I 7s c9h19cooo=c9h18coooh5j 3.912E+08 0.000 22050.0 !12-I 8s ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 12-II/ro2 = olefin + ho2 ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! !pc4h9o2=c4h8-1+ho2 3.780e+07 1.510 29640.0 !12-II !sc4h9o2=c4h8-1+ho2 4.680e+09 1.160 30870.0 !12-II !sc4h9o2=c4h8-2+ho2 3.780e+07 1.510 29640.0 !12-II !c5h11o2-1=c5h10-1+ho2 3.780e+07 1.510 29640.0 !12-II !c5h11o2-2=c5h10-1+ho2 4.680e+09 1.160 30870.0 !12-II !c5h11o2-2=c5h10-2+ho2 3.780e+07 1.510 29640.0 !12-II !c5h11o2-3=c5h10-2+ho2 7.560e+07 1.510 29640.0 !12-II !c6h13o2-1=c6h12-1+ho2 3.780e+07 1.510 29640.0 !12-II !c6h13o2-2=c6h12-1+ho2 4.680e+09 1.160 30870.0 !12-II !c6h13o2-2=c6h12-2+ho2 3.780e+07 1.510 29640.0 !12-II !c6h13o2-3=c6h12-2+ho2 3.780e+07 1.510 29640.0 !12-II !c6h13o2-3=c6h12-3+ho2 3.780e+07 1.510 29640.0 !12-II !c7h15o2-1=c7h14-1+ho2 3.780e+07 1.510 29640.0 !12-II !c7h15o2-2=c7h14-1+ho2 4.680e+09 1.160 30870.0 !12-II !c7h15o2-2=c7h14-2+ho2 3.780e+07 1.510 29640.0 !12-II !c7h15o2-3=c7h14-2+ho2 3.780e+07 1.510 29640.0 !12-II !c7h15o2-3=c7h14-3+ho2 3.780e+07 1.510 29640.0 !12-II !c7h15o2-4=c7h14-3+ho2 7.560e+07 1.510 29640.0 !12-II c8h17o2-1=c8h16-1+ho2 3.780e+07 1.510 29640.0 !12-II c8h17o2-2=c8h16-1+ho2 4.680e+09 1.160 30870.0 !12-II c8h17o2-2=c8h16-2+ho2 3.780e+07 1.510 29640.0 !12-II c8h17o2-3=c8h16-2+ho2 3.780e+07 1.510 29640.0 !12-II c8h17o2-3=c8h16-3+ho2 3.780e+07 1.510 29640.0 !12-II c8h17o2-4=c8h16-3+ho2 3.780e+07 1.510 29640.0 !12-II c8h17o2-4=c8h16-4+ho2 3.780e+07 1.510 29640.0 !12-II c9h19o2-1=c9h18-1+ho2 3.780e+07 1.510 29640.0 !12-II c9h19o2-2=c9h18-1+ho2 4.680e+09 1.160 30870.0 !12-II c9h19o2-2=c9h18-2+ho2 3.780e+07 1.510 29640.0 !12-II c9h19o2-3=c9h18-2+ho2 3.780e+07 1.510 29640.0 !12-II c9h19o2-3=c9h18-3+ho2 3.780e+07 1.510 29640.0 !12-II c9h19o2-4=c9h18-3+ho2 3.780e+07 1.510 29640.0 !12-II c9h19o2-4=c9h18-4+ho2 3.780e+07 1.510 29640.0 !12-II c9h19o2-5=c9h18-4+ho2 7.560e+07 1.510 29640.0 !12-II ! ! mp2o2=mp2d+ho2 4.680e+09 1.160 30870.0 !12-II mp3o2=mp2d+ho2 3.780e+07 1.510 29640.0 !12-II ! mb2o2=mb2d+ho2 3.780e+07 1.510 29640.0 !12-II mb3o2=mb2d+ho2 3.780e+07 1.510 29640.0 !12-II mb3o2=mb3d+ho2 4.680e+09 1.160 30870.0 !12-II mb4o2=mb3d+ho2 3.780e+07 1.510 29640.0 !12-II ! mf2o2=mf2d+ho2 3.780e+07 1.510 29640.0 !12-II mf3o2=mf2d+ho2 3.780e+07 1.510 29640.0 !12-II mf3o2=mf3d+ho2 3.780e+07 1.510 29640.0 !12-II mf4o2=mf3d+ho2 3.780e+07 1.510 29640.0 !12-II mf4o2=mf4d+ho2 4.680e+09 1.160 30870.0 !12-II mf5o2=mf4d+ho2 3.780e+07 1.510 29640.0 !12-II ! mh2o2=mh2d+ho2 3.780e+07 1.510 29640.0 !12-II mh3o2=mh2d+ho2 3.780e+07 1.510 29640.0 !12-II mh3o2=mh3d+ho2 3.780e+07 1.510 29640.0 !12-II mh4o2=mh3d+ho2 3.780e+07 1.510 29640.0 !12-II mh4o2=mh4d+ho2 3.780e+07 1.510 29640.0 !12-II mh5o2=mh4d+ho2 3.780e+07 1.510 29640.0 !12-II mh5o2=mh5d+ho2 4.680e+09 1.160 30870.0 !12-II mh6o2=mh5d+ho2 3.780e+07 1.510 29640.0 !12-II ! ms2o2=ms2d+ho2 3.780e+07 1.510 29640.0 !12-II ms3o2=ms2d+ho2 3.780e+07 1.510 29640.0 !12-II ms3o2=ms3d+ho2 3.780e+07 1.510 29640.0 !12-II ms4o2=ms3d+ho2 3.780e+07 1.510 29640.0 !12-II ms4o2=ms4d+ho2 3.780e+07 1.510 29640.0 !12-II ms5o2=ms4d+ho2 3.780e+07 1.510 29640.0 !12-II ms5o2=ms5d+ho2 3.780e+07 1.510 29640.0 !12-II ms6o2=ms5d+ho2 3.780e+07 1.510 29640.0 !12-II ms6o2=ms6d+ho2 4.680e+09 1.160 30870.0 !12-II ms7o2=ms6d+ho2 3.780e+07 1.510 29640.0 !12-II ! mo2o2=mo2d+ho2 3.780e+07 1.510 29640.0 !12-II mo3o2=mo2d+ho2 3.780e+07 1.510 29640.0 !12-II mo3o2=mo3d+ho2 3.780e+07 1.510 29640.0 !12-II mo4o2=mo3d+ho2 3.780e+07 1.510 29640.0 !12-II mo4o2=mo4d+ho2 3.780e+07 1.510 29640.0 !12-II mo5o2=mo4d+ho2 3.780e+07 1.510 29640.0 !12-II mo5o2=mo5d+ho2 3.780e+07 1.510 29640.0 !12-II mo6o2=mo5d+ho2 3.780e+07 1.510 29640.0 !12-II mo6o2=mo6d+ho2 3.780e+07 1.510 29640.0 !12-II mo7o2=mo6d+ho2 3.780e+07 1.510 29640.0 !12-II mo7o2=mo7d+ho2 4.680e+09 1.160 30870.0 !12-II mo8o2=mo7d+ho2 3.780e+07 1.510 29640.0 !12-II ! mn2o2=mn2d+ho2 3.780e+07 1.510 29640.0 !12-II mn3o2=mn2d+ho2 3.780e+07 1.510 29640.0 !12-II mn3o2=mn3d+ho2 3.780e+07 1.510 29640.0 !12-II mn4o2=mn3d+ho2 3.780e+07 1.510 29640.0 !12-II mn4o2=mn4d+ho2 3.780e+07 1.510 29640.0 !12-II mn5o2=mn4d+ho2 3.780e+07 1.510 29640.0 !12-II mn5o2=mn5d+ho2 3.780e+07 1.510 29640.0 !12-II mn6o2=mn5d+ho2 3.780e+07 1.510 29640.0 !12-II mn6o2=mn6d+ho2 3.780e+07 1.510 29640.0 !12-II mn7o2=mn6d+ho2 3.780e+07 1.510 29640.0 !12-II mn7o2=mn7d+ho2 3.780e+07 1.510 29640.0 !12-II mn8o2=mn7d+ho2 3.780e+07 1.510 29640.0 !12-II mn8o2=mn8d+ho2 4.680e+09 1.160 30870.0 !12-II mn9o2=mn8d+ho2 3.780e+07 1.510 29640.0 !12-II ! md2o2=md2d+ho2 3.780e+07 1.510 29640.0 !12-II md3o2=md2d+ho2 3.780e+07 1.510 29640.0 !12-II md3o2=md3d+ho2 3.780e+07 1.510 29640.0 !12-II md4o2=md3d+ho2 3.780e+07 1.510 29640.0 !12-II md4o2=md4d+ho2 3.780e+07 1.510 29640.0 !12-II md5o2=md4d+ho2 3.780e+07 1.510 29640.0 !12-II md5o2=md5d+ho2 3.780e+07 1.510 29640.0 !12-II md6o2=md5d+ho2 3.780e+07 1.510 29640.0 !12-II md6o2=md6d+ho2 3.780e+07 1.510 29640.0 !12-II md7o2=md6d+ho2 3.780e+07 1.510 29640.0 !12-II md7o2=md7d+ho2 3.780e+07 1.510 29640.0 !12-II md8o2=md7d+ho2 3.780e+07 1.510 29640.0 !12-II md8o2=md8d+ho2 3.780e+07 1.510 29640.0 !12-II md9o2=md8d+ho2 3.780e+07 1.510 29640.0 !12-II md9o2=md9d+ho2 4.680e+09 1.160 30870.0 !12-II md10o2=md9d+ho2 3.780e+07 1.510 29640.0 !12-II ! c9h19cooo=c8h17chco+ho2 3.780E+07 1.510 29640.0 !12-II ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 12-III/ro2 = aldehyde + oh ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! c2h5o2=ch3cho+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ! nc3h7o2=c2h5cho+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ic3h7o2=ch3coch3+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ! !pc4h9o2=c3h7cho+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 !sc4h9o2=c2h5coch3+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ! !c5h11o2-1=c4h9cho+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 !c5h11o2-2=c3h7coch3+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 !c5h11o2-3=c2h5coc2h5+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ! !c6h13o2-1=c5h11cho+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 !c6h13o2-2=c4h9coch3+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 !c6h13o2-3=c3h7coc2h5+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ! !c7h15o2-1=c6h13cho+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 !c7h15o2-2=c5h11coch3+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 !c7h15o2-3=c4h9coc2h5+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 !c7h15o2-4=c3h7coc3h7+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ! c8h17o2-1=c7h15cho+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 c8h17o2-2=c6h13coch3+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 c8h17o2-3=c5h11coc2h5+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 c8h17o2-4=c4h9coc3h7+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ! c9h19o2-1=c8h17cho+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 c9h19o2-2=c7h15coch3+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 c9h19o2-3=c6h13coc2h5+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 c9h19o2-4=c5h11coc3h7+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 c9h19o2-5=c4h9coc4h9+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ! ! memo2=memoxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 me2o2=me2oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ! mpmo2=mpmoxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mp2o2=mp2oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mp3o2=mp3oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ! mbmo2=mbmoxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mb2o2=mb2oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mb3o2=mb3oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mb4o2=mb4oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ! mfmo2=mfmoxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mf2o2=mf2oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mf3o2=mf3oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mf4o2=mf4oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mf5o2=mf5oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ! mhmo2=mhmoxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mh2o2=mh2oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mh3o2=mh3oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mh4o2=mh4oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mh5o2=mh5oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mh6o2=mh6oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ! msmo2=msmoxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ms2o2=ms2oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ms3o2=ms3oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ms4o2=ms4oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ms5o2=ms5oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ms6o2=ms6oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ms7o2=ms7oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ! mamo2=mamoxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mo2o2=mo2oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mo3o2=mo3oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mo4o2=mo4oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mo5o2=mo5oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mo6o2=mo6oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mo7o2=mo7oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mo8o2=mo8oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ! mnmo2=mnmoxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mn2o2=mn2oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mn3o2=mn3oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mn4o2=mn4oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mn5o2=mn5oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mn6o2=mn6oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mn7o2=mn7oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mn8o2=mn8oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 mn9o2=mn9oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ! mdmo2=mdmoxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 md2o2=md2oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 md3o2=md3oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 md4o2=md4oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 md5o2=md5oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 md6o2=md6oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 md7o2=md7oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 md8o2=md8oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 md9o2=md9oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 md10o2=md10oxo+oh 1.320e+09 1.370 41590.0 !12-III Sheng et al., 2002 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!! ! 13/RO2+HO2=ROOH+O2 ! !!!!!!!!!!!!!!!!!!!!!!!!!! ! !pc4h9o2+ho2=pc4h9ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 !sc4h9o2+ho2=sc4h9ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 !c5h11o2-1+ho2=c5h11ooh-1+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 !c5h11o2-2+ho2=c5h11ooh-2+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 !c5h11o2-3+ho2=c5h11ooh-3+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 !c6h13o2-1+ho2=c6h13ooh-1+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 !c6h13o2-2+ho2=c6h13ooh-2+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 !c6h13o2-3+ho2=c6h13ooh-3+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 !c7h15o2-1+ho2=c7h15ooh-1+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 !c7h15o2-2+ho2=c7h15ooh-2+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 !c7h15o2-3+ho2=c7h15ooh-3+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 !c7h15o2-4+ho2=c7h15ooh-4+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 c8h17o2-1+ho2=c8h17ooh-1+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 c8h17o2-2+ho2=c8h17ooh-2+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 c8h17o2-3+ho2=c8h17ooh-3+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 c8h17o2-4+ho2=c8h17ooh-4+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 c9h19o2-1+ho2=c9h19ooh-1+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 c9h19o2-2+ho2=c9h19ooh-2+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 c9h19o2-3+ho2=c9h19ooh-3+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 c9h19o2-4+ho2=c9h19ooh-4+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 c9h19o2-5+ho2=c9h19ooh-5+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 ! memo2+ho2=memooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 me2o2+ho2=me2ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 ! mpmo2+ho2=mpmooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mp2o2+ho2=mp2ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mp3o2+ho2=mp3ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 ! mbmo2+ho2=mbmooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mb2o2+ho2=mb2ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mb3o2+ho2=mb3ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mb4o2+ho2=mb4ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 ! mfmo2+ho2=mfmooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mf2o2+ho2=mf2ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mf3o2+ho2=mf3ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mf4o2+ho2=mf4ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mf5o2+ho2=mf5ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 ! mhmo2+ho2=mhmooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mh2o2+ho2=mh2ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mh3o2+ho2=mh3ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mh4o2+ho2=mh4ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mh5o2+ho2=mh5ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mh6o2+ho2=mh6ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 ! msmo2+ho2=msmooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 ms2o2+ho2=ms2ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 ms3o2+ho2=ms3ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 ms4o2+ho2=ms4ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 ms5o2+ho2=ms5ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 ms6o2+ho2=ms6ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 ms7o2+ho2=ms7ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 ! mamo2+ho2=mamooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mo2o2+ho2=mo2ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mo3o2+ho2=mo3ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mo4o2+ho2=mo4ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mo5o2+ho2=mo5ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mo6o2+ho2=mo6ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mo7o2+ho2=mo7ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mo8o2+ho2=mo8ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 ! mnmo2+ho2=mnmooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mn2o2+ho2=mn2ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mn3o2+ho2=mn3ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mn4o2+ho2=mn4ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mn5o2+ho2=mn5ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mn6o2+ho2=mn6ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mn7o2+ho2=mn7ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mn8o2+ho2=mn8ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 mn9o2+ho2=mn9ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 ! mdmo2+ho2=mdmooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 md2o2+ho2=md2ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 md3o2+ho2=md3ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 md4o2+ho2=md4ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 md5o2+ho2=md5ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 md6o2+ho2=md6ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 md7o2+ho2=md7ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 md8o2+ho2=md8ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 md9o2+ho2=md9ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 md10o2+ho2=md10ooh+o2 1.750E+11 0.000 01710.0 !13 !Lightfoot et al., 1991 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 14/RO2+H2O2=ROOH+HO2 ! !!!!!!!!!!!!!!!!!!!!!!!!!!!! ! !pc4h9o2+h2o2=pc4h9ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 !sc4h9o2+h2o2=sc4h9ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 !c5h11o2-1+h2o2=c5h11ooh-1+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 !c5h11o2-2+h2o2=c5h11ooh-2+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 !c5h11o2-3+h2o2=c5h11ooh-3+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 !c6h13o2-1+h2o2=c6h13ooh-1+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 !c6h13o2-2+h2o2=c6h13ooh-2+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 !c6h13o2-3+h2o2=c6h13ooh-3+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 !c7h15o2-1+h2o2=c7h15ooh-1+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 !c7h15o2-2+h2o2=c7h15ooh-2+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 !c7h15o2-3+h2o2=c7h15ooh-3+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 !c7h15o2-4+h2o2=c7h15ooh-4+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 c8h17o2-1+h2o2=c8h17ooh-1+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 c8h17o2-2+h2o2=c8h17ooh-2+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 c8h17o2-3+h2o2=c8h17ooh-3+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 c8h17o2-4+h2o2=c8h17ooh-4+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 c9h19o2-1+h2o2=c9h19ooh-1+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 c9h19o2-2+h2o2=c9h19ooh-2+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 c9h19o2-3+h2o2=c9h19ooh-3+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 c9h19o2-4+h2o2=c9h19ooh-4+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 c9h19o2-5+h2o2=c9h19ooh-5+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 ! memo2+h2o2=memooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 me2o2+h2o2=me2ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 ! mpmo2+h2o2=mpmooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mp2o2+h2o2=mp2ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mp3o2+h2o2=mp3ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 ! mbmo2+h2o2=mbmooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mb2o2+h2o2=mb2ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mb3o2+h2o2=mb3ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mb4o2+h2o2=mb4ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 ! mfmo2+h2o2=mfmooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mf2o2+h2o2=mf2ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mf3o2+h2o2=mf3ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mf4o2+h2o2=mf4ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mf5o2+h2o2=mf5ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 ! mhmo2+h2o2=mhmooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mh2o2+h2o2=mh2ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mh3o2+h2o2=mh3ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mh4o2+h2o2=mh4ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mh5o2+h2o2=mh5ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mh6o2+h2o2=mh6ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 ! msmo2+h2o2=msmooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 ms2o2+h2o2=ms2ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 ms3o2+h2o2=ms3ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 ms4o2+h2o2=ms4ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 ms5o2+h2o2=ms5ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 ms6o2+h2o2=ms6ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 ms7o2+h2o2=ms7ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 ! mamo2+h2o2=mamooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mo2o2+h2o2=mo2ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mo3o2+h2o2=mo3ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mo4o2+h2o2=mo4ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mo5o2+h2o2=mo5ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mo6o2+h2o2=mo6ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mo7o2+h2o2=mo7ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mo8o2+h2o2=mo8ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 ! mnmo2+h2o2=mnmooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mn2o2+h2o2=mn2ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mn3o2+h2o2=mn3ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mn4o2+h2o2=mn4ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mn5o2+h2o2=mn5ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mn6o2+h2o2=mn6ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mn7o2+h2o2=mn7ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mn8o2+h2o2=mn8ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 mn9o2+h2o2=mn9ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 ! mdmo2+h2o2=mdmooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 md2o2+h2o2=md2ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 md3o2+h2o2=md3ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 md4o2+h2o2=md4ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 md5o2+h2o2=md5ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 md6o2+h2o2=md6ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 md7o2+h2o2=md7ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 md8o2+h2o2=md8ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 md9o2+h2o2=md9ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 md10o2+h2o2=md10ooh+ho2 2.410E+12 0.000 09940.0 !14 !Tsang and Hampson, 1986 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 15/RO2+CH3O2=RO+CH3O+O2 ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! !pc4h9o2+ch3o2=pc4h9o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 !sc4h9o2+ch3o2=sc4h9o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 !c5h11o2-1+ch3o2=c5h11o-1+ch3o+o2 1.400E+16 -1.610 01860.0 !15 !c5h11o2-2+ch3o2=c5h11o-2+ch3o+o2 1.400E+16 -1.610 01860.0 !15 !c5h11o2-3+ch3o2=c5h11o-3+ch3o+o2 1.400E+16 -1.610 01860.0 !15 !c6h13o2-1+ch3o2=c6h13o-1+ch3o+o2 1.400E+16 -1.610 01860.0 !15 !c6h13o2-2+ch3o2=c6h13o-2+ch3o+o2 1.400E+16 -1.610 01860.0 !15 !c6h13o2-3+ch3o2=c6h13o-3+ch3o+o2 1.400E+16 -1.610 01860.0 !15 !c7h15o2-1+ch3o2=c7h15o-1+ch3o+o2 1.400E+16 -1.610 01860.0 !15 !c7h15o2-2+ch3o2=c7h15o-2+ch3o+o2 1.400E+16 -1.610 01860.0 !15 !c7h15o2-3+ch3o2=c7h15o-3+ch3o+o2 1.400E+16 -1.610 01860.0 !15 !c7h15o2-4+ch3o2=c7h15o-4+ch3o+o2 1.400E+16 -1.610 01860.0 !15 c8h17o2-1+ch3o2=c8h17o-1+ch3o+o2 1.400E+16 -1.610 01860.0 !15 c8h17o2-2+ch3o2=c8h17o-2+ch3o+o2 1.400E+16 -1.610 01860.0 !15 c8h17o2-3+ch3o2=c8h17o-3+ch3o+o2 1.400E+16 -1.610 01860.0 !15 c8h17o2-4+ch3o2=c8h17o-4+ch3o+o2 1.400E+16 -1.610 01860.0 !15 c9h19o2-1+ch3o2=c9h19o-1+ch3o+o2 1.400E+16 -1.610 01860.0 !15 c9h19o2-2+ch3o2=c9h19o-2+ch3o+o2 1.400E+16 -1.610 01860.0 !15 c9h19o2-3+ch3o2=c9h19o-3+ch3o+o2 1.400E+16 -1.610 01860.0 !15 c9h19o2-4+ch3o2=c9h19o-4+ch3o+o2 1.400E+16 -1.610 01860.0 !15 c9h19o2-5+ch3o2=c9h19o-5+ch3o+o2 1.400E+16 -1.610 01860.0 !15 ! memo2+ch3o2=memo+ch3o+o2 1.400E+16 -1.610 01860.0 !15 me2o2+ch3o2=me2o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 ! mpmo2+ch3o2=mpmo+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mp2o2+ch3o2=mp2o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mp3o2+ch3o2=mp3o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 ! mbmo2+ch3o2=mbmo+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mb2o2+ch3o2=mb2o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mb3o2+ch3o2=mb3o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mb4o2+ch3o2=mb4o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 ! mfmo2+ch3o2=mfmo+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mf2o2+ch3o2=mf2o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mf3o2+ch3o2=mf3o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mf4o2+ch3o2=mf4o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mf5o2+ch3o2=mf5o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 ! mhmo2+ch3o2=mhmo+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mh2o2+ch3o2=mh2o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mh3o2+ch3o2=mh3o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mh4o2+ch3o2=mh4o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mh5o2+ch3o2=mh5o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mh6o2+ch3o2=mh6o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 ! msmo2+ch3o2=msmo+ch3o+o2 1.400E+16 -1.610 01860.0 !15 ms2o2+ch3o2=ms2o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 ms3o2+ch3o2=ms3o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 ms4o2+ch3o2=ms4o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 ms5o2+ch3o2=ms5o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 ms6o2+ch3o2=ms6o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 ms7o2+ch3o2=ms7o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 ! mamo2+ch3o2=mamo+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mo2o2+ch3o2=mo2o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mo3o2+ch3o2=mo3o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mo4o2+ch3o2=mo4o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mo5o2+ch3o2=mo5o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mo6o2+ch3o2=mo6o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mo7o2+ch3o2=mo7o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mo8o2+ch3o2=mo8o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 ! mnmo2+ch3o2=mnmo+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mn2o2+ch3o2=mn2o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mn3o2+ch3o2=mn3o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mn4o2+ch3o2=mn4o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mn5o2+ch3o2=mn5o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mn6o2+ch3o2=mn6o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mn7o2+ch3o2=mn7o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mn8o2+ch3o2=mn8o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 mn9o2+ch3o2=mn9o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 ! mdmo2+ch3o2=mdmo+ch3o+o2 1.400E+16 -1.610 01860.0 !15 md2o2+ch3o2=md2o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 md3o2+ch3o2=md3o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 md4o2+ch3o2=md4o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 md5o2+ch3o2=md5o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 md6o2+ch3o2=md6o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 md7o2+ch3o2=md7o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 md8o2+ch3o2=md8o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 md9o2+ch3o2=md9o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 md10o2+ch3o2=md10o+ch3o+o2 1.400E+16 -1.610 01860.0 !15 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 16/RO2+R'O2=RO+R'O+O2 ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! md10o2+md10o2=md10o+md10o+o2 1.400E+16 -1.610 01860.0 !16 md9o2+md10o2=md9o+md10o+o2 1.400E+16 -1.610 01860.0 !16 md8o2+md10o2=md8o+md10o+o2 1.400E+16 -1.610 01860.0 !16 md7o2+md10o2=md7o+md10o+o2 1.400E+16 -1.610 01860.0 !16 md6o2+md10o2=md6o+md10o+o2 1.400E+16 -1.610 01860.0 !16 md5o2+md10o2=md5o+md10o+o2 1.400E+16 -1.610 01860.0 !16 md4o2+md10o2=md4o+md10o+o2 1.400E+16 -1.610 01860.0 !16 md3o2+md10o2=md3o+md10o+o2 1.400E+16 -1.610 01860.0 !16 md2o2+md10o2=md2o+md10o+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+md10o2=mdmo+md10o+o2 1.400E+16 -1.610 01860.0 !16 ! md9o2+md9o2=md9o+md9o+o2 1.400E+16 -1.610 01860.0 !16 md8o2+md9o2=md8o+md9o+o2 1.400E+16 -1.610 01860.0 !16 md7o2+md9o2=md7o+md9o+o2 1.400E+16 -1.610 01860.0 !16 md6o2+md9o2=md6o+md9o+o2 1.400E+16 -1.610 01860.0 !16 md5o2+md9o2=md5o+md9o+o2 1.400E+16 -1.610 01860.0 !16 md4o2+md9o2=md4o+md9o+o2 1.400E+16 -1.610 01860.0 !16 md3o2+md9o2=md3o+md9o+o2 1.400E+16 -1.610 01860.0 !16 md2o2+md9o2=md2o+md9o+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+md9o2=mdmo+md9o+o2 1.400E+16 -1.610 01860.0 !16 ! md8o2+md8o2=md8o+md8o+o2 1.400E+16 -1.610 01860.0 !16 md7o2+md8o2=md7o+md8o+o2 1.400E+16 -1.610 01860.0 !16 md6o2+md8o2=md6o+md8o+o2 1.400E+16 -1.610 01860.0 !16 md5o2+md8o2=md5o+md8o+o2 1.400E+16 -1.610 01860.0 !16 md4o2+md8o2=md4o+md8o+o2 1.400E+16 -1.610 01860.0 !16 md3o2+md8o2=md3o+md8o+o2 1.400E+16 -1.610 01860.0 !16 md2o2+md8o2=md2o+md8o+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+md8o2=mdmo+md8o+o2 1.400E+16 -1.610 01860.0 !16 ! md7o2+md7o2=md7o+md7o+o2 1.400E+16 -1.610 01860.0 !16 md6o2+md7o2=md6o+md7o+o2 1.400E+16 -1.610 01860.0 !16 md5o2+md7o2=md5o+md7o+o2 1.400E+16 -1.610 01860.0 !16 md4o2+md7o2=md4o+md7o+o2 1.400E+16 -1.610 01860.0 !16 md3o2+md7o2=md3o+md7o+o2 1.400E+16 -1.610 01860.0 !16 md2o2+md7o2=md2o+md7o+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+md7o2=mdmo+md7o+o2 1.400E+16 -1.610 01860.0 !16 ! md6o2+md6o2=md6o+md6o+o2 1.400E+16 -1.610 01860.0 !16 md5o2+md6o2=md5o+md6o+o2 1.400E+16 -1.610 01860.0 !16 md4o2+md6o2=md4o+md6o+o2 1.400E+16 -1.610 01860.0 !16 md3o2+md6o2=md3o+md6o+o2 1.400E+16 -1.610 01860.0 !16 md2o2+md6o2=md2o+md6o+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+md6o2=mdmo+md6o+o2 1.400E+16 -1.610 01860.0 !16 ! md5o2+md5o2=md5o+md5o+o2 1.400E+16 -1.610 01860.0 !16 md4o2+md5o2=md4o+md5o+o2 1.400E+16 -1.610 01860.0 !16 md3o2+md5o2=md3o+md5o+o2 1.400E+16 -1.610 01860.0 !16 md2o2+md5o2=md2o+md5o+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+md5o2=mdmo+md5o+o2 1.400E+16 -1.610 01860.0 !16 ! md4o2+md4o2=md4o+md4o+o2 1.400E+16 -1.610 01860.0 !16 md3o2+md4o2=md3o+md4o+o2 1.400E+16 -1.610 01860.0 !16 md2o2+md4o2=md2o+md4o+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+md4o2=mdmo+md4o+o2 1.400E+16 -1.610 01860.0 !16 ! md3o2+md3o2=md3o+md3o+o2 1.400E+16 -1.610 01860.0 !16 md2o2+md3o2=md2o+md3o+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+md3o2=mdmo+md3o+o2 1.400E+16 -1.610 01860.0 !16 ! md2o2+md2o2=md2o+md2o+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+md2o2=mdmo+md2o+o2 1.400E+16 -1.610 01860.0 !16 ! mdmo2+mdmo2=mdmo+mdmo+o2 1.400E+16 -1.610 01860.0 !16 ! md10o2+mn9o2=md10o+mn9o+o2 1.400E+16 -1.610 01860.0 !16 md9o2+mn9o2=md9o+mn9o+o2 1.400E+16 -1.610 01860.0 !16 md8o2+mn9o2=md8o+mn9o+o2 1.400E+16 -1.610 01860.0 !16 md7o2+mn9o2=md7o+mn9o+o2 1.400E+16 -1.610 01860.0 !16 md6o2+mn9o2=md6o+mn9o+o2 1.400E+16 -1.610 01860.0 !16 md5o2+mn9o2=md5o+mn9o+o2 1.400E+16 -1.610 01860.0 !16 md4o2+mn9o2=md4o+mn9o+o2 1.400E+16 -1.610 01860.0 !16 md3o2+mn9o2=md3o+mn9o+o2 1.400E+16 -1.610 01860.0 !16 md2o2+mn9o2=md2o+mn9o+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+mn9o2=mdmo+mn9o+o2 1.400E+16 -1.610 01860.0 !16 ! md10o2+mo8o2=md10o+mo8o+o2 1.400E+16 -1.610 01860.0 !16 md9o2+mo8o2=md9o+mo8o+o2 1.400E+16 -1.610 01860.0 !16 md8o2+mo8o2=md8o+mo8o+o2 1.400E+16 -1.610 01860.0 !16 md7o2+mo8o2=md7o+mo8o+o2 1.400E+16 -1.610 01860.0 !16 md6o2+mo8o2=md6o+mo8o+o2 1.400E+16 -1.610 01860.0 !16 md5o2+mo8o2=md5o+mo8o+o2 1.400E+16 -1.610 01860.0 !16 md4o2+mo8o2=md4o+mo8o+o2 1.400E+16 -1.610 01860.0 !16 md3o2+mo8o2=md3o+mo8o+o2 1.400E+16 -1.610 01860.0 !16 md2o2+mo8o2=md2o+mo8o+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+mo8o2=mdmo+mo8o+o2 1.400E+16 -1.610 01860.0 !16 ! md10o2+ms7o2=md10o+ms7o+o2 1.400E+16 -1.610 01860.0 !16 md9o2+ms7o2=md9o+ms7o+o2 1.400E+16 -1.610 01860.0 !16 md8o2+ms7o2=md8o+ms7o+o2 1.400E+16 -1.610 01860.0 !16 md7o2+ms7o2=md7o+ms7o+o2 1.400E+16 -1.610 01860.0 !16 md6o2+ms7o2=md6o+ms7o+o2 1.400E+16 -1.610 01860.0 !16 md5o2+ms7o2=md5o+ms7o+o2 1.400E+16 -1.610 01860.0 !16 md4o2+ms7o2=md4o+ms7o+o2 1.400E+16 -1.610 01860.0 !16 md3o2+ms7o2=md3o+ms7o+o2 1.400E+16 -1.610 01860.0 !16 md2o2+ms7o2=md2o+ms7o+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+ms7o2=mdmo+ms7o+o2 1.400E+16 -1.610 01860.0 !16 ! md10o2+mh6o2=md10o+mh6o+o2 1.400E+16 -1.610 01860.0 !16 md9o2+mh6o2=md9o+mh6o+o2 1.400E+16 -1.610 01860.0 !16 md8o2+mh6o2=md8o+mh6o+o2 1.400E+16 -1.610 01860.0 !16 md7o2+mh6o2=md7o+mh6o+o2 1.400E+16 -1.610 01860.0 !16 md6o2+mh6o2=md6o+mh6o+o2 1.400E+16 -1.610 01860.0 !16 md5o2+mh6o2=md5o+mh6o+o2 1.400E+16 -1.610 01860.0 !16 md4o2+mh6o2=md4o+mh6o+o2 1.400E+16 -1.610 01860.0 !16 md3o2+mh6o2=md3o+mh6o+o2 1.400E+16 -1.610 01860.0 !16 md2o2+mh6o2=md2o+mh6o+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+mh6o2=mdmo+mh6o+o2 1.400E+16 -1.610 01860.0 !16 ! md10o2+mf5o2=md10o+mf5o+o2 1.400E+16 -1.610 01860.0 !16 md9o2+mf5o2=md9o+mf5o+o2 1.400E+16 -1.610 01860.0 !16 md8o2+mf5o2=md8o+mf5o+o2 1.400E+16 -1.610 01860.0 !16 md7o2+mf5o2=md7o+mf5o+o2 1.400E+16 -1.610 01860.0 !16 md6o2+mf5o2=md6o+mf5o+o2 1.400E+16 -1.610 01860.0 !16 md5o2+mf5o2=md5o+mf5o+o2 1.400E+16 -1.610 01860.0 !16 md4o2+mf5o2=md4o+mf5o+o2 1.400E+16 -1.610 01860.0 !16 md3o2+mf5o2=md3o+mf5o+o2 1.400E+16 -1.610 01860.0 !16 md2o2+mf5o2=md2o+mf5o+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+mf5o2=mdmo+mf5o+o2 1.400E+16 -1.610 01860.0 !16 ! md10o2+mb4o2=md10o+mb4o+o2 1.400E+16 -1.610 01860.0 !16 md9o2+mb4o2=md9o+mb4o+o2 1.400E+16 -1.610 01860.0 !16 md8o2+mb4o2=md8o+mb4o+o2 1.400E+16 -1.610 01860.0 !16 md7o2+mb4o2=md7o+mb4o+o2 1.400E+16 -1.610 01860.0 !16 md6o2+mb4o2=md6o+mb4o+o2 1.400E+16 -1.610 01860.0 !16 md5o2+mb4o2=md5o+mb4o+o2 1.400E+16 -1.610 01860.0 !16 md4o2+mb4o2=md4o+mb4o+o2 1.400E+16 -1.610 01860.0 !16 md3o2+mb4o2=md3o+mb4o+o2 1.400E+16 -1.610 01860.0 !16 md2o2+mb4o2=md2o+mb4o+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+mb4o2=mdmo+mb4o+o2 1.400E+16 -1.610 01860.0 !16 ! md10o2+mp3o2=md10o+mp3o+o2 1.400E+16 -1.610 01860.0 !16 md9o2+mp3o2=md9o+mp3o+o2 1.400E+16 -1.610 01860.0 !16 md8o2+mp3o2=md8o+mp3o+o2 1.400E+16 -1.610 01860.0 !16 md7o2+mp3o2=md7o+mp3o+o2 1.400E+16 -1.610 01860.0 !16 md6o2+mp3o2=md6o+mp3o+o2 1.400E+16 -1.610 01860.0 !16 md5o2+mp3o2=md5o+mp3o+o2 1.400E+16 -1.610 01860.0 !16 md4o2+mp3o2=md4o+mp3o+o2 1.400E+16 -1.610 01860.0 !16 md3o2+mp3o2=md3o+mp3o+o2 1.400E+16 -1.610 01860.0 !16 md2o2+mp3o2=md2o+mp3o+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+mp3o2=mdmo+mp3o+o2 1.400E+16 -1.610 01860.0 !16 ! md10o2+me2o2=md10o+me2o+o2 1.400E+16 -1.610 01860.0 !16 md9o2+me2o2=md9o+me2o+o2 1.400E+16 -1.610 01860.0 !16 md8o2+me2o2=md8o+me2o+o2 1.400E+16 -1.610 01860.0 !16 md7o2+me2o2=md7o+me2o+o2 1.400E+16 -1.610 01860.0 !16 md6o2+me2o2=md6o+me2o+o2 1.400E+16 -1.610 01860.0 !16 md5o2+me2o2=md5o+me2o+o2 1.400E+16 -1.610 01860.0 !16 md4o2+me2o2=md4o+me2o+o2 1.400E+16 -1.610 01860.0 !16 md3o2+me2o2=md3o+me2o+o2 1.400E+16 -1.610 01860.0 !16 md2o2+me2o2=md2o+me2o+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+me2o2=mdmo+me2o+o2 1.400E+16 -1.610 01860.0 !16 ! md10o2+c2h5o2=md10o+c2h5o+o2 1.400E+16 -1.610 01860.0 !16 md9o2+c2h5o2=md9o+c2h5o+o2 1.400E+16 -1.610 01860.0 !16 md8o2+c2h5o2=md8o+c2h5o+o2 1.400E+16 -1.610 01860.0 !16 md7o2+c2h5o2=md7o+c2h5o+o2 1.400E+16 -1.610 01860.0 !16 md6o2+c2h5o2=md6o+c2h5o+o2 1.400E+16 -1.610 01860.0 !16 md5o2+c2h5o2=md5o+c2h5o+o2 1.400E+16 -1.610 01860.0 !16 md4o2+c2h5o2=md4o+c2h5o+o2 1.400E+16 -1.610 01860.0 !16 md3o2+c2h5o2=md3o+c2h5o+o2 1.400E+16 -1.610 01860.0 !16 md2o2+c2h5o2=md2o+c2h5o+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+c2h5o2=mdmo+c2h5o+o2 1.400E+16 -1.610 01860.0 !16 ! md10o2+nc3h7o2=md10o+nc3h7o+o2 1.400E+16 -1.610 01860.0 !16 md9o2+nc3h7o2=md9o+nc3h7o+o2 1.400E+16 -1.610 01860.0 !16 md8o2+nc3h7o2=md8o+nc3h7o+o2 1.400E+16 -1.610 01860.0 !16 md7o2+nc3h7o2=md7o+nc3h7o+o2 1.400E+16 -1.610 01860.0 !16 md6o2+nc3h7o2=md6o+nc3h7o+o2 1.400E+16 -1.610 01860.0 !16 md5o2+nc3h7o2=md5o+nc3h7o+o2 1.400E+16 -1.610 01860.0 !16 md4o2+nc3h7o2=md4o+nc3h7o+o2 1.400E+16 -1.610 01860.0 !16 md3o2+nc3h7o2=md3o+nc3h7o+o2 1.400E+16 -1.610 01860.0 !16 md2o2+nc3h7o2=md2o+nc3h7o+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+nc3h7o2=mdmo+nc3h7o+o2 1.400E+16 -1.610 01860.0 !16 ! md10o2+pc4h9o2=md10o+pc4h9o+o2 1.400E+16 -1.610 01860.0 !16 md9o2+pc4h9o2=md9o+pc4h9o+o2 1.400E+16 -1.610 01860.0 !16 md8o2+pc4h9o2=md8o+pc4h9o+o2 1.400E+16 -1.610 01860.0 !16 md7o2+pc4h9o2=md7o+pc4h9o+o2 1.400E+16 -1.610 01860.0 !16 md6o2+pc4h9o2=md6o+pc4h9o+o2 1.400E+16 -1.610 01860.0 !16 md5o2+pc4h9o2=md5o+pc4h9o+o2 1.400E+16 -1.610 01860.0 !16 md4o2+pc4h9o2=md4o+pc4h9o+o2 1.400E+16 -1.610 01860.0 !16 md3o2+pc4h9o2=md3o+pc4h9o+o2 1.400E+16 -1.610 01860.0 !16 md2o2+pc4h9o2=md2o+pc4h9o+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+pc4h9o2=mdmo+pc4h9o+o2 1.400E+16 -1.610 01860.0 !16 ! md10o2+c5h11o2-1=md10o+c5h11o-1+o2 1.400E+16 -1.610 01860.0 !16 md9o2+c5h11o2-1=md9o+c5h11o-1+o2 1.400E+16 -1.610 01860.0 !16 md8o2+c5h11o2-1=md8o+c5h11o-1+o2 1.400E+16 -1.610 01860.0 !16 md7o2+c5h11o2-1=md7o+c5h11o-1+o2 1.400E+16 -1.610 01860.0 !16 md6o2+c5h11o2-1=md6o+c5h11o-1+o2 1.400E+16 -1.610 01860.0 !16 md5o2+c5h11o2-1=md5o+c5h11o-1+o2 1.400E+16 -1.610 01860.0 !16 md4o2+c5h11o2-1=md4o+c5h11o-1+o2 1.400E+16 -1.610 01860.0 !16 md3o2+c5h11o2-1=md3o+c5h11o-1+o2 1.400E+16 -1.610 01860.0 !16 md2o2+c5h11o2-1=md2o+c5h11o-1+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+c5h11o2-1=mdmo+c5h11o-1+o2 1.400E+16 -1.610 01860.0 !16 ! md10o2+c6h13o2-1=md10o+c6h13o-1+o2 1.400E+16 -1.610 01860.0 !16 md9o2+c6h13o2-1=md9o+c6h13o-1+o2 1.400E+16 -1.610 01860.0 !16 md8o2+c6h13o2-1=md8o+c6h13o-1+o2 1.400E+16 -1.610 01860.0 !16 md7o2+c6h13o2-1=md7o+c6h13o-1+o2 1.400E+16 -1.610 01860.0 !16 md6o2+c6h13o2-1=md6o+c6h13o-1+o2 1.400E+16 -1.610 01860.0 !16 md5o2+c6h13o2-1=md5o+c6h13o-1+o2 1.400E+16 -1.610 01860.0 !16 md4o2+c6h13o2-1=md4o+c6h13o-1+o2 1.400E+16 -1.610 01860.0 !16 md3o2+c6h13o2-1=md3o+c6h13o-1+o2 1.400E+16 -1.610 01860.0 !16 md2o2+c6h13o2-1=md2o+c6h13o-1+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+c6h13o2-1=mdmo+c6h13o-1+o2 1.400E+16 -1.610 01860.0 !16 ! md10o2+c7h15o2-1=md10o+c7h15o-1+o2 1.400E+16 -1.610 01860.0 !16 md9o2+c7h15o2-1=md9o+c7h15o-1+o2 1.400E+16 -1.610 01860.0 !16 md8o2+c7h15o2-1=md8o+c7h15o-1+o2 1.400E+16 -1.610 01860.0 !16 md7o2+c7h15o2-1=md7o+c7h15o-1+o2 1.400E+16 -1.610 01860.0 !16 md6o2+c7h15o2-1=md6o+c7h15o-1+o2 1.400E+16 -1.610 01860.0 !16 md5o2+c7h15o2-1=md5o+c7h15o-1+o2 1.400E+16 -1.610 01860.0 !16 md4o2+c7h15o2-1=md4o+c7h15o-1+o2 1.400E+16 -1.610 01860.0 !16 md3o2+c7h15o2-1=md3o+c7h15o-1+o2 1.400E+16 -1.610 01860.0 !16 md2o2+c7h15o2-1=md2o+c7h15o-1+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+c7h15o2-1=mdmo+c7h15o-1+o2 1.400E+16 -1.610 01860.0 !16 ! md10o2+c8h17o2-1=md10o+c8h17o-1+o2 1.400E+16 -1.610 01860.0 !16 md9o2+c8h17o2-1=md9o+c8h17o-1+o2 1.400E+16 -1.610 01860.0 !16 md8o2+c8h17o2-1=md8o+c8h17o-1+o2 1.400E+16 -1.610 01860.0 !16 md7o2+c8h17o2-1=md7o+c8h17o-1+o2 1.400E+16 -1.610 01860.0 !16 md6o2+c8h17o2-1=md6o+c8h17o-1+o2 1.400E+16 -1.610 01860.0 !16 md5o2+c8h17o2-1=md5o+c8h17o-1+o2 1.400E+16 -1.610 01860.0 !16 md4o2+c8h17o2-1=md4o+c8h17o-1+o2 1.400E+16 -1.610 01860.0 !16 md3o2+c8h17o2-1=md3o+c8h17o-1+o2 1.400E+16 -1.610 01860.0 !16 md2o2+c8h17o2-1=md2o+c8h17o-1+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+c8h17o2-1=mdmo+c8h17o-1+o2 1.400E+16 -1.610 01860.0 !16 ! md10o2+c9h19o2-1=md10o+c9h19o-1+o2 1.400E+16 -1.610 01860.0 !16 md9o2+c9h19o2-1=md9o+c9h19o-1+o2 1.400E+16 -1.610 01860.0 !16 md8o2+c9h19o2-1=md8o+c9h19o-1+o2 1.400E+16 -1.610 01860.0 !16 md7o2+c9h19o2-1=md7o+c9h19o-1+o2 1.400E+16 -1.610 01860.0 !16 md6o2+c9h19o2-1=md6o+c9h19o-1+o2 1.400E+16 -1.610 01860.0 !16 md5o2+c9h19o2-1=md5o+c9h19o-1+o2 1.400E+16 -1.610 01860.0 !16 md4o2+c9h19o2-1=md4o+c9h19o-1+o2 1.400E+16 -1.610 01860.0 !16 md3o2+c9h19o2-1=md3o+c9h19o-1+o2 1.400E+16 -1.610 01860.0 !16 md2o2+c9h19o2-1=md2o+c9h19o-1+o2 1.400E+16 -1.610 01860.0 !16 mdmo2+c9h19o2-1=mdmo+c9h19o-1+o2 1.400E+16 -1.610 01860.0 !16 ! ! ! !!!!!!!!!!!!!!!!!!!!! ! 17/ROOH=RO+OH ! !!!!!!!!!!!!!!!!!!!!! ! !pc4h9ooh=oh+pc4h9o 1.810E+13 0.000 42330.0 !17 Lightfoot et al., 1991 !sc4h9ooh=oh+sc4h9o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 !c5h11ooh-1=oh+c5h11o-1 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 !c5h11ooh-2=oh+c5h11o-2 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 !c5h11ooh-3=oh+c5h11o-3 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 !c6h13ooh-1=oh+c6h13o-1 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 !c6h13ooh-2=oh+c6h13o-2 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 !c6h13ooh-3=oh+c6h13o-3 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 !c7h15ooh-1=oh+c7h15o-1 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 !c7h15ooh-2=oh+c7h15o-2 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 !c7h15ooh-3=oh+c7h15o-3 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 !c7h15ooh-4=oh+c7h15o-4 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 c8h17ooh-1=oh+c8h17o-1 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 c8h17ooh-2=oh+c8h17o-2 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 c8h17ooh-3=oh+c8h17o-3 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 c8h17ooh-4=oh+c8h17o-4 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 c9h19ooh-1=oh+c9h19o-1 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 c9h19ooh-2=oh+c9h19o-2 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 c9h19ooh-3=oh+c9h19o-3 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 c9h19ooh-4=oh+c9h19o-4 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 c9h19ooh-5=oh+c9h19o-5 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 ! memooh=oh+memo 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 me2ooh=oh+me2o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 ! mpmooh=oh+mpmo 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mp2ooh=oh+mp2o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mp3ooh=oh+mp3o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 ! mbmooh=oh+mbmo 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mb2ooh=oh+mb2o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mb3ooh=oh+mb3o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mb4ooh=oh+mb4o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 ! mfmooh=oh+mfmo 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mf2ooh=oh+mf2o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mf3ooh=oh+mf3o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mf4ooh=oh+mf4o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mf5ooh=oh+mf5o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 ! mhmooh=oh+mhmo 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mh2ooh=oh+mh2o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mh3ooh=oh+mh3o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mh4ooh=oh+mh4o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mh5ooh=oh+mh5o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mh6ooh=oh+mh6o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 ! msmooh=oh+msmo 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 ms2ooh=oh+ms2o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 ms3ooh=oh+ms3o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 ms4ooh=oh+ms4o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 ms5ooh=oh+ms5o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 ms6ooh=oh+ms6o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 ms7ooh=oh+ms7o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 ! mamooh=oh+mamo 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mo2ooh=oh+mo2o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mo3ooh=oh+mo3o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mo4ooh=oh+mo4o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mo5ooh=oh+mo5o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mo6ooh=oh+mo6o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mo7ooh=oh+mo7o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mo8ooh=oh+mo8o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 ! mnmooh=oh+mnmo 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mn2ooh=oh+mn2o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mn3ooh=oh+mn3o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mn4ooh=oh+mn4o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mn5ooh=oh+mn5o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mn6ooh=oh+mn6o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mn7ooh=oh+mn7o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mn8ooh=oh+mn8o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 mn9ooh=oh+mn9o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 ! mdmooh=oh+mdmo 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 md2ooh=oh+md2o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 md3ooh=oh+md3o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 md4ooh=oh+md4o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 md5ooh=oh+md5o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 md6ooh=oh+md6o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 md7ooh=oh+md7o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 md8ooh=oh+md8o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 md9ooh=oh+md9o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 md10ooh=oh+md10o 6.310E+14 0.000 42330.0 !17 Lightfoot et al., 1991 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!! ! 18/RO decomposition ! !!!!!!!!!!!!!!!!!!!!!!!!!!! ! c2h5+mo8oxo=md8o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+md8oxo=md8o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h ms7j+c2h5cho=md8o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho nc3h7+ms7oxo=md7o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+md7oxo=md7o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h mh6j+c3h7cho=md7o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho pc4h9+mh6oxo=md6o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+md6oxo=md6o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h mf5j+c4h9cho=md6o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho c5h11-1+mf5oxo=md5o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+md5oxo=md5o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h mb4j+c5h11cho=md5o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho c6h13-1+mb4oxo=md4o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+md4oxo=md4o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h mp3j+c6h13cho=md4o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho c7h15-1+mp3oxo=md3o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+md3oxo=md3o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h me2j+c7h15cho=md3o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho c8h17-1+me2oxo=md2o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+md2oxo=md2o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h ch3oco+c8h17cho=md2o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho daoj+ch2o=mdmo 1.000E+11 0.000 11900.0 !18 Huge mechanism ch3o+ch2o h+mdmoxo=mdmo 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h ! c2h5+ms7oxo=mn7o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+mn7oxo=mn7o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h mh6j+c2h5cho=mn7o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho nc3h7+mh6oxo=mn6o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+mn6oxo=mn6o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h mf5j+c3h7cho=mn6o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho pc4h9+mf5oxo=mn5o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+mn5oxo=mn5o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h mb4j+c4h9cho=mn5o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho c5h11-1+mb4oxo=mn4o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+mn4oxo=mn4o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h mp3j+c5h11cho=mn4o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho c6h13-1+mp3oxo=mn3o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+mn3oxo=mn3o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h me2j+c6h13cho=mn3o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho c7h15-1+me2oxo=mn2o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+mn2oxo=mn2o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h ch3oco+c7h15cho=mn2o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho naoj+ch2o=mnmo 1.000E+11 0.000 11900.0 !18 Huge mechanism ch3o+ch2o h+mnmoxo=mnmo 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h ! c2h5+mh6oxo=mo6o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+mo6oxo=mo6o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h mf5j+c2h5cho=mo6o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho nc3h7+mf5oxo=mo5o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+mo5oxo=mo5o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h mb4j+c3h7cho=mo5o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho pc4h9+mb4oxo=mo4o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+mo4oxo=mo4o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h mp3j+c4h9cho=mo4o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho c5h11-1+mp3oxo=mo3o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+mo3oxo=mo3o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h me2j+c5h11cho=mo3o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho c6h13-1+me2oxo=mo2o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+mo2oxo=mo2o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h ch3oco+c6h13cho=mo2o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho oaoj+ch2o=mamo 1.000E+11 0.000 11900.0 !18 Huge mechanism ch3o+ch2o h+mamoxo=mamo 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h ! c2h5+mf5oxo=ms5o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+ms5oxo=ms5o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h mb4j+c2h5cho=ms5o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho nc3h7+mb4oxo=ms4o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+ms4oxo=ms4o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h mp3j+c3h7cho=ms4o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho pc4h9+mp3oxo=ms3o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+ms3oxo=ms3o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h me2j+c4h9cho=ms3o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho c5h11-1+me2oxo=ms2o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+ms2oxo=ms2o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h ch3oco+c5h11cho=ms2o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho saoj+ch2o=msmo 1.000E+11 0.000 11900.0 !18 Huge mechanism ch3o+ch2o h+msmoxo=msmo 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h ! c2h5+mb4oxo=mh4o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+mh4oxo=mh4o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h mp3j+c2h5cho=mh4o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho nc3h7+mp3oxo=mh3o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+mh3oxo=mh3o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h me2j+c3h7cho=mh3o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho pc4h9+me2oxo=mh2o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+mh2oxo=mh2o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h ch3oco+c4h9cho=mh2o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho haoj+ch2o=mhmo 1.000E+11 0.000 11900.0 !18 Huge mechanism ch3o+ch2o h+mhmoxo=mhmo 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h ! c2h5+mp3oxo=mf3o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+mf3oxo=mf3o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h me2j+c2h5cho=mf3o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho nc3h7+me2oxo=mf2o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+mf2oxo=mf2o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h ch3oco+c3h7cho=mf2o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho faoj+ch2o=mfmo 1.000E+11 0.000 11900.0 !18 Huge mechanism ch3o+ch2o h+mfmoxo=mfmo 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h ! c2h5+me2oxo=mb2o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+mb2oxo=mb2o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h ch3oco+c2h5cho=mb2o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho baoj+ch2o=mbmo 1.000E+11 0.000 11900.0 !18 Huge mechanism ch3o+ch2o h+mbmoxo=mbmo 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h ! paoj+ch2o=mpmo 1.000E+11 0.000 11900.0 !18 Huge mechanism ch3o+ch2o h+mpmoxo=mpmo 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h ! ch3oco+ch2o=me2o 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+me2oxo=me2o 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h eaoj+ch2o=memo 1.000E+11 0.000 11900.0 !18 Huge mechanism ch3o+ch2o h+memoxo=memo 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h ! !c2h5+c2h5cho=c5h11o-3 6.660E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho !h+c2h5coc2h5=c5h11o-3 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h ! !c2h5+c3h7cho=c6h13o-3 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho !h+c3h7coc2h5=c6h13o-3 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h !nc3h7+c2h5cho=c6h13o-3 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho ! !c2h5+c4h9cho=c7h15o-3 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho !h+c4h9coc2h5=c7h15o-3 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h !pc4h9+c2h5cho=c7h15o-3 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho !nc3h7+c3h7cho=c7h15o-4 6.660E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho !h+c3h7coc3h7=c7h15o-4 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h ! c2h5+c5h11cho=c8h17o-3 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+c5h11coc2h5=c8h17o-3 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h c5h11-1+c2h5cho=c8h17o-3 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho nc3h7+c4h9cho=c8h17o-4 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+c4h9coc3h7=c8h17o-4 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h pc4h9+c3h7cho=c8h17o-4 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho ! c2h5+c6h13cho=c9h19o-3 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+c6h13coc2h5=c9h19o-3 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h c6h13-1+c2h5cho=c9h19o-3 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho nc3h7+c5h11cho=c9h19o-4 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+c5h11coc3h7=c9h19o-4 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h c5h11-1+c3h7cho=c9h19o-4 3.330E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho pc4h9+c4h9cho=c9h19o-5 6.660E+10 0.000 06397.0 !18 Curran, 2006 c2h5+ch3cho h+c4h9coc4h9=c9h19o-5 2.000E+12 0.000 07270.0 !18 Curran, 2006 ch3coch3+h ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 19/decomposition of qooh to cyclic ethers ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! !c4h8ooh1-2=c4h8o1-2+oh 6.000e+11 0.000 22000.0 !19 oxirane !c4h8ooh1-3=c4h8o1-3+oh 7.500e+10 0.000 15250.0 !19 oxetane !c4h8ooh1-4=c4h8o1-4+oh 9.375e+09 0.000 07000.0 !19 oxalane !c4h8ooh2-1=c4h8o1-2+oh 6.000e+11 0.000 22000.0 !19 oxirane !c4h8ooh2-3=c4h8o2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane !c4h8ooh2-4=c4h8o1-3+oh 7.500e+10 0.000 15250.0 !19 oxetane ! !c5h10ooh1-2=c5h10o1-2+oh 6.000e+11 0.000 22000.0 !19 oxirane !c5h10ooh1-3=c5h10o1-3+oh 7.500e+10 0.000 15250.0 !19 oxetane !c5h10ooh1-4=c5h10o1-4+oh 9.375e+09 0.000 07000.0 !19 oxalane !c5h10ooh1-5=c5h10o1-5+oh 1.172e+09 0.000 01800.0 !19 oxane !c5h10ooh2-1=c5h10o1-2+oh 6.000e+11 0.000 22000.0 !19 oxirane !c5h10ooh2-3=c5h10o2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane !c5h10ooh2-4=c5h10o2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane !c5h10ooh2-5=c5h10o1-4+oh 9.375e+09 0.000 07000.0 !19 oxalane !c5h10ooh3-1=c5h10o1-3+oh 7.500e+10 0.000 15250.0 !19 oxetane !c5h10ooh3-2=c5h10o2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane ! !c6h12ooh1-2=c6h12o1-2+oh 6.000e+11 0.000 22000.0 !19 oxirane !c6h12ooh1-3=c6h12o1-3+oh 7.500e+10 0.000 15250.0 !19 oxetane !c6h12ooh1-4=c6h12o1-4+oh 9.375e+09 0.000 07000.0 !19 oxalane !c6h12ooh1-5=c6h12o1-5+oh 1.172e+09 0.000 01800.0 !19 oxane !c6h12ooh2-1=c6h12o1-2+oh 6.000e+11 0.000 22000.0 !19 oxirane !c6h12ooh2-3=c6h12o2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane !c6h12ooh2-4=c6h12o2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane !c6h12ooh2-5=c6h12o2-5+oh 9.375e+09 0.000 07000.0 !19 oxalane !c6h12ooh2-6=c6h12o1-5+oh 1.172e+09 0.000 01800.0 !19 oxane !c6h12ooh3-1=c6h12o1-3+oh 7.500e+10 0.000 15250.0 !19 oxetane !c6h12ooh3-2=c6h12o2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane !c6h12ooh3-4=c6h12o3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane !c6h12ooh3-5=c6h12o2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane !c6h12ooh3-6=c6h12o1-4+oh 9.375e+09 0.000 07000.0 !19 oxalane ! !c7h14ooh1-2=c7h14o1-2+oh 6.000e+11 0.000 22000.0 !19 oxirane !c7h14ooh1-3=c7h14o1-3+oh 7.500e+10 0.000 15250.0 !19 oxetane !c7h14ooh1-4=c7h14o1-4+oh 9.375e+09 0.000 07000.0 !19 oxalane !c7h14ooh1-5=c7h14o1-5+oh 1.172e+09 0.000 01800.0 !19 oxane !c7h14ooh2-1=c7h14o1-2+oh 6.000e+11 0.000 22000.0 !19 oxirane !c7h14ooh2-3=c7h14o2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane !c7h14ooh2-4=c7h14o2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane !c7h14ooh2-5=c7h14o2-5+oh 9.375e+09 0.000 07000.0 !19 oxalane !c7h14ooh2-6=c7h14o2-6+oh 1.172e+09 0.000 01800.0 !19 oxane !c7h14ooh3-1=c7h14o1-3+oh 7.500e+10 0.000 15250.0 !19 oxetane !c7h14ooh3-2=c7h14o2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane !c7h14ooh3-4=c7h14o3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane !c7h14ooh3-5=c7h14o3-5+oh 7.500e+10 0.000 15250.0 !19 oxetane !c7h14ooh3-6=c7h14o2-5+oh 9.375e+09 0.000 07000.0 !19 oxalane !c7h14ooh3-7=c7h14o1-5+oh 1.172e+09 0.000 01800.0 !19 oxane !c7h14ooh4-1=c7h14o1-4+oh 9.375e+09 0.000 07000.0 !19 oxalane !c7h14ooh4-2=c7h14o2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane !c7h14ooh4-3=c7h14o3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane ! c8h16ooh1-2=c8h16o1-2+oh 6.000e+11 0.000 22000.0 !19 oxirane c8h16ooh1-3=c8h16o1-3+oh 7.500e+10 0.000 15250.0 !19 oxetane c8h16ooh1-4=c8h16o1-4+oh 9.375e+09 0.000 07000.0 !19 oxalane c8h16ooh1-5=c8h16o1-5+oh 1.172e+09 0.000 01800.0 !19 oxane c8h16ooh2-1=c8h16o1-2+oh 6.000e+11 0.000 22000.0 !19 oxirane c8h16ooh2-3=c8h16o2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane c8h16ooh2-4=c8h16o2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane c8h16ooh2-5=c8h16o2-5+oh 9.375e+09 0.000 07000.0 !19 oxalane c8h16ooh2-6=c8h16o2-6+oh 1.172e+09 0.000 01800.0 !19 oxane c8h16ooh3-1=c8h16o1-3+oh 7.500e+10 0.000 15250.0 !19 oxetane c8h16ooh3-2=c8h16o2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane c8h16ooh3-4=c8h16o3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane c8h16ooh3-5=c8h16o3-5+oh 7.500e+10 0.000 15250.0 !19 oxetane c8h16ooh3-6=c8h16o3-6+oh 9.375e+09 0.000 07000.0 !19 oxalane c8h16ooh3-7=c8h16o2-6+oh 1.172e+09 0.000 01800.0 !19 oxane c8h16ooh4-1=c8h16o1-4+oh 9.375e+09 0.000 07000.0 !19 oxalane c8h16ooh4-2=c8h16o2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane c8h16ooh4-3=c8h16o3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane c8h16ooh4-5=c8h16o4-5+oh 6.000e+11 0.000 22000.0 !19 oxirane c8h16ooh4-6=c8h16o3-5+oh 7.500e+10 0.000 15250.0 !19 oxetane c8h16ooh4-7=c8h16o2-5+oh 9.375e+09 0.000 07000.0 !19 oxalane c8h16ooh4-8=c8h16o1-5+oh 1.172e+09 0.000 01800.0 !19 oxane ! c9h18ooh1-2=c9h18o1-2+oh 6.000e+11 0.000 22000.0 !19 oxirane c9h18ooh1-3=c9h18o1-3+oh 7.500e+10 0.000 15250.0 !19 oxetane c9h18ooh1-4=c9h18o1-4+oh 9.375e+09 0.000 07000.0 !19 oxalane c9h18ooh1-5=c9h18o1-5+oh 1.172e+09 0.000 01800.0 !19 oxane c9h18ooh2-1=c9h18o1-2+oh 6.000e+11 0.000 22000.0 !19 oxirane c9h18ooh2-3=c9h18o2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane c9h18ooh2-4=c9h18o2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane c9h18ooh2-5=c9h18o2-5+oh 9.375e+09 0.000 07000.0 !19 oxalane c9h18ooh2-6=c9h18o2-6+oh 1.172e+09 0.000 01800.0 !19 oxane c9h18ooh3-1=c9h18o1-3+oh 7.500e+10 0.000 15250.0 !19 oxetane c9h18ooh3-2=c9h18o2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane c9h18ooh3-4=c9h18o3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane c9h18ooh3-5=c9h18o3-5+oh 7.500e+10 0.000 15250.0 !19 oxetane c9h18ooh3-6=c9h18o3-6+oh 9.375e+09 0.000 07000.0 !19 oxalane c9h18ooh3-7=c9h18o3-7+oh 1.172e+09 0.000 01800.0 !19 oxane c9h18ooh4-1=c9h18o1-4+oh 9.375e+09 0.000 07000.0 !19 oxalane c9h18ooh4-2=c9h18o2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane c9h18ooh4-3=c9h18o3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane c9h18ooh4-5=c9h18o4-5+oh 6.000e+11 0.000 22000.0 !19 oxirane c9h18ooh4-6=c9h18o4-6+oh 7.500e+10 0.000 15250.0 !19 oxetane c9h18ooh4-7=c9h18o3-6+oh 9.375e+09 0.000 07000.0 !19 oxalane c9h18ooh4-8=c9h18o2-6+oh 1.172e+09 0.000 01800.0 !19 oxane c9h18ooh5-1=c9h18o1-5+oh 1.172e+09 0.000 01800.0 !19 oxane c9h18ooh5-2=c9h18o2-5+oh 9.375e+09 0.000 07000.0 !19 oxalane c9h18ooh5-3=c9h18o3-5+oh 7.500e+10 0.000 15250.0 !19 oxetane c9h18ooh5-4=c9h18o4-5+oh 6.000e+11 0.000 22000.0 !19 oxirane ! ! memooh2j=meom-2+oh 9.375e+09 0.000 07000.0 !19 oxalane me2oohmj=meom-2+oh 9.375e+09 0.000 07000.0 !19 oxalane ! mpmooh2j=mpom-2+oh 9.375e+09 0.000 07000.0 !19 oxalane mpmooh3j=mpom-3+oh 1.172e+09 0.000 01800.0 !19 oxane mp2oohmj=mpom-2+oh 9.375e+09 0.000 07000.0 !19 oxalane mp2ooh3j=mpo2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane mp3oohmj=mpo2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane mp3ooh2j=mpom-3+oh 1.172e+09 0.000 01800.0 !19 oxane ! mbmooh2j=mbom-2+oh 9.375e+09 0.000 07000.0 !19 oxalane mbmooh3j=mbom-3+oh 1.172e+09 0.000 01800.0 !19 oxane mb2oohmj=mbom-2+oh 9.375e+09 0.000 07000.0 !19 oxalane mb2ooh3j=mbo2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane mb2ooh4j=mbo2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane mb3oohmj=mbom-3+oh 1.172e+09 0.000 01800.0 !19 oxane mb3ooh2j=mbo2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane mb3ooh4j=mbo3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane mb4ooh3j=mbo3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane mb4ooh2j=mbo2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane ! mfmooh2j=mfom-2+oh 9.375e+09 0.000 07000.0 !19 oxalane mfmooh3j=mfom-3+oh 1.172e+09 0.000 01800.0 !19 oxane mf2oohmj=mfom-2+oh 9.375e+09 0.000 07000.0 !19 oxalane mf2ooh3j=mfo2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane mf2ooh4j=mfo2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane mf2ooh5j=mfo2-5+oh 9.375e+09 0.000 07000.0 !19 oxalane mf3oohmj=mfom-3+oh 1.172e+09 0.000 01800.0 !19 oxane mf3ooh2j=mfo2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane mf3ooh4j=mfo3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane mf3ooh5j=mfo3-5+oh 7.500e+10 0.000 15250.0 !19 oxetane mf4ooh3j=mfo3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane mf4ooh2j=mfo2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane mf4ooh5j=mfo4-5+oh 6.000e+11 0.000 22000.0 !19 oxirane mf5ooh4j=mfo4-5+oh 6.000e+11 0.000 22000.0 !19 oxirane mf5ooh3j=mfo3-5+oh 7.500e+10 0.000 15250.0 !19 oxetane mf5ooh2j=mfo2-5+oh 9.375e+09 0.000 07000.0 !19 oxalane ! mhmooh2j=mhom-2+oh 9.375e+09 0.000 07000.0 !19 oxalane mhmooh3j=mhom-3+oh 1.172e+09 0.000 01800.0 !19 oxane mh2oohmj=mhom-2+oh 9.375e+09 0.000 07000.0 !19 oxalane mh2ooh3j=mho2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane mh2ooh4j=mho2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane mh2ooh5j=mho2-5+oh 9.375e+09 0.000 07000.0 !19 oxalane mh2ooh6j=mho2-6+oh 1.172e+09 0.000 01800.0 !19 oxane mh3oohmj=mhom-3+oh 1.172e+09 0.000 01800.0 !19 oxane mh3ooh2j=mho2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane mh3ooh4j=mho3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane mh3ooh5j=mho3-5+oh 7.500e+10 0.000 15250.0 !19 oxetane mh3ooh6j=mho3-6+oh 9.375e+09 0.000 07000.0 !19 oxalane mh4ooh3j=mho3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane mh4ooh2j=mho2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane mh4ooh5j=mho4-5+oh 6.000e+11 0.000 22000.0 !19 oxirane mh4ooh6j=mho4-6+oh 7.500e+10 0.000 15250.0 !19 oxetane mh5ooh4j=mho4-5+oh 6.000e+11 0.000 22000.0 !19 oxirane mh5ooh3j=mho3-5+oh 7.500e+10 0.000 15250.0 !19 oxetane mh5ooh2j=mho2-5+oh 9.375e+09 0.000 07000.0 !19 oxalane mh5ooh6j=mho5-6+oh 6.000e+11 0.000 22000.0 !19 oxirane mh6ooh5j=mho5-6+oh 6.000e+11 0.000 22000.0 !19 oxirane mh6ooh4j=mho4-6+oh 7.500e+10 0.000 15250.0 !19 oxetane mh6ooh3j=mho3-6+oh 9.375e+09 0.000 07000.0 !19 oxalane mh6ooh2j=mho2-6+oh 1.172e+09 0.000 01800.0 !19 oxane ! msmooh2j=msom-2+oh 9.375e+09 0.000 07000.0 !19 oxalane msmooh3j=msom-3+oh 1.172e+09 0.000 01800.0 !19 oxane ms2oohmj=msom-2+oh 9.375e+09 0.000 07000.0 !19 oxalane ms2ooh3j=mso2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane ms2ooh4j=mso2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane ms2ooh5j=mso2-5+oh 9.375e+09 0.000 07000.0 !19 oxalane ms2ooh6j=mso2-6+oh 1.172e+09 0.000 01800.0 !19 oxane ms3oohmj=msom-3+oh 1.172e+09 0.000 01800.0 !19 oxane ms3ooh2j=mso2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane ms3ooh4j=mso3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane ms3ooh5j=mso3-5+oh 7.500e+10 0.000 15250.0 !19 oxetane ms3ooh6j=mso3-6+oh 9.375e+09 0.000 07000.0 !19 oxalane ms3ooh7j=mso3-7+oh 1.172e+09 0.000 01800.0 !19 oxane ms4ooh3j=mso3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane ms4ooh2j=mso2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane ms4ooh5j=mso4-5+oh 6.000e+11 0.000 22000.0 !19 oxirane ms4ooh6j=mso4-6+oh 7.500e+10 0.000 15250.0 !19 oxetane ms4ooh7j=mso4-7+oh 9.375e+09 0.000 07000.0 !19 oxalane ms5ooh4j=mso4-5+oh 6.000e+11 0.000 22000.0 !19 oxirane ms5ooh3j=mso3-5+oh 7.500e+10 0.000 15250.0 !19 oxetane ms5ooh2j=mso2-5+oh 9.375e+09 0.000 07000.0 !19 oxalane ms5ooh6j=mso5-6+oh 6.000e+11 0.000 22000.0 !19 oxirane ms5ooh7j=mso5-7+oh 7.500e+10 0.000 15250.0 !19 oxetane ms6ooh5j=mso5-6+oh 6.000e+11 0.000 22000.0 !19 oxirane ms6ooh4j=mso4-6+oh 7.500e+10 0.000 15250.0 !19 oxetane ms6ooh3j=mso3-6+oh 9.375e+09 0.000 07000.0 !19 oxalane ms6ooh2j=mso2-6+oh 1.172e+09 0.000 01800.0 !19 oxane ms6ooh7j=mso6-7+oh 6.000e+11 0.000 22000.0 !19 oxirane ms7ooh6j=mso6-7+oh 6.000e+11 0.000 22000.0 !19 oxirane ms7ooh5j=mso5-7+oh 7.500e+10 0.000 15250.0 !19 oxetane ms7ooh4j=mso4-7+oh 9.375e+09 0.000 07000.0 !19 oxalane ms7ooh3j=mso3-7+oh 1.172e+09 0.000 01800.0 !19 oxane ! mamooh2j=moom-2+oh 9.375e+09 0.000 07000.0 !19 oxalane mamooh3j=moom-3+oh 1.172e+09 0.000 01800.0 !19 oxane mo2oohmj=moom-2+oh 9.375e+09 0.000 07000.0 !19 oxalane mo2ooh3j=moo2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane mo2ooh4j=moo2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane mo2ooh5j=moo2-5+oh 9.375e+09 0.000 07000.0 !19 oxalane mo2ooh6j=moo2-6+oh 1.172e+09 0.000 01800.0 !19 oxane mo3oohmj=moom-3+oh 1.172e+09 0.000 01800.0 !19 oxane mo3ooh2j=moo2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane mo3ooh4j=moo3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane mo3ooh5j=moo3-5+oh 7.500e+10 0.000 15250.0 !19 oxetane mo3ooh6j=moo3-6+oh 9.375e+09 0.000 07000.0 !19 oxalane mo3ooh7j=moo3-7+oh 1.172e+09 0.000 01800.0 !19 oxane mo4ooh3j=moo3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane mo4ooh2j=moo2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane mo4ooh5j=moo4-5+oh 6.000e+11 0.000 22000.0 !19 oxirane mo4ooh6j=moo4-6+oh 7.500e+10 0.000 15250.0 !19 oxetane mo4ooh7j=moo4-7+oh 9.375e+09 0.000 07000.0 !19 oxalane mo4ooh8j=moo4-8+oh 1.172e+09 0.000 01800.0 !19 oxane mo5ooh4j=moo4-5+oh 6.000e+11 0.000 22000.0 !19 oxirane mo5ooh3j=moo3-5+oh 7.500e+10 0.000 15250.0 !19 oxetane mo5ooh2j=moo2-5+oh 9.375e+09 0.000 07000.0 !19 oxalane mo5ooh6j=moo5-6+oh 6.000e+11 0.000 22000.0 !19 oxirane mo5ooh7j=moo5-7+oh 7.500e+10 0.000 15250.0 !19 oxetane mo5ooh8j=moo5-8+oh 9.375e+09 0.000 07000.0 !19 oxalane mo6ooh5j=moo5-6+oh 6.000e+11 0.000 22000.0 !19 oxirane mo6ooh4j=moo4-6+oh 7.500e+10 0.000 15250.0 !19 oxetane mo6ooh3j=moo3-6+oh 9.375e+09 0.000 07000.0 !19 oxalane mo6ooh2j=moo2-6+oh 1.172e+09 0.000 01800.0 !19 oxane mo6ooh7j=moo6-7+oh 6.000e+11 0.000 22000.0 !19 oxirane mo6ooh8j=moo6-8+oh 7.500e+10 0.000 15250.0 !19 oxetane mo7ooh6j=moo6-7+oh 6.000e+11 0.000 22000.0 !19 oxirane mo7ooh5j=moo5-7+oh 7.500e+10 0.000 15250.0 !19 oxetane mo7ooh4j=moo4-7+oh 9.375e+09 0.000 07000.0 !19 oxalane mo7ooh3j=moo3-7+oh 1.172e+09 0.000 01800.0 !19 oxane mo7ooh8j=moo7-8+oh 6.000e+11 0.000 22000.0 !19 oxirane mo8ooh7j=moo7-8+oh 6.000e+11 0.000 22000.0 !19 oxirane mo8ooh6j=moo6-8+oh 7.500e+10 0.000 15250.0 !19 oxetane mo8ooh5j=moo5-8+oh 9.375e+09 0.000 07000.0 !19 oxalane mo8ooh4j=moo4-8+oh 1.172e+09 0.000 01800.0 !19 oxane ! mnmooh2j=mnom-2+oh 9.375e+09 0.000 07000.0 !19 oxalane mnmooh3j=mnom-3+oh 1.172e+09 0.000 01800.0 !19 oxane mn2oohmj=mnom-2+oh 9.375e+09 0.000 07000.0 !19 oxalane mn2ooh3j=mno2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane mn2ooh4j=mno2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane mn2ooh5j=mno2-5+oh 9.375e+09 0.000 07000.0 !19 oxalane mn2ooh6j=mno2-6+oh 1.172e+09 0.000 01800.0 !19 oxane mn3oohmj=mnom-3+oh 1.172e+09 0.000 01800.0 !19 oxane mn3ooh2j=mno2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane mn3ooh4j=mno3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane mn3ooh5j=mno3-5+oh 7.500e+10 0.000 15250.0 !19 oxetane mn3ooh6j=mno3-6+oh 9.375e+09 0.000 07000.0 !19 oxalane mn3ooh7j=mno3-7+oh 1.172e+09 0.000 01800.0 !19 oxane mn4ooh3j=mno3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane mn4ooh2j=mno2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane mn4ooh5j=mno4-5+oh 6.000e+11 0.000 22000.0 !19 oxirane mn4ooh6j=mno4-6+oh 7.500e+10 0.000 15250.0 !19 oxetane mn4ooh7j=mno4-7+oh 9.375e+09 0.000 07000.0 !19 oxalane mn4ooh8j=mno4-8+oh 1.172e+09 0.000 01800.0 !19 oxane mn5ooh4j=mno4-5+oh 6.000e+11 0.000 22000.0 !19 oxirane mn5ooh3j=mno3-5+oh 7.500e+10 0.000 15250.0 !19 oxetane mn5ooh2j=mno2-5+oh 9.375e+09 0.000 07000.0 !19 oxalane mn5ooh6j=mno5-6+oh 6.000e+11 0.000 22000.0 !19 oxirane mn5ooh7j=mno5-7+oh 7.500e+10 0.000 15250.0 !19 oxetane mn5ooh8j=mno5-8+oh 9.375e+09 0.000 07000.0 !19 oxalane mn5ooh9j=mno5-9+oh 1.172e+09 0.000 01800.0 !19 oxane mn6ooh5j=mno5-6+oh 6.000e+11 0.000 22000.0 !19 oxirane mn6ooh4j=mno4-6+oh 7.500e+10 0.000 15250.0 !19 oxetane mn6ooh3j=mno3-6+oh 9.375e+09 0.000 07000.0 !19 oxalane mn6ooh2j=mno2-6+oh 1.172e+09 0.000 01800.0 !19 oxane mn6ooh7j=mno6-7+oh 6.000e+11 0.000 22000.0 !19 oxirane mn6ooh8j=mno6-8+oh 7.500e+10 0.000 15250.0 !19 oxetane mn6ooh9j=mno6-9+oh 9.375e+09 0.000 07000.0 !19 oxalane mn7ooh6j=mno6-7+oh 6.000e+11 0.000 22000.0 !19 oxirane mn7ooh5j=mno5-7+oh 7.500e+10 0.000 15250.0 !19 oxetane mn7ooh4j=mno4-7+oh 9.375e+09 0.000 07000.0 !19 oxalane mn7ooh3j=mno3-7+oh 1.172e+09 0.000 01800.0 !19 oxane mn7ooh8j=mno7-8+oh 6.000e+11 0.000 22000.0 !19 oxirane mn7ooh9j=mno7-9+oh 7.500e+10 0.000 15250.0 !19 oxetane mn8ooh7j=mno7-8+oh 6.000e+11 0.000 22000.0 !19 oxirane mn8ooh6j=mno6-8+oh 7.500e+10 0.000 15250.0 !19 oxetane mn8ooh5j=mno5-8+oh 9.375e+09 0.000 07000.0 !19 oxalane mn8ooh4j=mno4-8+oh 1.172e+09 0.000 01800.0 !19 oxane mn8ooh9j=mno8-9+oh 6.000e+11 0.000 22000.0 !19 oxirane mn9ooh8j=mno8-9+oh 6.000e+11 0.000 22000.0 !19 oxirane mn9ooh7j=mno7-9+oh 7.500e+10 0.000 15250.0 !19 oxetane mn9ooh6j=mno6-9+oh 9.375e+09 0.000 07000.0 !19 oxalane mn9ooh5j=mno5-9+oh 1.172e+09 0.000 01800.0 !19 oxane ! mdmooh2j=mdom-2+oh 9.375e+09 0.000 07000.0 !19 oxalane mdmooh3j=mdom-3+oh 1.172e+09 0.000 01800.0 !19 oxane md2oohmj=mdom-2+oh 9.375e+09 0.000 07000.0 !19 oxalane md2ooh3j=mdo2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane md2ooh4j=mdo2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane md2ooh5j=mdo2-5+oh 9.375e+09 0.000 07000.0 !19 oxalane md2ooh6j=mdo2-6+oh 1.172e+09 0.000 01800.0 !19 oxane md3oohmj=mdom-3+oh 1.172e+09 0.000 01800.0 !19 oxane md3ooh2j=mdo2-3+oh 6.000e+11 0.000 22000.0 !19 oxirane md3ooh4j=mdo3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane md3ooh5j=mdo3-5+oh 7.500e+10 0.000 15250.0 !19 oxetane md3ooh6j=mdo3-6+oh 9.375e+09 0.000 07000.0 !19 oxalane md3ooh7j=mdo3-7+oh 1.172e+09 0.000 01800.0 !19 oxane md4ooh3j=mdo3-4+oh 6.000e+11 0.000 22000.0 !19 oxirane md4ooh2j=mdo2-4+oh 7.500e+10 0.000 15250.0 !19 oxetane md4ooh5j=mdo4-5+oh 6.000e+11 0.000 22000.0 !19 oxirane md4ooh6j=mdo4-6+oh 7.500e+10 0.000 15250.0 !19 oxetane md4ooh7j=mdo4-7+oh 9.375e+09 0.000 07000.0 !19 oxalane md4ooh8j=mdo4-8+oh 1.172e+09 0.000 01800.0 !19 oxane md5ooh4j=mdo4-5+oh 6.000e+11 0.000 22000.0 !19 oxirane md5ooh3j=mdo3-5+oh 7.500e+10 0.000 15250.0 !19 oxetane md5ooh2j=mdo2-5+oh 9.375e+09 0.000 07000.0 !19 oxalane md5ooh6j=mdo5-6+oh 6.000e+11 0.000 22000.0 !19 oxirane md5ooh7j=mdo5-7+oh 7.500e+10 0.000 15250.0 !19 oxetane md5ooh8j=mdo5-8+oh 9.375e+09 0.000 07000.0 !19 oxalane md5ooh9j=mdo5-9+oh 1.172e+09 0.000 01800.0 !19 oxane md6ooh5j=mdo5-6+oh 6.000e+11 0.000 22000.0 !19 oxirane md6ooh4j=mdo4-6+oh 7.500e+10 0.000 15250.0 !19 oxetane md6ooh3j=mdo3-6+oh 9.375e+09 0.000 07000.0 !19 oxalane md6ooh2j=mdo2-6+oh 1.172e+09 0.000 01800.0 !19 oxane md6ooh7j=mdo6-7+oh 6.000e+11 0.000 22000.0 !19 oxirane md6ooh8j=mdo6-8+oh 7.500e+10 0.000 15250.0 !19 oxetane md6ooh9j=mdo6-9+oh 9.375e+09 0.000 07000.0 !19 oxalane md6ooh10j=mdo6-10+oh 1.172e+09 0.000 01800.0 !19 oxane md7ooh6j=mdo6-7+oh 6.000e+11 0.000 22000.0 !19 oxirane md7ooh5j=mdo5-7+oh 7.500e+10 0.000 15250.0 !19 oxetane md7ooh4j=mdo4-7+oh 9.375e+09 0.000 07000.0 !19 oxalane md7ooh3j=mdo3-7+oh 1.172e+09 0.000 01800.0 !19 oxane md7ooh8j=mdo7-8+oh 6.000e+11 0.000 22000.0 !19 oxirane md7ooh9j=mdo7-9+oh 7.500e+10 0.000 15250.0 !19 oxetane md7ooh10j=mdo7-10+oh 9.375e+09 0.000 07000.0 !19 oxalane md8ooh7j=mdo7-8+oh 6.000e+11 0.000 22000.0 !19 oxirane md8ooh6j=mdo6-8+oh 7.500e+10 0.000 15250.0 !19 oxetane md8ooh5j=mdo5-8+oh 9.375e+09 0.000 07000.0 !19 oxalane md8ooh4j=mdo4-8+oh 1.172e+09 0.000 01800.0 !19 oxane md8ooh9j=mdo8-9+oh 6.000e+11 0.000 22000.0 !19 oxirane md8ooh10j=mdo8-10+oh 7.500e+10 0.000 15250.0 !19 oxetane md9ooh8j=mdo8-9+oh 6.000e+11 0.000 22000.0 !19 oxirane md9ooh7j=mdo7-9+oh 7.500e+10 0.000 15250.0 !19 oxetane md9ooh6j=mdo6-9+oh 9.375e+09 0.000 07000.0 !19 oxalane md9ooh5j=mdo5-9+oh 1.172e+09 0.000 01800.0 !19 oxane md9ooh10j=mdo9-10+oh 6.000e+11 0.000 22000.0 !19 oxirane md10ooh9j=mdo9-10+oh 6.000e+11 0.000 22000.0 !19 oxirane md10ooh8j=mdo8-10+oh 7.500e+10 0.000 15250.0 !19 oxetane md10ooh7j=mdo7-10+oh 9.375e+09 0.000 07000.0 !19 oxalane md10ooh6j=mdo6-10+oh 1.172e+09 0.000 01800.0 !19 oxane ! ch2ocoooh=cych2ocoo+oh 7.500E+10 0.000 15250.0 !19 oxetane c9h18coooh2j=cyc9h19coo2+oh 6.000E+11 0.000 22000.0 !19 oxirane c9h18coooh3j=cyc9h19coo3+oh 7.500E+10 0.000 15250.0 !19 oxetane c9h18coooh4j=cyc9h19coo4+oh 9.375E+09 0.000 07000.0 !19 oxalane c9h18coooh5j=cyc9h19coo5+oh 1.172E+09 0.000 01800.0 !19 oxane ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 20-I/qooh = olefin + ho2 ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! ! !c4h8-1+ho2=c4h8ooh1-2 1.000e+11 0.000 10750.0 !20-I !c4h8-1+ho2=c4h8ooh2-1 1.000e+11 0.000 11750.0 !20-I !c4h8-2+ho2=c4h8ooh2-3 1.000e+11 0.000 11750.0 !20-I ! !c5h10-1+ho2=c5h10ooh1-2 1.000e+11 0.000 10750.0 !20-I !c5h10-1+ho2=c5h10ooh2-1 1.000e+11 0.000 11750.0 !20-I !c5h10-2+ho2=c5h10ooh2-3 1.000e+11 0.000 11750.0 !20-I !c5h10-2+ho2=c5h10ooh3-2 2.000e+11 0.000 11750.0 !20-I ! !c6h12-1+ho2=c6h12ooh1-2 1.000e+11 0.000 10750.0 !20-I !c6h12-1+ho2=c6h12ooh2-1 1.000e+11 0.000 11750.0 !20-I !c6h12-2+ho2=c6h12ooh2-3 1.000e+11 0.000 11750.0 !20-I !c6h12-2+ho2=c6h12ooh3-2 1.000e+11 0.000 11750.0 !20-I !c6h12-3+ho2=c6h12ooh3-4 1.000e+11 0.000 11750.0 !20-I ! !c7h14-1+ho2=c7h14ooh1-2 1.000e+11 0.000 10750.0 !20-I !c7h14-1+ho2=c7h14ooh2-1 1.000e+11 0.000 11750.0 !20-I !c7h14-2+ho2=c7h14ooh2-3 1.000e+11 0.000 11750.0 !20-I !c7h14-2+ho2=c7h14ooh3-2 1.000e+11 0.000 11750.0 !20-I !c7h14-3+ho2=c7h14ooh3-4 1.000e+11 0.000 11750.0 !20-I !c7h14-3+ho2=c7h14ooh4-3 2.000e+11 0.000 11750.0 !20-I ! c8h16-1+ho2=c8h16ooh1-2 1.000e+11 0.000 10750.0 !20-I c8h16-1+ho2=c8h16ooh2-1 1.000e+11 0.000 11750.0 !20-I c8h16-2+ho2=c8h16ooh2-3 1.000e+11 0.000 11750.0 !20-I c8h16-2+ho2=c8h16ooh3-2 1.000e+11 0.000 11750.0 !20-I c8h16-3+ho2=c8h16ooh3-4 1.000e+11 0.000 11750.0 !20-I c8h16-3+ho2=c8h16ooh4-3 1.000e+11 0.000 11750.0 !20-I c8h16-4+ho2=c8h16ooh4-5 1.000e+11 0.000 11750.0 !20-I ! c9h18-1+ho2=c9h18ooh1-2 1.000e+11 0.000 10750.0 !20-I c9h18-1+ho2=c9h18ooh2-1 1.000e+11 0.000 11750.0 !20-I c9h18-2+ho2=c9h18ooh2-3 1.000e+11 0.000 11750.0 !20-I c9h18-2+ho2=c9h18ooh3-2 1.000e+11 0.000 11750.0 !20-I c9h18-3+ho2=c9h18ooh3-4 1.000e+11 0.000 11750.0 !20-I c9h18-3+ho2=c9h18ooh4-3 1.000e+11 0.000 11750.0 !20-I c9h18-4+ho2=c9h18ooh4-5 1.000e+11 0.000 11750.0 !20-I c9h18-4+ho2=c9h18ooh5-4 2.000e+11 0.000 11750.0 !20-I ! ! mp2d+ho2=mp2ooh3j 1.000e+11 0.000 10750.0 !20-I mp2d+ho2=mp3ooh2j 1.000e+11 0.000 11750.0 !20-I ! mb2d+ho2=mb2ooh3j 1.000e+11 0.000 11750.0 !20-I mb2d+ho2=mb3ooh2j 1.000e+11 0.000 11750.0 !20-I mb3d+ho2=mb3ooh4j 1.000e+11 0.000 10750.0 !20-I mb3d+ho2=mb4ooh3j 1.000e+11 0.000 11750.0 !20-I ! mf2d+ho2=mf2ooh3j 1.000e+11 0.000 11750.0 !20-I mf2d+ho2=mf3ooh2j 1.000e+11 0.000 11750.0 !20-I mf3d+ho2=mf3ooh4j 1.000e+11 0.000 11750.0 !20-I mf3d+ho2=mf4ooh3j 1.000e+11 0.000 11750.0 !20-I mf4d+ho2=mf4ooh5j 1.000e+11 0.000 10750.0 !20-I mf4d+ho2=mf5ooh4j 1.000e+11 0.000 11750.0 !20-I ! mh2d+ho2=mh2ooh3j 1.000e+11 0.000 11750.0 !20-I mh2d+ho2=mh3ooh2j 1.000e+11 0.000 11750.0 !20-I mh3d+ho2=mh3ooh4j 1.000e+11 0.000 11750.0 !20-I mh3d+ho2=mh4ooh3j 1.000e+11 0.000 11750.0 !20-I mh4d+ho2=mh4ooh5j 1.000e+11 0.000 11750.0 !20-I mh4d+ho2=mh5ooh4j 1.000e+11 0.000 11750.0 !20-I mh5d+ho2=mh5ooh6j 1.000e+11 0.000 10750.0 !20-I mh5d+ho2=mh6ooh5j 1.000e+11 0.000 11750.0 !20-I ! ms2d+ho2=ms2ooh3j 1.000e+11 0.000 11750.0 !20-I ms2d+ho2=ms3ooh2j 1.000e+11 0.000 11750.0 !20-I ms3d+ho2=ms3ooh4j 1.000e+11 0.000 11750.0 !20-I ms3d+ho2=ms4ooh3j 1.000e+11 0.000 11750.0 !20-I ms4d+ho2=ms4ooh5j 1.000e+11 0.000 11750.0 !20-I ms4d+ho2=ms5ooh4j 1.000e+11 0.000 11750.0 !20-I ms5d+ho2=ms5ooh6j 1.000e+11 0.000 11750.0 !20-I ms5d+ho2=ms6ooh5j 1.000e+11 0.000 11750.0 !20-I ms6d+ho2=ms6ooh7j 1.000e+11 0.000 10750.0 !20-I ms6d+ho2=ms7ooh6j 1.000e+11 0.000 11750.0 !20-I ! mo2d+ho2=mo2ooh3j 1.000e+11 0.000 11750.0 !20-I mo2d+ho2=mo3ooh2j 1.000e+11 0.000 11750.0 !20-I mo3d+ho2=mo3ooh4j 1.000e+11 0.000 11750.0 !20-I mo3d+ho2=mo4ooh3j 1.000e+11 0.000 11750.0 !20-I mo4d+ho2=mo4ooh5j 1.000e+11 0.000 11750.0 !20-I mo4d+ho2=mo5ooh4j 1.000e+11 0.000 11750.0 !20-I mo5d+ho2=mo5ooh6j 1.000e+11 0.000 11750.0 !20-I mo5d+ho2=mo6ooh5j 1.000e+11 0.000 11750.0 !20-I mo6d+ho2=mo6ooh7j 1.000e+11 0.000 11750.0 !20-I mo6d+ho2=mo7ooh6j 1.000e+11 0.000 11750.0 !20-I mo7d+ho2=mo7ooh8j 1.000e+11 0.000 10750.0 !20-I mo7d+ho2=mo8ooh7j 1.000e+11 0.000 11750.0 !20-I ! mn2d+ho2=mn2ooh3j 1.000e+11 0.000 11750.0 !20-I mn2d+ho2=mn3ooh2j 1.000e+11 0.000 11750.0 !20-I mn3d+ho2=mn3ooh4j 1.000e+11 0.000 11750.0 !20-I mn3d+ho2=mn4ooh3j 1.000e+11 0.000 11750.0 !20-I mn4d+ho2=mn4ooh5j 1.000e+11 0.000 11750.0 !20-I mn4d+ho2=mn5ooh4j 1.000e+11 0.000 11750.0 !20-I mn5d+ho2=mn5ooh6j 1.000e+11 0.000 11750.0 !20-I mn5d+ho2=mn6ooh5j 1.000e+11 0.000 11750.0 !20-I mn6d+ho2=mn6ooh7j 1.000e+11 0.000 11750.0 !20-I mn6d+ho2=mn7ooh6j 1.000e+11 0.000 11750.0 !20-I mn7d+ho2=mn7ooh8j 1.000e+11 0.000 11750.0 !20-I mn7d+ho2=mn8ooh7j 1.000e+11 0.000 11750.0 !20-I mn8d+ho2=mn8ooh9j 1.000e+11 0.000 10750.0 !20-I mn8d+ho2=mn9ooh8j 1.000e+11 0.000 11750.0 !20-I ! md2d+ho2=md2ooh3j 1.000e+11 0.000 11750.0 !20-I md2d+ho2=md3ooh2j 1.000e+11 0.000 11750.0 !20-I md3d+ho2=md3ooh4j 1.000e+11 0.000 11750.0 !20-I md3d+ho2=md4ooh3j 1.000e+11 0.000 11750.0 !20-I md4d+ho2=md4ooh5j 1.000e+11 0.000 11750.0 !20-I md4d+ho2=md5ooh4j 1.000e+11 0.000 11750.0 !20-I md5d+ho2=md5ooh6j 1.000e+11 0.000 11750.0 !20-I md5d+ho2=md6ooh5j 1.000e+11 0.000 11750.0 !20-I md6d+ho2=md6ooh7j 1.000e+11 0.000 11750.0 !20-I md6d+ho2=md7ooh6j 1.000e+11 0.000 11750.0 !20-I md7d+ho2=md7ooh8j 1.000e+11 0.000 11750.0 !20-I md7d+ho2=md8ooh7j 1.000e+11 0.000 11750.0 !20-I md8d+ho2=md8ooh9j 1.000e+11 0.000 11750.0 !20-I md8d+ho2=md9ooh8j 1.000e+11 0.000 11750.0 !20-I md9d+ho2=md9ooh10j 1.000e+11 0.000 10750.0 !20-I md9d+ho2=md10ooh9j 1.000e+11 0.000 11750.0 !20-I ! c8h17chco+ho2=c9h18coooh2j 1.000E+11 0.000 10750.0 !20-I ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 20-II/other qooh decomposition ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! ch2ocoooh=ch2o+co2+oh 4.450E+14 0.000 27220.0 !20-II ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 21/qooh=olefin+carbonyl+oh ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! ! !c4h8ooh1-3=c3h6+ch2o+oh 6.637e+13 -0.160 29900.0 !21 ! rev/ 0.000e+00 0.000 00000.0 / !c4h8ooh2-4=c2h4+ch3cho+oh 1.945e+18 -1.630 26790.0 !21 ! rev/ 0.000e+00 0.000 00000.0 / !c5h10ooh1-3=c4h8-1+ch2o+oh 8.283e+13 -0.170 30090.0 !21 ! rev/ 0.000e+00 0.000 00000.0 / !c5h10ooh2-4=c3h6+ch3cho+oh 8.312e+17 -1.400 27170.0 !21 ! rev/ 0.000e+00 0.000 00000.0 / !c5h10ooh3-1=c2h4+c2h5cho+oh 3.096e+18 -1.730 26820.0 !21 ! rev/ 0.000e+00 0.000 00000.0 / !c6h12ooh1-3=c5h10-1+ch2o+oh 7.703E+13 -0.160 30090.0 !21 ! rev/ 0.000e+00 0.000 00000.0 / !c6h12ooh2-4=c4h8-1+ch3cho+oh 2.933E+18 -1.700 24080.0 !21 ! rev/ 0.000e+00 0.000 00000.0 / !c6h12ooh3-5=c3h6+c2h5cho+oh 1.171E+17 -1.310 28880.0 !21 ! rev/ 0.000e+00 0.000 00000.0 / !c6h12ooh3-1=c2h4+c3h7cho+oh 7.326E+18 -1.740 27420.0 !21 ! rev/ 0.000e+00 0.000 00000.0 / !c7h14ooh1-3=c6h12-1+ch2o+oh 8.120E+13 -0.140 31090.0 !21 ! rev/ 0.000e+00 0.000 00000.0 / !c7h14ooh2-4=c5h10-1+ch3cho+oh 5.364E+17 -1.400 26750.0 !21 ! rev/ 0.000e+00 0.000 00000.0 / !c7h14ooh3-5=c4h8-1+c2h5cho+oh 2.470E+18 -1.550 27020.0 !21 ! rev/ 0.000e+00 0.000 00000.0 / !c7h14ooh3-1=c2h4+c4h9cho+oh 2.212E+19 -1.670 26980.0 !21 ! rev/ 0.000e+00 0.000 00000.0 / !c7h14ooh4-2=c3h6+c3h7cho+oh 1.300E+18 -1.490 26800.0 !21 ! rev/ 0.000e+00 0.000 00000.0 / c8h16ooh1-3=c7h14-1+ch2o+oh 8.120E+13 -0.140 31090.0 !21 rev/ 0.000e+00 0.000 00000.0 / c8h16ooh2-4=c6h12-1+ch3cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / c8h16ooh3-5=c5h10-1+c2h5cho+oh 2.470E+18 -1.550 27020.0 !21 rev/ 0.000e+00 0.000 00000.0 / c8h16ooh3-1=c2h4+c5h11cho+oh 2.212E+19 -1.670 26980.0 !21 rev/ 0.000e+00 0.000 00000.0 / c8h16ooh4-6=c4h8-1+c3h7cho+oh 2.470E+18 -1.550 27020.0 !21 rev/ 0.000e+00 0.000 00000.0 / c8h16ooh4-2=c3h6+c4h9cho+oh 1.300E+18 -1.490 26800.0 !21 rev/ 0.000e+00 0.000 00000.0 / c9h18ooh1-3=c8h16-1+ch2o+oh 8.120E+13 -0.140 31090.0 !21 rev/ 0.000e+00 0.000 00000.0 / c9h18ooh2-4=c7h14-1+ch3cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / c9h18ooh3-5=c6h12-1+c2h5cho+oh 2.470E+18 -1.550 27020.0 !21 rev/ 0.000e+00 0.000 00000.0 / c9h18ooh3-1=c2h4+c6h13cho+oh 2.212E+19 -1.670 26980.0 !21 rev/ 0.000e+00 0.000 00000.0 / c9h18ooh4-6=c5h10-1+c3h7cho+oh 2.470E+18 -1.550 27020.0 !21 rev/ 0.000e+00 0.000 00000.0 / c9h18ooh4-2=c3h6+c5h11cho+oh 1.300E+18 -1.490 26800.0 !21 rev/ 0.000e+00 0.000 00000.0 / c9h18ooh5-3=c4h8-1+c4h9cho+oh 2.470E+18 -1.550 27020.0 !21 rev/ 0.000e+00 0.000 00000.0 / mb4ooh2j=mp2d+ch2o+oh 8.120E+13 -0.140 31090.0 !21 rev/ 0.000e+00 0.000 00000.0 / mb2ooh4j=c2h4+me2oxo+oh 7.326E+18 -1.740 27420.0 !21 rev/ 0.000e+00 0.000 00000.0 / mf5ooh3j=mb3d+ch2o+oh 8.120E+13 -0.140 31090.0 !21 rev/ 0.000e+00 0.000 00000.0 / mf4ooh2j=mp2d+ch3cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / mf3ooh5j=c2h4+mp3oxo+oh 7.326E+18 -1.740 27420.0 !21 rev/ 0.000e+00 0.000 00000.0 / mf2ooh4j=c3h6+me2oxo+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / mh6ooh4j=mf4d+ch2o+oh 8.120E+13 -0.140 31090.0 !21 rev/ 0.000e+00 0.000 00000.0 / mh5ooh3j=mb3d+ch3cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / mh4ooh2j=mp2d+c2h5cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / mh4ooh6j=c2h4+mb4oxo+oh 7.326E+18 -1.740 27420.0 !21 rev/ 0.000e+00 0.000 00000.0 / mh3ooh5j=c3h6+mp3oxo+oh 2.212E+19 -1.670 26980.0 !21 rev/ 0.000e+00 0.000 00000.0 / mh2ooh4j=c4h8-1+me2oxo+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / ms7ooh5j=mh5d+ch2o+oh 8.120E+13 -0.140 31090.0 !21 rev/ 0.000e+00 0.000 00000.0 / ms6ooh4j=mf4d+ch3cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / ms5ooh3j=mb3d+c2h5cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / ms4ooh2j=mp2d+c3h7cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / ms5ooh7j=c2h4+mf5oxo+oh 7.326E+18 -1.740 27420.0 !21 rev/ 0.000e+00 0.000 00000.0 / ms4ooh6j=c3h6+mb4oxo+oh 2.212E+19 -1.670 26980.0 !21 rev/ 0.000e+00 0.000 00000.0 / ms3ooh5j=c4h8-1+mp3oxo+oh 2.212E+19 -1.670 26980.0 !21 rev/ 0.000e+00 0.000 00000.0 / ms2ooh4j=c5h10-1+me2oxo+oh 2.212E+19 -1.670 26980.0 !21 rev/ 0.000e+00 0.000 00000.0 / mo8ooh6j=ms6d+ch2o+oh 8.120E+13 -0.140 31090.0 !21 rev/ 0.000e+00 0.000 00000.0 / mo7ooh5j=mh5d+ch3cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / mo6ooh4j=mf4d+c2h5cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / mo5ooh3j=mb3d+c3h7cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / mo4ooh2j=mp2d+c4h9cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / mo6ooh8j=c2h4+mh6oxo+oh 7.326E+18 -1.740 27420.0 !21 rev/ 0.000e+00 0.000 00000.0 / mo5ooh7j=c3h6+mf5oxo+oh 2.212E+19 -1.670 26980.0 !21 rev/ 0.000e+00 0.000 00000.0 / mo4ooh6j=c4h8-1+mb4oxo+oh 2.212E+19 -1.670 26980.0 !21 rev/ 0.000e+00 0.000 00000.0 / mo3ooh5j=c5h10-1+mp3oxo+oh 2.212E+19 -1.670 26980.0 !21 rev/ 0.000e+00 0.000 00000.0 / mo2ooh4j=c6h12-1+me2oxo+oh 2.212E+19 -1.670 26980.0 !21 rev/ 0.000e+00 0.000 00000.0 / mn9ooh7j=mo7d+ch2o+oh 8.120E+13 -0.140 31090.0 !21 rev/ 0.000e+00 0.000 00000.0 / mn8ooh6j=ms6d+ch3cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / mn7ooh5j=mh5d+c2h5cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / mn6ooh4j=mf4d+c3h7cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / mn5ooh3j=mb3d+c4h9cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / mn4ooh2j=mp2d+c5h11cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / mn7ooh9j=c2h4+ms7oxo+oh 7.326E+18 -1.740 27420.0 !21 rev/ 0.000e+00 0.000 00000.0 / mn6ooh8j=c3h6+mh6oxo+oh 2.212E+19 -1.670 26980.0 !21 rev/ 0.000e+00 0.000 00000.0 / mn5ooh7j=c4h8-1+mf5oxo+oh 2.212E+19 -1.670 26980.0 !21 rev/ 0.000e+00 0.000 00000.0 / mn4ooh6j=c5h10-1+mb4oxo+oh 2.212E+19 -1.670 26980.0 !21 rev/ 0.000e+00 0.000 00000.0 / mn3ooh5j=c6h12-1+mp3oxo+oh 2.212E+19 -1.670 26980.0 !21 rev/ 0.000e+00 0.000 00000.0 / mn2ooh4j=c7h14-1+me2oxo+oh 2.212E+19 -1.670 26980.0 !21 rev/ 0.000e+00 0.000 00000.0 / md10ooh8j=mn8d+ch2o+oh 8.120E+13 -0.140 31090.0 !21 rev/ 0.000e+00 0.000 00000.0 / md9ooh7j=mo7d+ch3cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / md8ooh6j=ms6d+c2h5cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / md7ooh5j=mh5d+c3h7cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / md6ooh4j=mf4d+c4h9cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / md5ooh3j=mb3d+c5h11cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / md4ooh2j=mp2d+c6h13cho+oh 5.364E+17 -1.400 26750.0 !21 rev/ 0.000e+00 0.000 00000.0 / md8ooh10j=c2h4+mo8oxo+oh 7.326E+18 -1.740 27420.0 !21 rev/ 0.000e+00 0.000 00000.0 / md7ooh9j=c3h6+ms7oxo+oh 2.212E+19 -1.670 26980.0 !21 rev/ 0.000e+00 0.000 00000.0 / md6ooh8j=c4h8-1+mh6oxo+oh 2.212E+19 -1.670 26980.0 !21 rev/ 0.000e+00 0.000 00000.0 / md5ooh7j=c5h10-1+mf5oxo+oh 2.212E+19 -1.670 26980.0 !21 rev/ 0.000e+00 0.000 00000.0 / md4ooh6j=c6h12-1+mb4oxo+oh 2.212E+19 -1.670 26980.0 !21 rev/ 0.000e+00 0.000 00000.0 / md3ooh5j=c7h14-1+mp3oxo+oh 2.212E+19 -1.670 26980.0 !21 rev/ 0.000e+00 0.000 00000.0 / md2ooh4j=c8h16-1+me2oxo+oh 2.212E+19 -1.670 26980.0 !21 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!! ! 22-QOOH+O2=OOQOOH ! !!!!!!!!!!!!!!!!!!!!!!!!! ! !Second addition to mdxoohyj radicals only ! mdmooh2j+o2=mdmooh2o2 7.540E+12 0.000 00000.0 !22 mdmooh3j+o2=mdmooh3o2 7.540E+12 0.000 00000.0 !22 md2oohmj+o2=md2oohmo2 7.540E+12 0.000 00000.0 !22 md2ooh3j+o2=md2ooh3o2 7.540E+12 0.000 00000.0 !22 md2ooh4j+o2=md2ooh4o2 7.540E+12 0.000 00000.0 !22 md2ooh5j+o2=md2ooh5o2 7.540E+12 0.000 00000.0 !22 md2ooh6j+o2=md2ooh6o2 7.540E+12 0.000 00000.0 !22 md3oohmj+o2=md3oohmo2 7.540E+12 0.000 00000.0 !22 md3ooh2j+o2=md3ooh2o2 7.540E+12 0.000 00000.0 !22 md3ooh4j+o2=md3ooh4o2 7.540E+12 0.000 00000.0 !22 md3ooh5j+o2=md3ooh5o2 7.540E+12 0.000 00000.0 !22 md3ooh6j+o2=md3ooh6o2 7.540E+12 0.000 00000.0 !22 md3ooh7j+o2=md3ooh7o2 7.540E+12 0.000 00000.0 !22 md4ooh3j+o2=md4ooh3o2 7.540E+12 0.000 00000.0 !22 md4ooh2j+o2=md4ooh2o2 7.540E+12 0.000 00000.0 !22 md4ooh5j+o2=md4ooh5o2 7.540E+12 0.000 00000.0 !22 md4ooh6j+o2=md4ooh6o2 7.540E+12 0.000 00000.0 !22 md4ooh7j+o2=md4ooh7o2 7.540E+12 0.000 00000.0 !22 md4ooh8j+o2=md4ooh8o2 7.540E+12 0.000 00000.0 !22 md5ooh4j+o2=md5ooh4o2 7.540E+12 0.000 00000.0 !22 md5ooh3j+o2=md5ooh3o2 7.540E+12 0.000 00000.0 !22 md5ooh2j+o2=md5ooh2o2 7.540E+12 0.000 00000.0 !22 md5ooh6j+o2=md5ooh6o2 7.540E+12 0.000 00000.0 !22 md5ooh7j+o2=md5ooh7o2 7.540E+12 0.000 00000.0 !22 md5ooh8j+o2=md5ooh8o2 7.540E+12 0.000 00000.0 !22 md5ooh9j+o2=md5ooh9o2 7.540E+12 0.000 00000.0 !22 md6ooh5j+o2=md6ooh5o2 7.540E+12 0.000 00000.0 !22 md6ooh4j+o2=md6ooh4o2 7.540E+12 0.000 00000.0 !22 md6ooh3j+o2=md6ooh3o2 7.540E+12 0.000 00000.0 !22 md6ooh2j+o2=md6ooh2o2 7.540E+12 0.000 00000.0 !22 md6ooh7j+o2=md6ooh7o2 7.540E+12 0.000 00000.0 !22 md6ooh8j+o2=md6ooh8o2 7.540E+12 0.000 00000.0 !22 md6ooh9j+o2=md6ooh9o2 7.540E+12 0.000 00000.0 !22 md6ooh10j+o2=md6ooh10o2 4.520E+12 0.000 00000.0 !22 md7ooh6j+o2=md7ooh6o2 7.540E+12 0.000 00000.0 !22 md7ooh5j+o2=md7ooh5o2 7.540E+12 0.000 00000.0 !22 md7ooh4j+o2=md7ooh4o2 7.540E+12 0.000 00000.0 !22 md7ooh3j+o2=md7ooh3o2 7.540E+12 0.000 00000.0 !22 md7ooh8j+o2=md7ooh8o2 7.540E+12 0.000 00000.0 !22 md7ooh9j+o2=md7ooh9o2 7.540E+12 0.000 00000.0 !22 md7ooh10j+o2=md7ooh10o2 4.520E+12 0.000 00000.0 !22 md8ooh7j+o2=md8ooh7o2 7.540E+12 0.000 00000.0 !22 md8ooh6j+o2=md8ooh6o2 7.540E+12 0.000 00000.0 !22 md8ooh5j+o2=md8ooh5o2 7.540E+12 0.000 00000.0 !22 md8ooh4j+o2=md8ooh4o2 7.540E+12 0.000 00000.0 !22 md8ooh9j+o2=md8ooh9o2 7.540E+12 0.000 00000.0 !22 md8ooh10j+o2=md8ooh10o2 4.520E+12 0.000 00000.0 !22 md9ooh8j+o2=md9ooh8o2 7.540E+12 0.000 00000.0 !22 md9ooh7j+o2=md9ooh7o2 7.540E+12 0.000 00000.0 !22 md9ooh6j+o2=md9ooh6o2 7.540E+12 0.000 00000.0 !22 md9ooh5j+o2=md9ooh5o2 7.540E+12 0.000 00000.0 !22 md9ooh10j+o2=md9ooh10o2 4.520E+12 0.000 00000.0 !22 md10ooh9j+o2=md10ooh9o2 7.540E+12 0.000 00000.0 !22 md10ooh8j+o2=md10ooh8o2 7.540E+12 0.000 00000.0 !22 md10ooh7j+o2=md10ooh7o2 7.540E+12 0.000 00000.0 !22 md10ooh6j+o2=md10ooh6o2 7.540E+12 0.000 00000.0 !22 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 23/OOQOOH isomerization to ketohydroperoxyde + oh ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! ! mdmooh2o2=mdketm2+oh 6.250E+09 0.000 19350.0 !23 7p mdmooh3o2=mdketm3+oh 3.907E+08 0.000 22550.0 !23 8p md2oohmo2=mdket2m+oh 3.125E+09 0.000 16050.0 !23 7s md2ooh3o2=mdket23+oh 1.000E+11 0.000 23850.0 !23 5s md2ooh4o2=mdket24+oh 1.250E+10 0.000 17850.0 !23 6s md2ooh5o2=mdket25+oh 3.125E+09 0.000 16050.0 !23 7s md2ooh6o2=mdket26+oh 1.563E+08 0.000 19050.0 !23 8s md3oohmo2=mdket3m+oh 1.563E+08 0.000 19050.0 !23 8s md3ooh2o2=mdket32+oh 1.000E+11 0.000 23850.0 !23 5s md3ooh4o2=mdket34+oh 1.000E+11 0.000 23850.0 !23 5s md3ooh5o2=mdket35+oh 1.250E+10 0.000 17850.0 !23 6s md3ooh6o2=mdket36+oh 3.125E+09 0.000 16050.0 !23 7s md3ooh7o2=mdket37+oh 1.563E+08 0.000 19050.0 !23 8s md4ooh3o2=mdket43+oh 1.000E+11 0.000 23850.0 !23 5s md4ooh2o2=mdket42+oh 1.250E+10 0.000 17850.0 !23 6s md4ooh5o2=mdket45+oh 1.000E+11 0.000 23850.0 !23 5s md4ooh6o2=mdket46+oh 1.250E+10 0.000 17850.0 !23 6s md4ooh7o2=mdket47+oh 3.125E+09 0.000 16050.0 !23 7s md4ooh8o2=mdket48+oh 1.563E+08 0.000 19050.0 !23 8s md5ooh4o2=mdket54+oh 1.000E+11 0.000 23850.0 !23 5s md5ooh3o2=mdket53+oh 1.250E+10 0.000 17850.0 !23 6s md5ooh2o2=mdket52+oh 3.125E+09 0.000 16050.0 !23 7s md5ooh6o2=mdket56+oh 1.000E+11 0.000 23850.0 !23 5s md5ooh7o2=mdket57+oh 1.250E+10 0.000 17850.0 !23 6s md5ooh8o2=mdket58+oh 3.125E+09 0.000 16050.0 !23 7s md5ooh9o2=mdket59+oh 1.563E+08 0.000 19050.0 !23 8s md6ooh5o2=mdket65+oh 1.000E+11 0.000 23850.0 !23 5s md6ooh4o2=mdket64+oh 1.250E+10 0.000 17850.0 !23 6s md6ooh3o2=mdket63+oh 3.125E+09 0.000 16050.0 !23 7s md6ooh2o2=mdket62+oh 1.563E+08 0.000 19050.0 !23 8s md6ooh7o2=mdket67+oh 1.000E+11 0.000 23850.0 !23 5s md6ooh8o2=mdket68+oh 1.250E+10 0.000 17850.0 !23 6s md6ooh9o2=mdket69+oh 3.125E+09 0.000 16050.0 !23 7s md6ooh10o2=mdket70+oh 1.563E+08 0.000 19050.0 !23 8s md7ooh6o2=mdket76+oh 1.000E+11 0.000 23850.0 !23 5s md7ooh5o2=mdket75+oh 1.250E+10 0.000 17850.0 !23 6s md7ooh4o2=mdket74+oh 3.125E+09 0.000 16050.0 !23 7s md7ooh3o2=mdket73+oh 1.563E+08 0.000 19050.0 !23 8s md7ooh8o2=mdket78+oh 1.000E+11 0.000 23850.0 !23 5s md7ooh9o2=mdket79+oh 1.250E+10 0.000 17850.0 !23 6s md7ooh10o2=mdket80+oh 3.125E+09 0.000 16050.0 !23 7s md8ooh7o2=mdket87+oh 1.000E+11 0.000 23850.0 !23 5s md8ooh6o2=mdket86+oh 1.250E+10 0.000 17850.0 !23 6s md8ooh5o2=mdket85+oh 3.125E+09 0.000 16050.0 !23 7s md8ooh4o2=mdket84+oh 1.563E+08 0.000 19050.0 !23 8s md8ooh9o2=mdket89+oh 1.000E+11 0.000 23850.0 !23 5s md8ooh10o2=mdket90+oh 1.250E+10 0.000 17850.0 !23 6s md9ooh8o2=mdket98+oh 1.000E+11 0.000 23850.0 !23 5s md9ooh7o2=mdket97+oh 1.250E+10 0.000 17850.0 !23 6s md9ooh6o2=mdket96+oh 3.125E+09 0.000 16050.0 !23 7s md9ooh5o2=mdket95+oh 1.563E+08 0.000 19050.0 !23 8s md9ooh10o2=mdket100+oh 1.000E+11 0.000 23850.0 !23 5s md10ooh9o2=mdket109+oh 2.000E+11 0.000 26400.0 !23 5p md10ooh8o2=mdket108+oh 2.500E+10 0.000 21400.0 !23 6p md10ooh7o2=mdket107+oh 6.250E+09 0.000 19350.0 !23 7p md10ooh6o2=mdket106+oh 3.907E+08 0.000 22550.0 !23 8p ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 23a/OOQOOH to alkeneooh + ho2 ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! ! mdmooh2o2=md2dmooh+ho2 4.680E+09 1.160 30870.0 !23a mdmooh3o2=md2dmooh+ho2 4.680E+09 1.160 30870.0 !23a mdmooh3o2=md3dmooh+ho2 4.680E+09 1.160 30870.0 !23a md2ooh3o2=md2d2ooh+ho2 4.680E+09 1.160 30870.0 !23a md2ooh3o2=md3d2ooh+ho2 4.680E+09 1.160 30870.0 !23a md2ooh4o2=md3d2ooh+ho2 4.680E+09 1.160 30870.0 !23a md2ooh4o2=md4d2ooh+ho2 4.680E+09 1.160 30870.0 !23a md2ooh5o2=md4d2ooh+ho2 4.680E+09 1.160 30870.0 !23a md2ooh5o2=md5d2ooh+ho2 4.680E+09 1.160 30870.0 !23a md2ooh6o2=md5d2ooh+ho2 4.680E+09 1.160 30870.0 !23a md2ooh6o2=md6d2ooh+ho2 4.680E+09 1.160 30870.0 !23a md3ooh2o2=md2d3ooh+ho2 4.680E+09 1.160 30870.0 !23a md3ooh4o2=md3d3ooh+ho2 4.680E+09 1.160 30870.0 !23a md3ooh4o2=md4d3ooh+ho2 4.680E+09 1.160 30870.0 !23a md3ooh5o2=md4d3ooh+ho2 4.680E+09 1.160 30870.0 !23a md3ooh5o2=md5d3ooh+ho2 4.680E+09 1.160 30870.0 !23a md3ooh6o2=md5d3ooh+ho2 4.680E+09 1.160 30870.0 !23a md3ooh6o2=md6d3ooh+ho2 4.680E+09 1.160 30870.0 !23a md3ooh7o2=md6d3ooh+ho2 4.680E+09 1.160 30870.0 !23a md3ooh7o2=md7d3ooh+ho2 4.680E+09 1.160 30870.0 !23a md4ooh2o2=md2d4ooh+ho2 4.680E+09 1.160 30870.0 !23a md4ooh3o2=md2d4ooh+ho2 4.680E+09 1.160 30870.0 !23a md4ooh3o2=md3d4ooh+ho2 4.680E+09 1.160 30870.0 !23a md4ooh5o2=md4d4ooh+ho2 4.680E+09 1.160 30870.0 !23a md4ooh5o2=md5d4ooh+ho2 4.680E+09 1.160 30870.0 !23a md4ooh6o2=md5d4ooh+ho2 4.680E+09 1.160 30870.0 !23a md4ooh6o2=md6d4ooh+ho2 4.680E+09 1.160 30870.0 !23a md4ooh7o2=md6d4ooh+ho2 4.680E+09 1.160 30870.0 !23a md4ooh7o2=md7d4ooh+ho2 4.680E+09 1.160 30870.0 !23a md4ooh8o2=md7d4ooh+ho2 4.680E+09 1.160 30870.0 !23a md4ooh8o2=md8d4ooh+ho2 4.680E+09 1.160 30870.0 !23a md5ooh2o2=md2d5ooh+ho2 4.680E+09 1.160 30870.0 !23a md5ooh3o2=md2d5ooh+ho2 4.680E+09 1.160 30870.0 !23a md5ooh3o2=md3d5ooh+ho2 4.680E+09 1.160 30870.0 !23a md5ooh4o2=md3d5ooh+ho2 4.680E+09 1.160 30870.0 !23a md5ooh4o2=md4d5ooh+ho2 4.680E+09 1.160 30870.0 !23a md5ooh6o2=md5d5ooh+ho2 4.680E+09 1.160 30870.0 !23a md5ooh6o2=md6d5ooh+ho2 4.680E+09 1.160 30870.0 !23a md5ooh7o2=md6d5ooh+ho2 4.680E+09 1.160 30870.0 !23a md5ooh7o2=md7d5ooh+ho2 4.680E+09 1.160 30870.0 !23a md5ooh8o2=md7d5ooh+ho2 4.680E+09 1.160 30870.0 !23a md5ooh8o2=md8d5ooh+ho2 4.680E+09 1.160 30870.0 !23a md5ooh9o2=md8d5ooh+ho2 4.680E+09 1.160 30870.0 !23a md5ooh9o2=md9d5ooh+ho2 4.680E+09 1.160 30870.0 !23a md6ooh2o2=md2d6ooh+ho2 4.680E+09 1.160 30870.0 !23a md6ooh3o2=md2d6ooh+ho2 4.680E+09 1.160 30870.0 !23a md6ooh3o2=md3d6ooh+ho2 4.680E+09 1.160 30870.0 !23a md6ooh4o2=md3d6ooh+ho2 4.680E+09 1.160 30870.0 !23a md6ooh4o2=md4d6ooh+ho2 4.680E+09 1.160 30870.0 !23a md6ooh5o2=md4d6ooh+ho2 4.680E+09 1.160 30870.0 !23a md6ooh5o2=md5d6ooh+ho2 4.680E+09 1.160 30870.0 !23a md6ooh7o2=md6d6ooh+ho2 4.680E+09 1.160 30870.0 !23a md6ooh7o2=md7d6ooh+ho2 4.680E+09 1.160 30870.0 !23a md6ooh8o2=md7d6ooh+ho2 4.680E+09 1.160 30870.0 !23a md6ooh8o2=md8d6ooh+ho2 4.680E+09 1.160 30870.0 !23a md6ooh9o2=md8d6ooh+ho2 4.680E+09 1.160 30870.0 !23a md6ooh9o2=md9d6ooh+ho2 4.680E+09 1.160 30870.0 !23a md6ooh10o2=md9d6ooh+ho2 3.780E+07 1.510 29640.0 !23a md7ooh3o2=md2d7ooh+ho2 4.680E+09 1.160 30870.0 !23a md7ooh3o2=md3d7ooh+ho2 4.680E+09 1.160 30870.0 !23a md7ooh4o2=md3d7ooh+ho2 4.680E+09 1.160 30870.0 !23a md7ooh4o2=md4d7ooh+ho2 4.680E+09 1.160 30870.0 !23a md7ooh5o2=md4d7ooh+ho2 4.680E+09 1.160 30870.0 !23a md7ooh5o2=md5d7ooh+ho2 4.680E+09 1.160 30870.0 !23a md7ooh6o2=md5d7ooh+ho2 4.680E+09 1.160 30870.0 !23a md7ooh6o2=md6d7ooh+ho2 4.680E+09 1.160 30870.0 !23a md7ooh8o2=md7d7ooh+ho2 4.680E+09 1.160 30870.0 !23a md7ooh8o2=md8d7ooh+ho2 4.680E+09 1.160 30870.0 !23a md7ooh9o2=md8d7ooh+ho2 4.680E+09 1.160 30870.0 !23a md7ooh9o2=md9d7ooh+ho2 4.680E+09 1.160 30870.0 !23a md7ooh10o2=md9d7ooh+ho2 3.780E+07 1.510 29640.0 !23a md8ooh4o2=md3d8ooh+ho2 4.680E+09 1.160 30870.0 !23a md8ooh4o2=md4d8ooh+ho2 4.680E+09 1.160 30870.0 !23a md8ooh5o2=md4d8ooh+ho2 4.680E+09 1.160 30870.0 !23a md8ooh5o2=md5d8ooh+ho2 4.680E+09 1.160 30870.0 !23a md8ooh6o2=md5d8ooh+ho2 4.680E+09 1.160 30870.0 !23a md8ooh6o2=md6d8ooh+ho2 4.680E+09 1.160 30870.0 !23a md8ooh7o2=md6d8ooh+ho2 4.680E+09 1.160 30870.0 !23a md8ooh7o2=md7d8ooh+ho2 4.680E+09 1.160 30870.0 !23a md8ooh9o2=md8d8ooh+ho2 4.680E+09 1.160 30870.0 !23a md8ooh9o2=md9d8ooh+ho2 4.680E+09 1.160 30870.0 !23a md8ooh10o2=md9d8ooh+ho2 3.780E+07 1.510 29640.0 !23a md9ooh5o2=md4d9ooh+ho2 4.680E+09 1.160 30870.0 !23a md9ooh5o2=md5d9ooh+ho2 4.680E+09 1.160 30870.0 !23a md9ooh6o2=md5d9ooh+ho2 4.680E+09 1.160 30870.0 !23a md9ooh6o2=md6d9ooh+ho2 4.680E+09 1.160 30870.0 !23a md9ooh7o2=md6d9ooh+ho2 4.680E+09 1.160 30870.0 !23a md9ooh7o2=md7d9ooh+ho2 4.680E+09 1.160 30870.0 !23a md9ooh8o2=md7d9ooh+ho2 4.680E+09 1.160 30870.0 !23a md9ooh8o2=md8d9ooh+ho2 4.680E+09 1.160 30870.0 !23a md9ooh10o2=md9d9ooh+ho2 3.780E+07 1.510 29640.0 !23a md10ooh6o2=md5d10ooh+ho2 4.680E+09 1.160 30870.0 !23a md10ooh6o2=md6d10ooh+ho2 4.680E+09 1.160 30870.0 !23a md10ooh7o2=md6d10ooh+ho2 4.680E+09 1.160 30870.0 !23a md10ooh7o2=md7d10ooh+ho2 4.680E+09 1.160 30870.0 !23a md10ooh8o2=md7d10ooh+ho2 4.680E+09 1.160 30870.0 !23a md10ooh8o2=md8d10ooh+ho2 4.680E+09 1.160 30870.0 !23a md10ooh9o2=md8d10ooh+ho2 4.680E+09 1.160 30870.0 !23a md10ooh9o2=md9d10ooh+ho2 4.680E+09 1.160 30870.0 !23a ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 23b/OOQOOH to HOOQOOH ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!! !except when HOOQOOH leads to a keto compounds + oh (see reaction type 23) ! mdmooh2o2=mddipxm2j3 2.000E+11 0.000 23850.0 !23b 5s -3000 mdmooh2o2=mddipxm2j4 2.500E+10 0.000 17850.0 !23b 6s -3000 mdmooh2o2=mddipxm2j5 6.250E+09 0.000 16050.0 !23b 7s -3000 mdmooh2o2=mddipxm2j6 3.907E+08 0.000 19050.0 !23b 8s -3000 mdmooh3o2=mddipxm3j2 2.000E+11 0.000 23850.0 !23b 5s -3000 mdmooh3o2=mddipxm3j4 2.000E+11 0.000 23850.0 !23b 5s -3000 mdmooh3o2=mddipxm3j5 2.500E+10 0.000 17850.0 !23b 6s -3000 mdmooh3o2=mddipxm3j6 6.250E+09 0.000 16050.0 !23b 7s -3000 mdmooh3o2=mddipxm3j7 3.907E+08 0.000 19050.0 !23b 8s -3000 md2oohmo2=mddipxm2j3 3.907E+08 0.000 19050.0 !23b 8s -3000 md2ooh3o2=mddipx23jm 5.860E+08 0.000 22550.0 !23b 8p -3000 md2ooh3o2=mddipx23j4 2.000E+11 0.000 23850.0 !23b 5s -3000 md2ooh3o2=mddipx23j5 2.500E+10 0.000 17850.0 !23b 6s -3000 md2ooh3o2=mddipx23j6 6.250E+09 0.000 16050.0 !23b 7s -3000 md2ooh3o2=mddipx23j7 3.907E+08 0.000 19050.0 !23b 8s -3000 md2ooh4o2=mddipx24j3 2.000E+11 0.000 23850.0 !23b 5s -3000 md2ooh4o2=mddipx24j5 2.000E+11 0.000 23850.0 !23b 5s -3000 md2ooh4o2=mddipx24j6 2.500E+10 0.000 17850.0 !23b 6s -3000 md2ooh4o2=mddipx24j7 6.250E+09 0.000 16050.0 !23b 7s -3000 md2ooh4o2=mddipx24j8 3.907E+08 0.000 19050.0 !23b 8s -3000 md2ooh5o2=mddipx25j3 2.500E+10 0.000 17850.0 !23b 6s -3000 md2ooh5o2=mddipx25j4 2.000E+11 0.000 23850.0 !23b 5s -3000 md2ooh5o2=mddipx25j6 2.000E+11 0.000 23850.0 !23b 5s -3000 md2ooh5o2=mddipx25j7 2.500E+10 0.000 17850.0 !23b 6s -3000 md2ooh5o2=mddipx25j8 6.250E+09 0.000 16050.0 !23b 7s -3000 md2ooh5o2=mddipx25j9 3.907E+08 0.000 19050.0 !23b 8s -3000 md2ooh6o2=mddipx26j3 6.250E+09 0.000 16050.0 !23b 7s -3000 md2ooh6o2=mddipx26j4 2.500E+10 0.000 17850.0 !23b 6s -3000 md2ooh6o2=mddipx26j5 2.000E+11 0.000 23850.0 !23b 5s -3000 md2ooh6o2=mddipx26j7 2.000E+11 0.000 23850.0 !23b 5s -3000 md2ooh6o2=mddipx26j8 2.500E+10 0.000 17850.0 !23b 6s -3000 md2ooh6o2=mddipx26j9 6.250E+09 0.000 16050.0 !23b 7s -3000 md2ooh6o2=mddipx26j10 5.860E+08 0.000 22550.0 !23b 8p -3000 md3oohmo2=mddipxm3j2 6.250E+09 0.000 16050.0 !23b 7s -3000 md3ooh2o2=mddipx23jm 9.375E+09 0.000 19350.0 !23b 7p -3000 md3ooh2o2=mddipx23j4 2.500E+10 0.000 17850.0 !23b 6s -3000 md3ooh2o2=mddipx23j5 6.250E+09 0.000 16050.0 !23b 7s -3000 md3ooh2o2=mddipx23j6 3.907E+08 0.000 19050.0 !23b 8s -3000 md3ooh4o2=mddipx34j2 2.500E+10 0.000 17850.0 !23b 6s -3000 md3ooh4o2=mddipx34j5 2.000E+11 0.000 23850.0 !23b 5s -3000 md3ooh4o2=mddipx34j6 2.500E+10 0.000 17850.0 !23b 6s -3000 md3ooh4o2=mddipx34j7 6.250E+09 0.000 16050.0 !23b 7s -3000 md3ooh4o2=mddipx34j8 3.907E+08 0.000 19050.0 !23b 8s -3000 md3ooh5o2=mddipx35j2 6.250E+09 0.000 16050.0 !23b 7s -3000 md3ooh5o2=mddipx35j4 2.000E+11 0.000 23850.0 !23b 5s -3000 md3ooh5o2=mddipx35j6 2.000E+11 0.000 23850.0 !23b 5s -3000 md3ooh5o2=mddipx35j7 2.500E+10 0.000 17850.0 !23b 6s -3000 md3ooh5o2=mddipx35j8 6.250E+09 0.000 16050.0 !23b 7s -3000 md3ooh5o2=mddipx35j9 3.907E+08 0.000 19050.0 !23b 8s -3000 md3ooh6o2=mddipx36j2 3.907E+08 0.000 19050.0 !23b 8s -3000 md3ooh6o2=mddipx36j4 2.500E+10 0.000 17850.0 !23b 6s -3000 md3ooh6o2=mddipx36j5 2.000E+11 0.000 23850.0 !23b 5s -3000 md3ooh6o2=mddipx36j7 2.000E+11 0.000 23850.0 !23b 5s -3000 md3ooh6o2=mddipx36j8 2.500E+10 0.000 17850.0 !23b 6s -3000 md3ooh6o2=mddipx36j9 6.250E+09 0.000 16050.0 !23b 7s -3000 md3ooh6o2=mddipx36j10 5.860E+08 0.000 22550.0 !23b 8p -3000 md3ooh7o2=mddipx37j4 6.250E+09 0.000 16050.0 !23b 7s -3000 md3ooh7o2=mddipx37j5 2.500E+10 0.000 17850.0 !23b 6s -3000 md3ooh7o2=mddipx37j6 2.000E+11 0.000 23850.0 !23b 5s -3000 md3ooh7o2=mddipx37j8 2.000E+11 0.000 23850.0 !23b 5s -3000 md3ooh7o2=mddipx37j9 2.500E+10 0.000 17850.0 !23b 6s -3000 md3ooh7o2=mddipx37j10 9.375E+09 0.000 19350.0 !23b 7p -3000 md4ooh2o2=mddipx24jm 9.375E+09 0.000 19350.0 !23b 7p -3000 md4ooh2o2=mddipx24j3 2.000E+11 0.000 23850.0 !23b 5s -3000 md4ooh2o2=mddipx24j5 6.250E+09 0.000 16050.0 !23b 7s -3000 md4ooh2o2=mddipx24j6 3.907E+08 0.000 19050.0 !23b 8s -3000 md4ooh3o2=mddipx34jm 5.860E+08 0.000 22550.0 !23b 8p -3000 md4ooh3o2=mddipx34j2 2.000E+11 0.000 23850.0 !23b 5s -3000 md4ooh3o2=mddipx34j5 2.500E+10 0.000 17850.0 !23b 6s -3000 md4ooh3o2=mddipx34j6 6.250E+09 0.000 16050.0 !23b 7s -3000 md4ooh3o2=mddipx34j7 3.907E+08 0.000 19050.0 !23b 8s -3000 md4ooh5o2=mddipx45j2 6.250E+09 0.000 16050.0 !23b 7s -3000 md4ooh5o2=mddipx45j3 2.500E+10 0.000 17850.0 !23b 6s -3000 md4ooh5o2=mddipx45j6 2.000E+11 0.000 23850.0 !23b 5s -3000 md4ooh5o2=mddipx45j7 2.500E+10 0.000 17850.0 !23b 6s -3000 md4ooh5o2=mddipx45j8 6.250E+09 0.000 16050.0 !23b 7s -3000 md4ooh5o2=mddipx45j9 3.907E+08 0.000 19050.0 !23b 8s -3000 md4ooh6o2=mddipx46j2 3.907E+08 0.000 19050.0 !23b 8s -3000 md4ooh6o2=mddipx46j3 6.250E+09 0.000 16050.0 !23b 7s -3000 md4ooh6o2=mddipx46j5 2.000E+11 0.000 23850.0 !23b 5s -3000 md4ooh6o2=mddipx46j7 2.000E+11 0.000 23850.0 !23b 5s -3000 md4ooh6o2=mddipx46j8 2.500E+10 0.000 17850.0 !23b 6s -3000 md4ooh6o2=mddipx46j9 6.250E+09 0.000 16050.0 !23b 7s -3000 md4ooh6o2=mddipx46j10 5.860E+08 0.000 22550.0 !23b 8p -3000 md4ooh7o2=mddipx47j3 3.907E+08 0.000 19050.0 !23b 8s -3000 md4ooh7o2=mddipx47j5 2.500E+10 0.000 17850.0 !23b 6s -3000 md4ooh7o2=mddipx47j6 2.000E+11 0.000 23850.0 !23b 5s -3000 md4ooh7o2=mddipx47j8 2.000E+11 0.000 23850.0 !23b 5s -3000 md4ooh7o2=mddipx47j9 2.500E+10 0.000 17850.0 !23b 6s -3000 md4ooh7o2=mddipx47j10 9.375E+09 0.000 19350.0 !23b 7p -3000 md4ooh8o2=mddipx48j5 6.250E+09 0.000 16050.0 !23b 7s -3000 md4ooh8o2=mddipx48j6 2.500E+10 0.000 17850.0 !23b 6s -3000 md4ooh8o2=mddipx48j7 2.000E+11 0.000 23850.0 !23b 5s -3000 md4ooh8o2=mddipx48j9 2.000E+11 0.000 23850.0 !23b 5s -3000 md4ooh8o2=mddipx48j10 3.750E+10 0.000 21400.0 !23b 6p -3000 md5ooh2o2=mddipx25jm 9.375E+09 0.000 19350.0 !23b 7p -3000 md5ooh2o2=mddipx25j3 2.000E+11 0.000 23850.0 !23b 5s -3000 md5ooh2o2=mddipx25j4 2.500E+10 0.000 17850.0 !23b 6s -3000 md5ooh2o2=mddipx25j6 3.907E+08 0.000 19050.0 !23b 8s -3000 md5ooh3o2=mddipx35jm 5.860E+08 0.000 22550.0 !23b 8p -3000 md5ooh3o2=mddipx35j2 2.000E+11 0.000 23850.0 !23b 5s -3000 md5ooh3o2=mddipx35j4 2.000E+11 0.000 23850.0 !23b 5s -3000 md5ooh3o2=mddipx35j6 6.250E+09 0.000 16050.0 !23b 7s -3000 md5ooh3o2=mddipx35j7 3.907E+08 0.000 19050.0 !23b 8s -3000 md5ooh4o2=mddipx45j2 2.500E+10 0.000 17850.0 !23b 6s -3000 md5ooh4o2=mddipx45j3 2.000E+11 0.000 23850.0 !23b 5s -3000 md5ooh4o2=mddipx45j6 2.000E+11 0.000 23850.0 !23b 5s -3000 md5ooh4o2=mddipx45j7 2.500E+10 0.000 17850.0 !23b 6s -3000 md5ooh4o2=mddipx45j8 6.250E+09 0.000 16050.0 !23b 7s -3000 md5ooh6o2=mddipx56j2 3.907E+08 0.000 19050.0 !23b 8s -3000 md5ooh6o2=mddipx56j3 6.250E+09 0.000 16050.0 !23b 7s -3000 md5ooh6o2=mddipx56j4 2.500E+10 0.000 17850.0 !23b 6s -3000 md5ooh6o2=mddipx56j7 2.000E+11 0.000 23850.0 !23b 5s -3000 md5ooh6o2=mddipx56j8 2.500E+10 0.000 17850.0 !23b 6s -3000 md5ooh6o2=mddipx56j9 6.250E+09 0.000 16050.0 !23b 7s -3000 md5ooh6o2=mddipx56j10 5.860E+08 0.000 22550.0 !23b 8p -3000 md5ooh7o2=mddipx57j3 3.907E+08 0.000 19050.0 !23b 8s -3000 md5ooh7o2=mddipx57j4 6.250E+09 0.000 16050.0 !23b 7s -3000 md5ooh7o2=mddipx57j6 2.000E+11 0.000 23850.0 !23b 5s -3000 md5ooh7o2=mddipx57j8 2.000E+11 0.000 23850.0 !23b 5s -3000 md5ooh7o2=mddipx57j9 2.500E+10 0.000 17850.0 !23b 6s -3000 md5ooh7o2=mddipx57j10 9.375E+09 0.000 19350.0 !23b 7p -3000 md5ooh8o2=mddipx58j4 3.907E+08 0.000 19050.0 !23b 8s -3000 md5ooh8o2=mddipx58j6 2.500E+10 0.000 17850.0 !23b 6s -3000 md5ooh8o2=mddipx58j7 2.000E+11 0.000 23850.0 !23b 5s -3000 md5ooh8o2=mddipx58j9 2.000E+11 0.000 23850.0 !23b 5s -3000 md5ooh8o2=mddipx58j10 3.750E+10 0.000 21400.0 !23b 6p -3000 md5ooh9o2=mddipx59j6 6.250E+09 0.000 16050.0 !23b 7s -3000 md5ooh9o2=mddipx59j7 2.500E+10 0.000 17850.0 !23b 6s -3000 md5ooh9o2=mddipx59j8 2.000E+11 0.000 23850.0 !23b 5s -3000 md5ooh9o2=mddipx59j10 3.000E+11 0.000 26400.0 !23b 5p -3000 md6ooh2o2=mddipx26jm 9.375E+09 0.000 19350.0 !23b 7p -3000 md6ooh2o2=mddipx26j3 2.000E+11 0.000 23850.0 !23b 5s -3000 md6ooh2o2=mddipx26j4 2.500E+10 0.000 17850.0 !23b 6s -3000 md6ooh2o2=mddipx26j5 6.250E+09 0.000 16050.0 !23b 7s -3000 md6ooh3o2=mddipx36jm 5.860E+08 0.000 22550.0 !23b 8p -3000 md6ooh3o2=mddipx36j2 2.000E+11 0.000 23850.0 !23b 5s -3000 md6ooh3o2=mddipx36j4 2.000E+11 0.000 23850.0 !23b 5s -3000 md6ooh3o2=mddipx36j5 2.500E+10 0.000 17850.0 !23b 6s -3000 md6ooh3o2=mddipx36j7 6.250E+09 0.000 16050.0 !23b 7s -3000 md6ooh4o2=mddipx46j2 2.500E+10 0.000 17850.0 !23b 6s -3000 md6ooh4o2=mddipx46j3 2.000E+11 0.000 23850.0 !23b 5s -3000 md6ooh4o2=mddipx46j5 2.000E+11 0.000 23850.0 !23b 5s -3000 md6ooh4o2=mddipx46j7 6.250E+09 0.000 16050.0 !23b 7s -3000 md6ooh4o2=mddipx46j8 3.907E+08 0.000 19050.0 !23b 8s -3000 md6ooh5o2=mddipx56j2 6.250E+09 0.000 16050.0 !23b 7s -3000 md6ooh5o2=mddipx56j3 2.500E+10 0.000 17850.0 !23b 6s -3000 md6ooh5o2=mddipx56j4 2.000E+11 0.000 23850.0 !23b 5s -3000 md6ooh5o2=mddipx56j7 2.500E+10 0.000 17850.0 !23b 6s -3000 md6ooh5o2=mddipx56j8 6.250E+09 0.000 16050.0 !23b 7s -3000 md6ooh5o2=mddipx56j9 3.907E+08 0.000 19050.0 !23b 8s -3000 md6ooh7o2=mddipx67j3 3.907E+08 0.000 19050.0 !23b 8s -3000 md6ooh7o2=mddipx67j4 6.250E+09 0.000 16050.0 !23b 7s -3000 md6ooh7o2=mddipx67j5 2.500E+10 0.000 17850.0 !23b 6s -3000 md6ooh7o2=mddipx67j8 2.000E+11 0.000 23850.0 !23b 5s -3000 md6ooh7o2=mddipx67j9 2.500E+10 0.000 17850.0 !23b 6s -3000 md6ooh7o2=mddipx67j10 9.375E+09 0.000 19350.0 !23b 7p -3000 md6ooh8o2=mddipx68j4 3.907E+08 0.000 19050.0 !23b 8s -3000 md6ooh8o2=mddipx68j5 6.250E+09 0.000 16050.0 !23b 7s -3000 md6ooh8o2=mddipx68j7 2.000E+11 0.000 23850.0 !23b 5s -3000 md6ooh8o2=mddipx68j9 2.000E+11 0.000 23850.0 !23b 5s -3000 md6ooh8o2=mddipx68j10 3.750E+10 0.000 21400.0 !23b 6p -3000 md6ooh9o2=mddipx69j5 3.907E+08 0.000 19050.0 !23b 8s -3000 md6ooh9o2=mddipx69j7 2.500E+10 0.000 17850.0 !23b 6s -3000 md6ooh9o2=mddipx69j8 2.000E+11 0.000 23850.0 !23b 5s -3000 md6ooh9o2=mddipx69j10 3.000E+11 0.000 26400.0 !23b 5p -3000 md6ooh10o2=mddipx70j7 6.250E+09 0.000 16050.0 !23b 7s -3000 md6ooh10o2=mddipx70j8 2.500E+10 0.000 17850.0 !23b 6s -3000 md6ooh10o2=mddipx70j9 2.000E+11 0.000 23850.0 !23b 5s -3000 md7ooh3o2=mddipx37jm 5.860E+08 0.000 22550.0 !23b 8p -3000 md7ooh3o2=mddipx37j2 2.000E+11 0.000 23850.0 !23b 5s -3000 md7ooh3o2=mddipx37j4 2.000E+11 0.000 23850.0 !23b 5s -3000 md7ooh3o2=mddipx37j5 2.500E+10 0.000 17850.0 !23b 6s -3000 md7ooh3o2=mddipx37j6 6.250E+09 0.000 16050.0 !23b 7s -3000 md7ooh4o2=mddipx47j2 2.500E+10 0.000 17850.0 !23b 6s -3000 md7ooh4o2=mddipx47j3 2.000E+11 0.000 23850.0 !23b 5s -3000 md7ooh4o2=mddipx47j5 2.000E+11 0.000 23850.0 !23b 5s -3000 md7ooh4o2=mddipx47j6 2.500E+10 0.000 17850.0 !23b 6s -3000 md7ooh4o2=mddipx47j8 3.907E+08 0.000 19050.0 !23b 8s -3000 md7ooh5o2=mddipx57j2 6.250E+09 0.000 16050.0 !23b 7s -3000 md7ooh5o2=mddipx57j3 2.500E+10 0.000 17850.0 !23b 6s -3000 md7ooh5o2=mddipx57j4 2.000E+11 0.000 23850.0 !23b 5s -3000 md7ooh5o2=mddipx57j6 2.000E+11 0.000 23850.0 !23b 5s -3000 md7ooh5o2=mddipx57j8 6.250E+09 0.000 16050.0 !23b 7s -3000 md7ooh5o2=mddipx57j9 3.907E+08 0.000 19050.0 !23b 8s -3000 md7ooh6o2=mddipx67j2 3.907E+08 0.000 19050.0 !23b 8s -3000 md7ooh6o2=mddipx67j3 6.250E+09 0.000 16050.0 !23b 7s -3000 md7ooh6o2=mddipx67j4 2.500E+10 0.000 17850.0 !23b 6s -3000 md7ooh6o2=mddipx67j5 2.000E+11 0.000 23850.0 !23b 5s -3000 md7ooh6o2=mddipx67j8 2.500E+10 0.000 17850.0 !23b 6s -3000 md7ooh6o2=mddipx67j9 6.250E+09 0.000 16050.0 !23b 7s -3000 md7ooh6o2=mddipx67j10 5.860E+08 0.000 22550.0 !23b 8p -3000 md7ooh8o2=mddipx78j4 3.907E+08 0.000 19050.0 !23b 8s -3000 md7ooh8o2=mddipx78j5 6.250E+09 0.000 16050.0 !23b 7s -3000 md7ooh8o2=mddipx78j6 2.500E+10 0.000 17850.0 !23b 6s -3000 md7ooh8o2=mddipx78j9 2.000E+11 0.000 23850.0 !23b 5s -3000 md7ooh8o2=mddipx78j10 3.750E+10 0.000 21400.0 !23b 6p -3000 md7ooh9o2=mddipx79j5 3.907E+08 0.000 19050.0 !23b 8s -3000 md7ooh9o2=mddipx79j6 6.250E+09 0.000 16050.0 !23b 7s -3000 md7ooh9o2=mddipx79j8 2.000E+11 0.000 23850.0 !23b 5s -3000 md7ooh9o2=mddipx79j10 3.000E+11 0.000 26400.0 !23b 5p -3000 md7ooh10o2=mddipx80j6 3.907E+08 0.000 19050.0 !23b 8s -3000 md7ooh10o2=mddipx80j8 2.500E+10 0.000 17850.0 !23b 6s -3000 md7ooh10o2=mddipx80j9 2.000E+11 0.000 23850.0 !23b 5s -3000 md8ooh4o2=mddipx48j2 2.500E+10 0.000 17850.0 !23b 6s -3000 md8ooh4o2=mddipx48j3 2.000E+11 0.000 23850.0 !23b 5s -3000 md8ooh4o2=mddipx48j5 2.000E+11 0.000 23850.0 !23b 5s -3000 md8ooh4o2=mddipx48j6 2.500E+10 0.000 17850.0 !23b 6s -3000 md8ooh4o2=mddipx48j7 6.250E+09 0.000 16050.0 !23b 7s -3000 md8ooh5o2=mddipx58j2 6.250E+09 0.000 16050.0 !23b 7s -3000 md8ooh5o2=mddipx58j3 2.500E+10 0.000 17850.0 !23b 6s -3000 md8ooh5o2=mddipx58j4 2.000E+11 0.000 23850.0 !23b 5s -3000 md8ooh5o2=mddipx58j6 2.000E+11 0.000 23850.0 !23b 5s -3000 md8ooh5o2=mddipx58j7 2.500E+10 0.000 17850.0 !23b 6s -3000 md8ooh5o2=mddipx58j9 3.907E+08 0.000 19050.0 !23b 8s -3000 md8ooh6o2=mddipx68j2 3.907E+08 0.000 19050.0 !23b 8s -3000 md8ooh6o2=mddipx68j3 6.250E+09 0.000 16050.0 !23b 7s -3000 md8ooh6o2=mddipx68j4 2.500E+10 0.000 17850.0 !23b 6s -3000 md8ooh6o2=mddipx68j5 2.000E+11 0.000 23850.0 !23b 5s -3000 md8ooh6o2=mddipx68j7 2.000E+11 0.000 23850.0 !23b 5s -3000 md8ooh6o2=mddipx68j9 6.250E+09 0.000 16050.0 !23b 7s -3000 md8ooh6o2=mddipx68j10 5.860E+08 0.000 22550.0 !23b 8p -3000 md8ooh7o2=mddipx78j3 3.907E+08 0.000 19050.0 !23b 8s -3000 md8ooh7o2=mddipx78j4 6.250E+09 0.000 16050.0 !23b 7s -3000 md8ooh7o2=mddipx78j5 2.500E+10 0.000 17850.0 !23b 6s -3000 md8ooh7o2=mddipx78j6 2.000E+11 0.000 23850.0 !23b 5s -3000 md8ooh7o2=mddipx78j9 2.500E+10 0.000 17850.0 !23b 6s -3000 md8ooh7o2=mddipx78j10 9.375E+09 0.000 19350.0 !23b 7p -3000 md8ooh9o2=mddipx89j5 3.907E+08 0.000 19050.0 !23b 8s -3000 md8ooh9o2=mddipx89j6 6.250E+09 0.000 16050.0 !23b 7s -3000 md8ooh9o2=mddipx89j7 2.500E+10 0.000 17850.0 !23b 6s -3000 md8ooh9o2=mddipx89j10 3.000E+11 0.000 26400.0 !23b 5p -3000 md8ooh10o2=mddipx90j6 3.907E+08 0.000 19050.0 !23b 8s -3000 md8ooh10o2=mddipx90j7 6.250E+09 0.000 16050.0 !23b 7s -3000 md8ooh10o2=mddipx90j9 2.000E+11 0.000 23850.0 !23b 5s -3000 md9ooh5o2=mddipx59j2 6.250E+09 0.000 16050.0 !23b 7s -3000 md9ooh5o2=mddipx59j3 2.500E+10 0.000 17850.0 !23b 6s -3000 md9ooh5o2=mddipx59j4 2.000E+11 0.000 23850.0 !23b 5s -3000 md9ooh5o2=mddipx59j6 2.000E+11 0.000 23850.0 !23b 5s -3000 md9ooh5o2=mddipx59j7 2.500E+10 0.000 17850.0 !23b 6s -3000 md9ooh5o2=mddipx59j8 6.250E+09 0.000 16050.0 !23b 7s -3000 md9ooh6o2=mddipx69j2 3.907E+08 0.000 19050.0 !23b 8s -3000 md9ooh6o2=mddipx69j3 6.250E+09 0.000 16050.0 !23b 7s -3000 md9ooh6o2=mddipx69j4 2.500E+10 0.000 17850.0 !23b 6s -3000 md9ooh6o2=mddipx69j5 2.000E+11 0.000 23850.0 !23b 5s -3000 md9ooh6o2=mddipx69j7 2.000E+11 0.000 23850.0 !23b 5s -3000 md9ooh6o2=mddipx69j8 2.500E+10 0.000 17850.0 !23b 6s -3000 md9ooh6o2=mddipx69j10 5.860E+08 0.000 22550.0 !23b 8p -3000 md9ooh7o2=mddipx79j3 3.907E+08 0.000 19050.0 !23b 8s -3000 md9ooh7o2=mddipx79j4 6.250E+09 0.000 16050.0 !23b 7s -3000 md9ooh7o2=mddipx79j5 2.500E+10 0.000 17850.0 !23b 6s -3000 md9ooh7o2=mddipx79j6 2.000E+11 0.000 23850.0 !23b 5s -3000 md9ooh7o2=mddipx79j8 2.000E+11 0.000 23850.0 !23b 5s -3000 md9ooh7o2=mddipx79j10 9.375E+09 0.000 19350.0 !23b 7p -3000 md9ooh8o2=mddipx89j4 3.907E+08 0.000 19050.0 !23b 8s -3000 md9ooh8o2=mddipx89j5 6.250E+09 0.000 16050.0 !23b 7s -3000 md9ooh8o2=mddipx89j6 2.500E+10 0.000 17850.0 !23b 6s -3000 md9ooh8o2=mddipx89j7 2.000E+11 0.000 23850.0 !23b 5s -3000 md9ooh8o2=mddipx89j10 3.750E+10 0.000 21400.0 !23b 6p -3000 md9ooh10o2=mddipx100j6 3.907E+08 0.000 19050.0 !23b 8s -3000 md9ooh10o2=mddipx100j7 6.250E+09 0.000 16050.0 !23b 7s -3000 md9ooh10o2=mddipx100j8 2.500E+10 0.000 17850.0 !23b 6s -3000 md10ooh6o2=mddipx70j2 3.907E+08 0.000 19050.0 !23b 8s -3000 md10ooh6o2=mddipx70j3 6.250E+09 0.000 16050.0 !23b 7s -3000 md10ooh6o2=mddipx70j4 2.500E+10 0.000 17850.0 !23b 6s -3000 md10ooh6o2=mddipx70j5 2.000E+11 0.000 23850.0 !23b 5s -3000 md10ooh6o2=mddipx70j7 2.000E+11 0.000 23850.0 !23b 5s -3000 md10ooh6o2=mddipx70j8 2.500E+10 0.000 17850.0 !23b 6s -3000 md10ooh6o2=mddipx70j9 6.250E+09 0.000 16050.0 !23b 7s -3000 md10ooh7o2=mddipx80j3 3.907E+08 0.000 19050.0 !23b 8s -3000 md10ooh7o2=mddipx80j4 6.250E+09 0.000 16050.0 !23b 7s -3000 md10ooh7o2=mddipx80j5 2.500E+10 0.000 17850.0 !23b 6s -3000 md10ooh7o2=mddipx80j6 2.000E+11 0.000 23850.0 !23b 5s -3000 md10ooh7o2=mddipx80j8 2.000E+11 0.000 23850.0 !23b 5s -3000 md10ooh7o2=mddipx80j9 2.500E+10 0.000 17850.0 !23b 6s -3000 md10ooh8o2=mddipx90j4 3.907E+08 0.000 19050.0 !23b 8s -3000 md10ooh8o2=mddipx90j5 6.250E+09 0.000 16050.0 !23b 7s -3000 md10ooh8o2=mddipx90j6 2.500E+10 0.000 17850.0 !23b 6s -3000 md10ooh8o2=mddipx90j7 2.000E+11 0.000 23850.0 !23b 5s -3000 md10ooh8o2=mddipx90j9 2.000E+11 0.000 23850.0 !23b 5s -3000 md10ooh9o2=mddipx100j5 3.907E+08 0.000 19050.0 !23b 8s -3000 md10ooh9o2=mddipx100j6 6.250E+09 0.000 16050.0 !23b 7s -3000 md10ooh9o2=mddipx100j7 2.500E+10 0.000 17850.0 !23b 6s -3000 md10ooh9o2=mddipx100j8 2.000E+11 0.000 23850.0 !23b 5s -3000 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 23c/HOOQOOH to olefinHP + ho2 ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! ! md2dmooh+ho2=mddipxm2j3 1.000E+11 0.000 11750.0 !23c md2dmooh+ho2=mddipxm3j2 1.000E+11 0.000 11750.0 !23c md2d4ooh+ho2=mddipx24j3 1.000E+11 0.000 11750.0 !23c md2d4ooh+ho2=mddipx34j2 1.000E+11 0.000 11750.0 !23c md2d5ooh+ho2=mddipx25j3 1.000E+11 0.000 11750.0 !23c md2d5ooh+ho2=mddipx35j2 1.000E+11 0.000 11750.0 !23c md2d6ooh+ho2=mddipx26j3 1.000E+11 0.000 11750.0 !23c md2d6ooh+ho2=mddipx36j2 1.000E+11 0.000 11750.0 !23c md2d7ooh+ho2=mddipx37j2 1.000E+11 0.000 11750.0 !23c md3dmooh+ho2=mddipxm3j4 1.000E+11 0.000 11750.0 !23c md3d2ooh+ho2=mddipx23j4 1.000E+11 0.000 11750.0 !23c md3d2ooh+ho2=mddipx24j3 1.000E+11 0.000 11750.0 !23c md3d5ooh+ho2=mddipx35j4 1.000E+11 0.000 11750.0 !23c md3d5ooh+ho2=mddipx45j3 1.000E+11 0.000 11750.0 !23c md3d6ooh+ho2=mddipx36j4 1.000E+11 0.000 11750.0 !23c md3d6ooh+ho2=mddipx46j3 1.000E+11 0.000 11750.0 !23c md3d7ooh+ho2=mddipx37j4 1.000E+11 0.000 11750.0 !23c md3d7ooh+ho2=mddipx47j3 1.000E+11 0.000 11750.0 !23c md3d8ooh+ho2=mddipx48j3 1.000E+11 0.000 11750.0 !23c md4d2ooh+ho2=mddipx24j5 1.000E+11 0.000 11750.0 !23c md4d2ooh+ho2=mddipx25j4 1.000E+11 0.000 11750.0 !23c md4d3ooh+ho2=mddipx34j5 1.000E+11 0.000 11750.0 !23c md4d3ooh+ho2=mddipx35j4 1.000E+11 0.000 11750.0 !23c md4d6ooh+ho2=mddipx46j5 1.000E+11 0.000 11750.0 !23c md4d6ooh+ho2=mddipx56j4 1.000E+11 0.000 11750.0 !23c md4d7ooh+ho2=mddipx47j5 1.000E+11 0.000 11750.0 !23c md4d7ooh+ho2=mddipx57j4 1.000E+11 0.000 11750.0 !23c md4d8ooh+ho2=mddipx48j5 1.000E+11 0.000 11750.0 !23c md4d8ooh+ho2=mddipx58j4 1.000E+11 0.000 11750.0 !23c md4d9ooh+ho2=mddipx59j4 1.000E+11 0.000 11750.0 !23c md5d2ooh+ho2=mddipx25j6 1.000E+11 0.000 11750.0 !23c md5d2ooh+ho2=mddipx26j5 1.000E+11 0.000 11750.0 !23c md5d3ooh+ho2=mddipx35j6 1.000E+11 0.000 11750.0 !23c md5d3ooh+ho2=mddipx36j5 1.000E+11 0.000 11750.0 !23c md5d4ooh+ho2=mddipx45j6 1.000E+11 0.000 11750.0 !23c md5d4ooh+ho2=mddipx46j5 1.000E+11 0.000 11750.0 !23c md5d7ooh+ho2=mddipx57j6 1.000E+11 0.000 11750.0 !23c md5d7ooh+ho2=mddipx67j5 1.000E+11 0.000 11750.0 !23c md5d8ooh+ho2=mddipx58j6 1.000E+11 0.000 11750.0 !23c md5d8ooh+ho2=mddipx68j5 1.000E+11 0.000 11750.0 !23c md5d9ooh+ho2=mddipx59j6 1.000E+11 0.000 11750.0 !23c md5d9ooh+ho2=mddipx69j5 1.000E+11 0.000 11750.0 !23c md5d10ooh+ho2=mddipx70j5 1.000E+11 0.000 11750.0 !23c md6d2ooh+ho2=mddipx26j7 1.000E+11 0.000 11750.0 !23c md6d3ooh+ho2=mddipx36j7 1.000E+11 0.000 11750.0 !23c md6d3ooh+ho2=mddipx37j6 1.000E+11 0.000 11750.0 !23c md6d4ooh+ho2=mddipx46j7 1.000E+11 0.000 11750.0 !23c md6d4ooh+ho2=mddipx47j6 1.000E+11 0.000 11750.0 !23c md6d5ooh+ho2=mddipx56j7 1.000E+11 0.000 11750.0 !23c md6d5ooh+ho2=mddipx57j6 1.000E+11 0.000 11750.0 !23c md6d8ooh+ho2=mddipx68j7 1.000E+11 0.000 11750.0 !23c md6d8ooh+ho2=mddipx78j6 1.000E+11 0.000 11750.0 !23c md6d9ooh+ho2=mddipx69j7 1.000E+11 0.000 11750.0 !23c md6d9ooh+ho2=mddipx79j6 1.000E+11 0.000 11750.0 !23c md6d10ooh+ho2=mddipx70j7 1.000E+11 0.000 11750.0 !23c md6d10ooh+ho2=mddipx80j6 1.000E+11 0.000 11750.0 !23c md7d3ooh+ho2=mddipx37j8 1.000E+11 0.000 11750.0 !23c md7d4ooh+ho2=mddipx47j8 1.000E+11 0.000 11750.0 !23c md7d4ooh+ho2=mddipx48j7 1.000E+11 0.000 11750.0 !23c md7d5ooh+ho2=mddipx57j8 1.000E+11 0.000 11750.0 !23c md7d5ooh+ho2=mddipx58j7 1.000E+11 0.000 11750.0 !23c md7d6ooh+ho2=mddipx67j8 1.000E+11 0.000 11750.0 !23c md7d6ooh+ho2=mddipx68j7 1.000E+11 0.000 11750.0 !23c md7d9ooh+ho2=mddipx79j8 1.000E+11 0.000 11750.0 !23c md7d9ooh+ho2=mddipx89j7 1.000E+11 0.000 11750.0 !23c md7d10ooh+ho2=mddipx80j8 1.000E+11 0.000 11750.0 !23c md7d10ooh+ho2=mddipx90j7 1.000E+11 0.000 11750.0 !23c md8d4ooh+ho2=mddipx48j9 1.000E+11 0.000 11750.0 !23c md8d5ooh+ho2=mddipx58j9 1.000E+11 0.000 11750.0 !23c md8d5ooh+ho2=mddipx59j8 1.000E+11 0.000 11750.0 !23c md8d6ooh+ho2=mddipx68j9 1.000E+11 0.000 11750.0 !23c md8d6ooh+ho2=mddipx69j8 1.000E+11 0.000 11750.0 !23c md8d7ooh+ho2=mddipx78j9 1.000E+11 0.000 11750.0 !23c md8d7ooh+ho2=mddipx79j8 1.000E+11 0.000 11750.0 !23c md8d10ooh+ho2=mddipx90j9 1.000E+11 0.000 11750.0 !23c md8d10ooh+ho2=mddipx100j8 1.000E+11 0.000 11750.0 !23c md9d5ooh+ho2=mddipx59j10 1.000E+11 0.000 11750.0 !23c md9d6ooh+ho2=mddipx69j10 1.000E+11 0.000 11750.0 !23c md9d6ooh+ho2=mddipx70j9 1.000E+11 0.000 10750.0 !23c md9d7ooh+ho2=mddipx79j10 1.000E+11 0.000 11750.0 !23c md9d7ooh+ho2=mddipx80j9 1.000E+11 0.000 10750.0 !23c md9d8ooh+ho2=mddipx89j10 1.000E+11 0.000 11750.0 !23c md9d8ooh+ho2=mddipx90j9 1.000E+11 0.000 10750.0 !23c ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 23d/HOOQOOH to HP cyclic ether + OH ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! ! mddipxm2j3=mdcym3-2+oh 1.172E+09 0.000 01800.0 !23d oxane mddipxm2j3=mdcy23-m+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipxm2j4=mdcy24-m+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipxm2j5=mdcy25-m+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipxm2j6=mdcy26-m+oh 1.172E+09 0.000 01800.0 !23d oxane mddipxm3j2=mdcym2-3+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipxm3j2=mdcy23-m+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipxm3j4=mdcy34-m+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipxm3j5=mdcy35-m+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipxm3j6=mdcy36-m+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipxm3j7=mdcy37-m+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx23jm=mdcym2-3+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx23jm=mdcym3-2+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx23j4=mdcy24-3+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx23j4=mdcy34-2+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx23j5=mdcy25-3+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx23j5=mdcy35-2+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx23j6=mdcy26-3+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx23j6=mdcy36-2+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx23j7=mdcy37-2+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx24jm=mdcym2-4+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx24j3=mdcy23-4+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx24j3=mdcy34-2+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx24j5=mdcy25-4+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx24j5=mdcy45-2+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx24j6=mdcy26-4+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx24j6=mdcy46-2+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx24j7=mdcy47-2+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx24j8=mdcy48-2+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx25jm=mdcym2-5+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx25j3=mdcy23-5+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx25j3=mdcy35-2+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx25j4=mdcy24-5+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx25j4=mdcy45-2+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx25j6=mdcy26-5+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx25j6=mdcy56-2+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx25j7=mdcy57-2+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx25j8=mdcy58-2+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx25j9=mdcy59-2+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx26jm=mdcym2-6+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx26j3=mdcy23-6+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx26j3=mdcy36-2+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx26j4=mdcy24-6+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx26j4=mdcy46-2+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx26j5=mdcy25-6+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx26j5=mdcy56-2+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx26j7=mdcy67-2+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx26j8=mdcy68-2+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx26j9=mdcy69-2+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx26j10=mdcy70-2+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx34jm=mdcym3-4+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx34j2=mdcy23-4+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx34j2=mdcy24-3+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx34j5=mdcy35-4+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx34j5=mdcy45-3+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx34j6=mdcy36-4+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx34j6=mdcy46-3+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx34j7=mdcy37-4+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx34j7=mdcy47-3+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx34j8=mdcy48-3+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx35jm=mdcym3-5+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx35j2=mdcy23-5+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx35j2=mdcy25-3+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx35j4=mdcy34-5+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx35j4=mdcy45-3+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx35j6=mdcy36-5+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx35j6=mdcy56-3+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx35j7=mdcy37-5+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx35j7=mdcy57-3+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx35j8=mdcy58-3+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx35j9=mdcy59-3+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx36jm=mdcym3-6+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx36j2=mdcy23-6+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx36j2=mdcy26-3+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx36j4=mdcy34-6+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx36j4=mdcy46-3+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx36j5=mdcy35-6+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx36j5=mdcy56-3+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx36j7=mdcy37-6+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx36j7=mdcy67-3+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx36j8=mdcy68-3+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx36j9=mdcy69-3+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx36j10=mdcy70-3+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx37jm=mdcym3-7+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx37j2=mdcy23-7+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx37j4=mdcy34-7+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx37j4=mdcy47-3+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx37j5=mdcy35-7+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx37j5=mdcy57-3+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx37j6=mdcy67-3+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx37j6=mdcy36-7+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx37j8=mdcy78-3+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx37j9=mdcy79-3+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx37j10=mdcy80-3+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx45j2=mdcy24-5+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx45j2=mdcy25-4+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx45j3=mdcy34-5+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx45j3=mdcy35-4+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx45j6=mdcy46-5+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx45j6=mdcy56-4+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx45j7=mdcy47-5+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx45j7=mdcy57-4+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx45j8=mdcy48-5+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx45j8=mdcy58-4+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx45j9=mdcy59-4+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx46j2=mdcy24-6+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx46j2=mdcy26-4+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx46j3=mdcy34-6+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx46j3=mdcy36-4+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx46j5=mdcy45-6+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx46j5=mdcy56-4+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx46j7=mdcy67-4+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx46j7=mdcy47-6+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx46j8=mdcy68-4+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx46j8=mdcy48-6+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx46j9=mdcy69-4+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx46j10=mdcy70-4+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx47j2=mdcy24-7+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx47j3=mdcy34-7+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx47j3=mdcy37-4+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx47j5=mdcy57-4+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx47j5=mdcy45-7+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx47j6=mdcy67-4+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx47j6=mdcy46-7+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx47j8=mdcy78-4+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx47j8=mdcy48-7+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx47j9=mdcy79-4+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx47j10=mdcy80-4+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx48j2=mdcy24-8+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx48j3=mdcy34-8+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx48j5=mdcy45-8+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx48j5=mdcy58-4+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx48j6=mdcy68-4+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx48j6=mdcy46-8+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx48j7=mdcy78-4+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx48j7=mdcy47-8+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx48j9=mdcy89-4+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx48j10=mdcy90-4+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx56j2=mdcy25-6+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx56j2=mdcy26-5+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx56j3=mdcy35-6+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx56j3=mdcy36-5+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx56j4=mdcy45-6+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx56j4=mdcy46-5+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx56j7=mdcy57-6+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx56j7=mdcy67-5+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx56j8=mdcy58-6+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx56j8=mdcy68-5+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx56j9=mdcy59-6+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx56j9=mdcy69-5+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx56j10=mdcy70-5+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx57j2=mdcy25-7+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx57j3=mdcy35-7+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx57j3=mdcy37-5+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx57j4=mdcy45-7+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx57j4=mdcy47-5+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx57j6=mdcy56-7+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx57j6=mdcy67-5+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx57j8=mdcy78-5+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx57j8=mdcy58-7+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx57j9=mdcy79-5+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx57j9=mdcy59-7+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx57j10=mdcy80-5+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx58j2=mdcy25-8+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx58j3=mdcy35-8+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx58j4=mdcy45-8+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx58j4=mdcy48-5+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx58j6=mdcy56-8+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx58j6=mdcy68-5+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx58j7=mdcy57-8+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx58j7=mdcy78-5+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx58j9=mdcy89-5+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx58j9=mdcy59-8+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx58j10=mdcy90-5+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx59j2=mdcy25-9+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx59j3=mdcy35-9+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx59j4=mdcy45-9+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx59j6=mdcy56-9+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx59j6=mdcy69-5+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx59j7=mdcy57-9+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx59j7=mdcy79-5+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx59j8=mdcy58-9+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx59j8=mdcy89-5+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx59j10=mdcy100-5+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx67j2=mdcy26-7+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx67j3=mdcy36-7+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx67j3=mdcy37-6+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx67j4=mdcy46-7+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx67j4=mdcy47-6+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx67j5=mdcy56-7+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx67j5=mdcy57-6+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx67j8=mdcy78-6+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx67j8=mdcy68-7+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx67j9=mdcy79-6+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx67j9=mdcy69-7+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx67j10=mdcy80-6+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx67j10=mdcy70-7+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx68j2=mdcy26-8+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx68j3=mdcy36-8+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx68j4=mdcy46-8+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx68j4=mdcy48-6+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx68j5=mdcy56-8+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx68j5=mdcy58-6+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx68j7=mdcy67-8+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx68j7=mdcy78-6+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx68j9=mdcy89-6+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx68j9=mdcy69-8+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx68j10=mdcy90-6+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx68j10=mdcy70-8+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx69j2=mdcy26-9+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx69j3=mdcy36-9+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx69j4=mdcy46-9+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx69j5=mdcy56-9+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx69j5=mdcy59-6+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx69j7=mdcy67-9+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx69j7=mdcy79-6+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx69j8=mdcy68-9+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx69j8=mdcy89-6+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx69j10=mdcy70-9+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx69j10=mdcy100-6+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx70j2=mdcy26-10+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx70j3=mdcy36-10+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx70j4=mdcy46-10+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx70j5=mdcy56-10+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx70j7=mdcy67-10+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx70j7=mdcy80-6+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx70j8=mdcy68-10+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx70j8=mdcy90-6+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx70j9=mdcy69-10+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx70j9=mdcy100-6+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx78j3=mdcy37-8+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx78j4=mdcy47-8+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx78j4=mdcy48-7+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx78j5=mdcy57-8+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx78j5=mdcy58-7+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx78j6=mdcy67-8+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx78j6=mdcy68-7+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx78j9=mdcy79-8+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx78j9=mdcy89-7+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx78j10=mdcy80-8+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx78j10=mdcy90-7+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx79j3=mdcy37-9+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx79j4=mdcy47-9+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx79j5=mdcy57-9+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx79j5=mdcy59-7+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx79j6=mdcy67-9+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx79j6=mdcy69-7+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx79j8=mdcy78-9+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx79j8=mdcy89-7+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx79j10=mdcy100-7+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx79j10=mdcy80-9+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx80j3=mdcy37-10+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx80j4=mdcy47-10+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx80j5=mdcy57-10+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx80j6=mdcy67-10+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx80j6=mdcy70-7+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx80j8=mdcy78-10+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx80j8=mdcy90-7+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx80j9=mdcy100-7+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx80j9=mdcy79-10+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx89j4=mdcy48-9+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx89j5=mdcy58-9+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx89j5=mdcy59-8+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx89j6=mdcy68-9+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx89j6=mdcy69-8+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx89j7=mdcy78-9+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx89j7=mdcy79-8+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx89j10=mdcy100-8+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx89j10=mdcy90-9+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx90j4=mdcy48-10+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx90j5=mdcy58-10+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx90j6=mdcy68-10+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx90j6=mdcy70-8+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx90j7=mdcy78-10+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx90j7=mdcy80-8+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx90j9=mdcy89-10+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx90j9=mdcy100-8+oh 6.000E+11 0.000 22000.0 !23d oxirane mddipx100j5=mdcy59-10+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx100j6=mdcy70-9+oh 1.172E+09 0.000 01800.0 !23d oxane mddipx100j6=mdcy69-10+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx100j7=mdcy80-9+oh 9.375E+09 0.000 07000.0 !23d oxalane mddipx100j7=mdcy79-10+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx100j8=mdcy90-9+oh 7.500E+10 0.000 15250.0 !23d oxetane mddipx100j8=mdcy89-10+oh 6.000E+11 0.000 22000.0 !23d oxirane ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 24/hydroperoxyketone decomposition ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! ! mdketm2=mdketm2o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdketm3=mdketm3o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket2m=mdket2mo+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket23=mdket23o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket24=mdket24o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket25=mdket25o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket26=mdket26o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket3m=mdket3mo+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket32=mdket32o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket34=mdket34o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket35=mdket35o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket36=mdket36o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket37=mdket37o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket42=mdket42o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket43=mdket43o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket45=mdket45o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket46=mdket46o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket47=mdket47o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket48=mdket48o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket52=mdket52o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket53=mdket53o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket54=mdket54o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket56=mdket56o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket57=mdket57o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket58=mdket58o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket59=mdket59o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket62=mdket62o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket63=mdket63o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket64=mdket64o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket65=mdket65o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket67=mdket67o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket68=mdket68o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket69=mdket69o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket70=mdket70o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket73=mdket73o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket74=mdket74o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket75=mdket75o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket76=mdket76o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket78=mdket78o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket79=mdket79o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket80=mdket80o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket84=mdket84o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket85=mdket85o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket86=mdket86o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket87=mdket87o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket89=mdket89o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket90=mdket90o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket95=mdket95o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket96=mdket96o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket97=mdket97o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket98=mdket98o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket100=mdket100o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket106=mdket106o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket107=mdket107o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket108=mdket108o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" mdket109=mdket109o+oh 6.310E+14 0.000 42330.0 !24 "Lightfoot et al., 1991" ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 24b/Decomposition of the radicals from reaction type 24 ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! ! h+mddioxom2=mdketm2o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c8h17-1+medioxom2=mdketm2o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c8h17cho+choco2j=mdketm2o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxom3=mdketm3o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c7h15-1+mpdioxom3=mdketm3o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c7h15cho+memoxo2j=mdketm3o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ! h+mddioxom2=mdket2mo 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h daoj2oxo+ch2o=mdket2mo 1.000E+11 0.000 11900.0 !24b Huge mechanism ch3o+ch2o h+mddioxo23=mdket23o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c7h15-1+mpdioxo23=mdket23o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c7h15cho+me2oxo2j=mdket23o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo24=mdket24o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c6h13-1+mbdioxo24=mdket24o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c6h13cho+mp2oxo3j=mdket24o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo25=mdket25o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c5h11-1+mfdioxo25=mdket25o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c5h11cho+mb2oxo4j=mdket25o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo26=mdket26o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h pc4h9+mhdioxo26=mdket26o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c4h9cho+mf2oxo5j=mdket26o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ! h+mddioxom3=mdket3mo 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h daoj3oxo+ch2o=mdket3mo 1.000E+11 0.000 11900.0 !24b Huge mechanism ch3o+ch2o h+mddioxo23=mdket32o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c7h15co+me2oxo=mdket32o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c7h15cocho+ch3oco=mdket32o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo34=mdket34o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c6h13-1+mbdioxo34=mdket34o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c6h13cho+mp3oxo3j=mdket34o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo35=mdket35o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c5h11-1+mfdioxo35=mdket35o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c5h11cho+mb3oxo4j=mdket35o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo36=mdket36o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h pc4h9+mhdioxo36=mdket36o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c4h9cho+mf3oxo5j=mdket36o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo37=mdket37o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h nc3h7+msdioxo37=mdket37o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c3h7cho+mh3oxo6j=mdket37o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ! h+mddioxo24=mdket42o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c6h13coch2+me2oxo=mdket42o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c6h13coch2cho+ch3oco=mdket42o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo34=mdket43o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c6h13co+mp3oxo=mdket43o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c6h13cocho+me2j=mdket43o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo45=mdket45o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c5h11-1+mfdioxo45=mdket45o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c5h11cho+mb4oxo4j=mdket45o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo46=mdket46o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h pc4h9+mhdioxo46=mdket46o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c4h9cho+mf4oxo5j=mdket46o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo47=mdket47o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h nc3h7+msdioxo47=mdket47o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c3h7cho+mh4oxo6j=mdket47o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo48=mdket48o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c2h5+modioxo48=mdket48o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c2h5cho+ms4oxo7j=mdket48o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ! h+mddioxo25=mdket52o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c5h11coc2h4cho+ch3oco=mdket52o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c5h11coc2h4+me2oxo=mdket52o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo35=mdket53o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c5h11coch2cho+me2j=mdket53o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c5h11coch2+mp3oxo=mdket53o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo45=mdket54o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c5h11cocho+mp3j=mdket54o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c5h11co+mb4oxo=mdket54o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo56=mdket56o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h pc4h9+mhdioxo56=mdket56o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c4h9cho+mf5oxo5j=mdket56o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo57=mdket57o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h nc3h7+msdioxo57=mdket57o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c3h7cho+mh5oxo6j=mdket57o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo58=mdket58o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c2h5+modioxo58=mdket58o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c2h5cho+ms5oxo7j=mdket58o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo59=mdket59o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ch3+mndioxo59=mdket59o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ch3cho+mo5oxo8j=mdket59o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ! h+mddioxo26=mdket62o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c4h9coc3h6cho+ch3oco=mdket62o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c4h9coc3h6+me2oxo=mdket62o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo36=mdket63o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c4h9coc2h4cho+me2j=mdket63o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c4h9coc2h4+mp3oxo=mdket63o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo46=mdket64o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c4h9coch2cho+mp3j=mdket64o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c4h9coch2+mb4oxo=mdket64o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo56=mdket65o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c4h9cocho+mb4j=mdket65o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c4h9co+mf5oxo=mdket65o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo67=mdket67o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h nc3h7+msdioxo67=mdket67o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c3h7cho+mh6oxo6j=mdket67o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo68=mdket68o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c2h5+modioxo68=mdket68o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c2h5cho+ms6oxo7j=mdket68o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo69=mdket69o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ch3+mndioxo69=mdket69o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ch3cho+mo6oxo8j=mdket69o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo70=mdket70o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ch2o+mn6oxo9j=mdket70o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ! h+mddioxo37=mdket73o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c3h7coc3h6cho+me2j=mdket73o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c3h7coc3h6+mp3oxo=mdket73o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo47=mdket74o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c3h7coc2h4cho+mp3j=mdket74o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c3h7coc2h4+mb4oxo=mdket74o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo57=mdket75o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c3h7coch2cho+mb4j=mdket75o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c3h7coch2+mf5oxo=mdket75o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo67=mdket76o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c3h7cocho+mf5j=mdket76o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c3h7co+mh6oxo=mdket76o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo78=mdket78o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c2h5+modioxo78=mdket78o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c2h5cho+ms7oxo7j=mdket78o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo79=mdket79o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ch3+mndioxo79=mdket79o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ch3cho+mo7oxo8j=mdket79o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo80=mdket80o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ch2o+mn7oxo9j=mdket80o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ! h+mddioxo48=mdket84o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c2h5coc3h6cho+mp3j=mdket84o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c2h5coc3h6+mb4oxo=mdket84o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo58=mdket85o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c2h5coc2h4cho+mb4j=mdket85o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c2h5coc2h4+mf5oxo=mdket85o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo68=mdket86o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c2h5coch2cho+mf5j=mdket86o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c2h5coch2+mh6oxo=mdket86o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo78=mdket87o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c2h5cocho+mh6j=mdket87o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c2h5co+ms7oxo=mdket87o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo89=mdket89o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ch3cho+mo8oxo8j=mdket89o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ch3+mndioxo89=mdket89o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo90=mdket90o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ch2o+mn8oxo9j=mdket90o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ! h+mddioxo59=mdket95o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ch3coc3h6cho+mb4j=mdket95o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ch3coc3h6+mf5oxo=mdket95o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo69=mdket96o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ch3coc2h4cho+mf5j=mdket96o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho c2h4coch3+mh6oxo=mdket96o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo79=mdket97o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ch3coch2cho+mh6j=mdket97o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ch3coch2+ms7oxo=mdket97o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo89=mdket98o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ch3cocho+ms7j=mdket98o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ch3co+mo8oxo=mdket98o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo100=mdket100o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ch2o+mn9oxo9j=mdket100o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ! h+mddioxo70=mdket106o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c3h6cho+mh6oxo=mdket106o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho choc3h6cho+mf5j=mdket106o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo80=mdket107o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h c2h4cho+ms7oxo=mdket107o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho choc2h4cho+mh6j=mdket107o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo90=mdket108o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h ch2cho+mo8oxo=mdket108o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho choch2cho+ms7j=mdket108o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho h+mddioxo100=mdket109o 2.000E+12 0.000 07270.0 !24b Curran, 2006 ch3coch3+h hco+mn9oxo=mdket109o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho chocho+mo8j=mdket109o 3.330E+10 0.000 06397.0 !24b Curran, 2006 c2h5+ch3cho ! ! ! ! ! co+ocho=choco2j 1.550E+06 2.020 05730.0 !24b Glaude et al., 2005 co2+hco=choco2j 1.259E+13 0.000 42325.1 !24b Henry et al., 2004 ! ch2co+ocho=memoxo2j 1.000E+11 0.000 11900.0 !24b Huge mechanism ch3o+ch2o co+ch3oco=me2oxo2j 1.510E+11 0.000 04810.0 !24b coco+ch3o=me2oxo2j 1.550E+06 2.020 05730.0 !24b Glaude et al., 2005 ! ch2co+ch3oco=mp2oxo3j 1.510E+11 0.000 04810.0 !24b c2h4+me2oxo2j=mb2oxo4j 1.055E+11 0.000 07350.0 !24b c2h4+mp2oxo3j=mf2oxo5j 8.800E+03 2.480 06130.0 !24b ! co+me2j=mp3oxo3j 1.510E+11 0.000 04810.0 !24b ch2co+ch3oco=mp3oxo3j 1.510E+11 0.000 04810.0 !24b ch2co+me2j=mb3oxo4j 1.510E+11 0.000 04810.0 !24b c2h4+mp3oxo3j=mf3oxo5j 1.055E+11 0.000 07350.0 !24b c2h4+mb3oxo4j=mh3oxo6j 8.800E+03 2.480 06130.0 !24b ! co+mp3j=mb4oxo4j 1.510E+11 0.000 04810.0 !24b ch2co+me2j=mb4oxo4j 1.510E+11 0.000 04810.0 !24b ch2co+mp3j=mf4oxo5j 1.510E+11 0.000 04810.0 !24b c2h4+mb4oxo4j=mh4oxo6j 1.055E+11 0.000 07350.0 !24b c2h4+mf4oxo5j=ms4oxo7j 8.800E+03 2.480 06130.0 !24b ! co+mb4j=mf5oxo5j 1.510E+11 0.000 04810.0 !24b ch2co+mp3j=mf5oxo5j 1.510E+11 0.000 04810.0 !24b ch2co+mb4j=mh5oxo6j 1.510E+11 0.000 04810.0 !24b c2h4+mf5oxo5j=ms5oxo7j 1.055E+11 0.000 07350.0 !24b c2h4+mh5oxo6j=mo5oxo8j 8.800E+03 2.480 06130.0 !24b ! co+mf5j=mh6oxo6j 1.510E+11 0.000 04810.0 !24b ch2co+mb4j=mh6oxo6j 1.510E+11 0.000 04810.0 !24b ch2co+mf5j=ms6oxo7j 1.510E+11 0.000 04810.0 !24b c2h4+mh6oxo6j=mo6oxo8j 1.055E+11 0.000 07350.0 !24b c2h4+ms6oxo7j=mn6oxo9j 8.800E+03 2.480 06130.0 !24b ! co+mh6j=ms7oxo7j 1.510E+11 0.000 04810.0 !24b ch2co+mf5j=ms7oxo7j 1.510E+11 0.000 04810.0 !24b ch2co+mh6j=mo7oxo8j 1.510E+11 0.000 04810.0 !24b c2h4+ms7oxo7j=mn7oxo9j 1.055E+11 0.000 07350.0 !24b ! co+ms7j=mo8oxo8j 1.510E+11 0.000 04810.0 !24b ch2co+mh6j=mo8oxo8j 1.510E+11 0.000 04810.0 !24b ch2co+ms7j=mn8oxo9j 1.510E+11 0.000 04810.0 !24b ch2co+ms7j=mn9oxo9j 1.510E+11 0.000 04810.00 !24b ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 25/Decomposition of cyclic ethers ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! !Metathesis and first b-scission globalized ! c4h8o1-2+oh=h2o+c2h5chjcho 1.900E+08 1.610 -00035.0 !25 c4h8o1-2+oh=h2o+c2h5coch2 8.840E+09 1.000 -00149.0 !25 c4h8o1-3+oh=h2o+ch3chjch2cho 1.900E+08 1.610 -00035.0 !25 c4h8o1-3+oh=h2o+c2h4coch3 8.840E+09 1.000 -00149.0 !25 c4h8o1-4+oh=h2o+c3h6cho 3.536E+13 1.000 -00149.0 !25 c4h8o2-3+oh=h2o+ch3chjcoch3 1.768E+10 1.000 -00149.0 !25 ! c5h10o1-2+oh=h2o+c3h7chjcho 1.900E+08 1.610 -00035.0 !25 c5h10o1-2+oh=h2o+c3h7coch2 8.840E+09 1.000 -00149.0 !25 c5h10o1-3+oh=h2o+c2h5chjch2cho 1.900E+08 1.610 -00035.0 !25 c5h10o1-3+oh=h2o+c2h5coc2h4 8.840E+09 1.000 -00149.0 !25 c5h10o1-4+oh=h2o+ch3chjc2h4cho 1.900E+08 1.610 -00035.0 !25 c5h10o1-4+oh=h2o+ch3coc3h6 8.840E+09 1.000 -00149.0 !25 c5h10o1-5+oh=h2o+c4h8cho 3.800E+08 1.610 -00035.0 !25 c5h10o2-3+oh=h2o+c2h5chjcoch3 8.840E+09 1.000 -00149.0 !25 c5h10o2-3+oh=h2o+c2h5coc2h4 8.840E+09 1.000 -00149.0 !25 c5h10o2-4+oh=h2o+ch3chjch2coch3 1.768E+10 1.000 -00149.0 !25 ! c6h12o1-2+oh=h2o+c4h9chjcho 1.900E+08 1.610 -00035.0 !25 c6h12o1-2+oh=h2o+c4h9coch2 8.840E+09 1.000 -00149.0 !25 c6h12o1-3+oh=h2o+c3h7chjch2cho 1.900E+08 1.610 -00035.0 !25 c6h12o1-3+oh=h2o+c3h7coc2h4 8.840E+09 1.000 -00149.0 !25 c6h12o1-4+oh=h2o+c2h5chjc2h4cho 1.900E+08 1.610 -00035.0 !25 c6h12o1-4+oh=h2o+c2h5coc3h6 8.840E+09 1.000 -00149.0 !25 c6h12o1-5+oh=h2o+ch3chjc3h6cho 1.900E+08 1.610 -00035.0 !25 c6h12o1-5+oh=h2o+ch3coc4h8 8.840E+09 1.000 -00149.0 !25 c6h12o2-3+oh=h2o+c3h7chjcoch3 8.840E+09 1.000 -00149.0 !25 c6h12o2-3+oh=h2o+ch3chjcoc3h7 8.840E+09 1.000 -00149.0 !25 c6h12o2-4+oh=h2o+c2h5chjch2coch3 8.840E+09 1.000 -00149.0 !25 c6h12o2-4+oh=h2o+ch3chjch2coc2h5 8.840E+09 1.000 -00149.0 !25 c6h12o2-5+oh=h2o+ch3chjc2h4coch3 1.768E+10 1.000 -00149.0 !25 c6h12o3-4+oh=h2o+c2h5chjcoc2h5 1.768E+10 1.000 -00149.0 !25 ! !c7h14o1-2+oh=h2o+c5h11chjcho 1.900E+08 1.610 -00035.0 !25 !c7h14o1-2+oh=h2o+c5h11coch2 8.840E+09 1.000 -00149.0 !25 !c7h14o1-3+oh=h2o+c4h9chjch2cho 1.900E+08 1.610 -00035.0 !25 !c7h14o1-3+oh=h2o+c4h9coc2h4 8.840E+09 1.000 -00149.0 !25 !c7h14o1-4+oh=h2o+c3h7chjc2h4cho 1.900E+08 1.610 -00035.0 !25 !c7h14o1-4+oh=h2o+c3h7coc3h6 8.840E+09 1.000 -00149.0 !25 !c7h14o1-5+oh=h2o+c2h5chjc3h6cho 1.900E+08 1.610 -00035.0 !25 !c7h14o1-5+oh=h2o+c2h5coc4h8 8.840E+09 1.000 -00149.0 !25 !c7h14o2-3+oh=h2o+c4h9chjcoch3 8.840E+09 1.000 -00149.0 !25 !c7h14o2-3+oh=h2o+ch3chjcoc4h9 8.840E+09 1.000 -00149.0 !25 !c7h14o2-4+oh=h2o+c3h7chjch2coch3 8.840E+09 1.000 -00149.0 !25 !c7h14o2-4+oh=h2o+ch3chjch2coc3h7 8.840E+09 1.000 -00149.0 !25 !c7h14o2-5+oh=h2o+c2h5chjc2h4coch3 8.840E+09 1.000 -00149.0 !25 !c7h14o2-5+oh=h2o+ch3chjc2h4coc2h5 8.840E+09 1.000 -00149.0 !25 !c7h14o2-6+oh=h2o+ch3chjc3h6coch3 1.768E+10 1.000 -00149.0 !25 !c7h14o3-4+oh=h2o+c3h7chjcoc2h5 8.840E+09 1.000 -00149.0 !25 !c7h14o3-4+oh=h2o+c2h5chjcoc3h7 8.840E+09 1.000 -00149.0 !25 !c7h14o3-5+oh=h2o+c2h5chjch2coc2h5 1.768E+10 1.000 -00149.0 !25 ! c8h16o1-2+oh=h2o+c6h13chjcho 1.900E+08 1.610 -00035.0 !25 c8h16o1-2+oh=h2o+c6h13coch2 8.840E+09 1.000 -00149.0 !25 c8h16o1-3+oh=h2o+c5h11chjch2cho 1.900E+08 1.610 -00035.0 !25 c8h16o1-3+oh=h2o+c5h11coc2h4 8.840E+09 1.000 -00149.0 !25 c8h16o1-4+oh=h2o+c4h9chjc2h4cho 1.900E+08 1.610 -00035.0 !25 c8h16o1-4+oh=h2o+c4h9coc3h6 8.840E+09 1.000 -00149.0 !25 c8h16o1-5+oh=h2o+c3h7chjc3h6cho 1.900E+08 1.610 -00035.0 !25 c8h16o1-5+oh=h2o+c3h7coc4h8 8.840E+09 1.000 -00149.0 !25 c8h16o2-3+oh=h2o+c5h11chjcoch3 8.840E+09 1.000 -00149.0 !25 c8h16o2-3+oh=h2o+ch3chjcoc5h11 8.840E+09 1.000 -00149.0 !25 c8h16o2-4+oh=h2o+c4h9chjch2coch3 8.840E+09 1.000 -00149.0 !25 c8h16o2-4+oh=h2o+ch3chjch2coc4h9 8.840E+09 1.000 -00149.0 !25 c8h16o2-5+oh=h2o+c3h7chjc2h4coch3 8.840E+09 1.000 -00149.0 !25 c8h16o2-5+oh=h2o+ch3chjc2h4coc3h7 8.840E+09 1.000 -00149.0 !25 c8h16o2-6+oh=h2o+c2h5chjc3h6coch3 8.840E+09 1.000 -00149.0 !25 c8h16o2-6+oh=h2o+ch3chjc3h6coc2h5 8.840E+09 1.000 -00149.0 !25 c8h16o3-4+oh=h2o+c4h9chjcoc2h5 8.840E+09 1.000 -00149.0 !25 c8h16o3-4+oh=h2o+c2h5chjcoc4h9 8.840E+09 1.000 -00149.0 !25 c8h16o3-5+oh=h2o+c3h7chjch2coc2h5 8.840E+09 1.000 -00149.0 !25 c8h16o3-5+oh=h2o+c2h5chjch2coc3h7 8.840E+09 1.000 -00149.0 !25 c8h16o3-6+oh=h2o+c2h5chc2h4coc2h5 1.768E+10 1.000 -00149.0 !25 c8h16o4-5+oh=h2o+c3h7chjcoc3h7 1.768E+10 1.000 -00149.0 !25 ! c9h18o1-2+oh=h2o+c7h15chjcho 1.900E+08 1.610 -00035.0 !25 c9h18o1-2+oh=h2o+c7h15coch2 8.840E+09 1.000 -00149.0 !25 c9h18o1-3+oh=h2o+c6h13chjch2cho 1.900E+08 1.610 -00035.0 !25 c9h18o1-3+oh=h2o+c6h13coc2h4 8.840E+09 1.000 -00149.0 !25 c9h18o1-4+oh=h2o+c5h11chjc2h4cho 1.900E+08 1.610 -00035.0 !25 c9h18o1-4+oh=h2o+c5h11coc3h6 8.840E+09 1.000 -00149.0 !25 c9h18o1-5+oh=h2o+c4h9chjc3h6cho 1.900E+08 1.610 -00035.0 !25 c9h18o1-5+oh=h2o+c4h9coc4h8 8.840E+09 1.000 -00149.0 !25 c9h18o2-3+oh=h2o+c6h13chjcoch3 8.840E+09 1.000 -00149.0 !25 c9h18o2-3+oh=h2o+ch3chjcoc6h13 8.840E+09 1.000 -00149.0 !25 c9h18o2-4+oh=h2o+c5h11chjch2coch3 8.840E+09 1.000 -00149.0 !25 c9h18o2-4+oh=h2o+ch3chjch2coc5h11 8.840E+09 1.000 -00149.0 !25 c9h18o2-5+oh=h2o+c4h9chjc2h4coch3 8.840E+09 1.000 -00149.0 !25 c9h18o2-5+oh=h2o+ch3chjc2h4coc4h9 8.840E+09 1.000 -00149.0 !25 c9h18o2-6+oh=h2o+c3h7chjc3h6coch3 8.840E+09 1.000 -00149.0 !25 c9h18o2-6+oh=h2o+ch3chjc3h6coc3h7 8.840E+09 1.000 -00149.0 !25 c9h18o3-4+oh=h2o+c5h11chjcoc2h5 8.840E+09 1.000 -00149.0 !25 c9h18o3-4+oh=h2o+c2h5chjcoc5h11 8.840E+09 1.000 -00149.0 !25 c9h18o3-5+oh=h2o+c4h9chjch2coc2h5 8.840E+09 1.000 -00149.0 !25 c9h18o3-5+oh=h2o+c2h5chjch2coc4h9 8.840E+09 1.000 -00149.0 !25 c9h18o3-6+oh=h2o+c3h7chc2h4coc2h5 8.840E+09 1.000 -00149.0 !25 c9h18o3-6+oh=h2o+c2h5chc2h4coc3h7 8.840E+09 1.000 -00149.0 !25 c9h18o3-7+oh=h2o+c2h5chc3h6coc2h5 1.768E+10 1.000 -00149.0 !25 c9h18o4-5+oh=h2o+c4h9chjcoc3h7 8.840E+09 1.000 -00149.0 !25 c9h18o4-5+oh=h2o+c3h7chjcoc4h9 8.840E+09 1.000 -00149.0 !25 c9h18o4-6+oh=h2o+c3h7chjch2coc3h7 1.768E+10 1.000 -00149.0 !25 ! meom-2+oh=h2o+memoxo2j 1.900E+08 1.610 -00035.0 !25 meom-2+oh=h2o+me2oxomj 1.900E+08 1.610 -00035.0 !25 ! mpom-2+oh=h2o+mpmoxo2j 1.900E+08 1.610 -00035.0 !25 mpom-2+oh=h2o+mp2oxomj 8.840E+09 1.000 -00149.0 !25 mpom-3+oh=h2o+mpmoxo3j 1.900E+08 1.610 -00035.0 !25 mpom-3+oh=h2o+mp3oxomj 1.900E+08 1.610 -00035.0 !25 mpo2-3+oh=h2o+mp2oxo3j 8.840E+09 1.000 -00149.0 !25 mpo2-3+oh=h2o+mp3oxo2j 1.900E+08 1.610 -00035.0 !25 ! mbom-2+oh=h2o+mbmoxo2j 1.900E+08 1.610 -00035.0 !25 mbom-2+oh=h2o+mb2oxomj 8.840E+09 1.000 -00149.0 !25 mbom-3+oh=h2o+mbmoxo3j 1.900E+08 1.610 -00035.0 !25 mbom-3+oh=h2o+mb3oxomj 8.840E+09 1.000 -00149.0 !25 mbo2-3+oh=h2o+mb2oxo3j 8.840E+09 1.000 -00149.0 !25 mbo2-3+oh=h2o+mb3oxo2j 8.840E+09 1.000 -00149.0 !25 mbo2-4+oh=h2o+mb2oxo4j 8.840E+09 1.000 -00149.0 !25 mbo2-4+oh=h2o+mb4oxo2j 1.900E+08 1.610 -00035.0 !25 mbo3-4+oh=h2o+mb3oxo4j 8.840E+09 1.000 -00149.0 !25 mbo3-4+oh=h2o+mb4oxo3j 1.900E+08 1.610 -00035.0 !25 ! mfom-2+oh=h2o+mfmoxo2j 1.900E+08 1.610 -00035.0 !25 mfom-2+oh=h2o+mf2oxomj 8.840E+09 1.000 -00149.0 !25 mfom-3+oh=h2o+mfmoxo3j 1.900E+08 1.610 -00035.0 !25 mfom-3+oh=h2o+mf3oxomj 8.840E+09 1.000 -00149.0 !25 mfo2-3+oh=h2o+mf2oxo3j 8.840E+09 1.000 -00149.0 !25 mfo2-3+oh=h2o+mf3oxo2j 8.840E+09 1.000 -00149.0 !25 mfo2-4+oh=h2o+mf2oxo4j 8.840E+09 1.000 -00149.0 !25 mfo2-4+oh=h2o+mf4oxo2j 8.840E+09 1.000 -00149.0 !25 mfo2-5+oh=h2o+mf2oxo5j 8.840E+09 1.000 -00149.0 !25 mfo2-5+oh=h2o+mf5oxo2j 1.900E+08 1.610 -00035.0 !25 mfo3-4+oh=h2o+mf3oxo4j 8.840E+09 1.000 -00149.0 !25 mfo3-4+oh=h2o+mf4oxo3j 8.840E+09 1.000 -00149.0 !25 mfo3-5+oh=h2o+mf3oxo5j 8.840E+09 1.000 -00149.0 !25 mfo3-5+oh=h2o+mf5oxo3j 1.900E+08 1.610 -00035.0 !25 mfo4-5+oh=h2o+mf4oxo5j 8.840E+09 1.000 -00149.0 !25 mfo4-5+oh=h2o+mf5oxo4j 1.900E+08 1.610 -00035.0 !25 ! mhom-2+oh=h2o+mhmoxo2j 1.900E+08 1.610 -00035.0 !25 mhom-2+oh=h2o+mh2oxomj 8.840E+09 1.000 -00149.0 !25 mhom-3+oh=h2o+mhmoxo3j 1.900E+08 1.610 -00035.0 !25 mhom-3+oh=h2o+mh3oxomj 8.840E+09 1.000 -00149.0 !25 mho2-3+oh=h2o+mh2oxo3j 8.840E+09 1.000 -00149.0 !25 mho2-3+oh=h2o+mh3oxo2j 8.840E+09 1.000 -00149.0 !25 mho2-4+oh=h2o+mh2oxo4j 8.840E+09 1.000 -00149.0 !25 mho2-4+oh=h2o+mh4oxo2j 8.840E+09 1.000 -00149.0 !25 mho2-5+oh=h2o+mh2oxo5j 8.840E+09 1.000 -00149.0 !25 mho2-5+oh=h2o+mh5oxo2j 8.840E+09 1.000 -00149.0 !25 mho2-6+oh=h2o+mh2oxo6j 8.840E+09 1.000 -00149.0 !25 mho2-6+oh=h2o+mh6oxo2j 1.900E+08 1.610 -00035.0 !25 mho3-4+oh=h2o+mh3oxo4j 8.840E+09 1.000 -00149.0 !25 mho3-4+oh=h2o+mh4oxo3j 8.840E+09 1.000 -00149.0 !25 mho3-5+oh=h2o+mh3oxo5j 8.840E+09 1.000 -00149.0 !25 mho3-5+oh=h2o+mh5oxo3j 8.840E+09 1.000 -00149.0 !25 mho3-6+oh=h2o+mh3oxo6j 8.840E+09 1.000 -00149.0 !25 mho3-6+oh=h2o+mh6oxo3j 1.900E+08 1.610 -00035.0 !25 mho4-5+oh=h2o+mh4oxo5j 8.840E+09 1.000 -00149.0 !25 mho4-5+oh=h2o+mh5oxo4j 8.840E+09 1.000 -00149.0 !25 mho4-6+oh=h2o+mh4oxo6j 8.840E+09 1.000 -00149.0 !25 mho4-6+oh=h2o+mh6oxo4j 1.900E+08 1.610 -00035.0 !25 mho5-6+oh=h2o+mh5oxo6j 8.840E+09 1.000 -00149.0 !25 mho5-6+oh=h2o+mh6oxo5j 1.900E+08 1.610 -00035.0 !25 ! msom-2+oh=h2o+msmoxo2j 1.900E+08 1.610 -00035.0 !25 msom-2+oh=h2o+ms2oxomj 8.840E+09 1.000 -00149.0 !25 msom-3+oh=h2o+msmoxo3j 1.900E+08 1.610 -00035.0 !25 msom-3+oh=h2o+ms3oxomj 8.840E+09 1.000 -00149.0 !25 mso2-3+oh=h2o+ms2oxo3j 8.840E+09 1.000 -00149.0 !25 mso2-3+oh=h2o+ms3oxo2j 8.840E+09 1.000 -00149.0 !25 mso2-4+oh=h2o+ms2oxo4j 8.840E+09 1.000 -00149.0 !25 mso2-4+oh=h2o+ms4oxo2j 8.840E+09 1.000 -00149.0 !25 mso2-5+oh=h2o+ms2oxo5j 8.840E+09 1.000 -00149.0 !25 mso2-5+oh=h2o+ms5oxo2j 8.840E+09 1.000 -00149.0 !25 mso2-6+oh=h2o+ms2oxo6j 8.840E+09 1.000 -00149.0 !25 mso2-6+oh=h2o+ms6oxo2j 8.840E+09 1.000 -00149.0 !25 mso3-4+oh=h2o+ms3oxo4j 8.840E+09 1.000 -00149.0 !25 mso3-4+oh=h2o+ms4oxo3j 8.840E+09 1.000 -00149.0 !25 mso3-5+oh=h2o+ms3oxo5j 8.840E+09 1.000 -00149.0 !25 mso3-5+oh=h2o+ms5oxo3j 8.840E+09 1.000 -00149.0 !25 mso3-6+oh=h2o+ms3oxo6j 8.840E+09 1.000 -00149.0 !25 mso3-6+oh=h2o+ms6oxo3j 8.840E+09 1.000 -00149.0 !25 mso3-7+oh=h2o+ms3oxo7j 8.840E+09 1.000 -00149.0 !25 mso3-7+oh=h2o+ms7oxo3j 1.900E+08 1.610 -00035.0 !25 mso4-5+oh=h2o+ms4oxo5j 8.840E+09 1.000 -00149.0 !25 mso4-5+oh=h2o+ms5oxo4j 8.840E+09 1.000 -00149.0 !25 mso4-6+oh=h2o+ms4oxo6j 8.840E+09 1.000 -00149.0 !25 mso4-6+oh=h2o+ms6oxo4j 8.840E+09 1.000 -00149.0 !25 mso4-7+oh=h2o+ms4oxo7j 8.840E+09 1.000 -00149.0 !25 mso4-7+oh=h2o+ms7oxo4j 1.900E+08 1.610 -00035.0 !25 mso5-6+oh=h2o+ms5oxo6j 8.840E+09 1.000 -00149.0 !25 mso5-6+oh=h2o+ms6oxo5j 8.840E+09 1.000 -00149.0 !25 mso5-7+oh=h2o+ms5oxo7j 8.840E+09 1.000 -00149.0 !25 mso5-7+oh=h2o+ms7oxo5j 1.900E+08 1.610 -00035.0 !25 mso6-7+oh=h2o+ms6oxo7j 8.840E+09 1.000 -00149.0 !25 mso6-7+oh=h2o+ms7oxo6j 1.900E+08 1.610 -00035.0 !25 ! moom-2+oh=h2o+momoxo2j 1.900E+08 1.610 -00035.0 !25 moom-2+oh=h2o+mo2oxomj 8.840E+09 1.000 -00149.0 !25 moom-3+oh=h2o+momoxo3j 1.900E+08 1.610 -00035.0 !25 moom-3+oh=h2o+mo3oxomj 8.840E+09 1.000 -00149.0 !25 moo2-3+oh=h2o+mo2oxo3j 8.840E+09 1.000 -00149.0 !25 moo2-3+oh=h2o+mo3oxo2j 8.840E+09 1.000 -00149.0 !25 moo2-4+oh=h2o+mo2oxo4j 8.840E+09 1.000 -00149.0 !25 moo2-4+oh=h2o+mo4oxo2j 8.840E+09 1.000 -00149.0 !25 moo2-5+oh=h2o+mo2oxo5j 8.840E+09 1.000 -00149.0 !25 moo2-5+oh=h2o+mo5oxo2j 8.840E+09 1.000 -00149.0 !25 moo2-6+oh=h2o+mo2oxo6j 8.840E+09 1.000 -00149.0 !25 moo2-6+oh=h2o+mo6oxo2j 8.840E+09 1.000 -00149.0 !25 moo3-4+oh=h2o+mo3oxo4j 8.840E+09 1.000 -00149.0 !25 moo3-4+oh=h2o+mo4oxo3j 8.840E+09 1.000 -00149.0 !25 moo3-5+oh=h2o+mo3oxo5j 8.840E+09 1.000 -00149.0 !25 moo3-5+oh=h2o+mo5oxo3j 8.840E+09 1.000 -00149.0 !25 moo3-6+oh=h2o+mo3oxo6j 8.840E+09 1.000 -00149.0 !25 moo3-6+oh=h2o+mo6oxo3j 8.840E+09 1.000 -00149.0 !25 moo3-7+oh=h2o+mo3oxo7j 8.840E+09 1.000 -00149.0 !25 moo3-7+oh=h2o+mo7oxo3j 8.840E+09 1.000 -00149.0 !25 moo4-5+oh=h2o+mo4oxo5j 8.840E+09 1.000 -00149.0 !25 moo4-5+oh=h2o+mo5oxo4j 8.840E+09 1.000 -00149.0 !25 moo4-6+oh=h2o+mo4oxo6j 8.840E+09 1.000 -00149.0 !25 moo4-6+oh=h2o+mo6oxo4j 8.840E+09 1.000 -00149.0 !25 moo4-7+oh=h2o+mo4oxo7j 8.840E+09 1.000 -00149.0 !25 moo4-7+oh=h2o+mo7oxo4j 8.840E+09 1.000 -00149.0 !25 moo4-8+oh=h2o+mo4oxo8j 8.840E+09 1.000 -00149.0 !25 moo4-8+oh=h2o+mo8oxo4j 1.900E+08 1.610 -00035.0 !25 moo5-6+oh=h2o+mo5oxo6j 8.840E+09 1.000 -00149.0 !25 moo5-6+oh=h2o+mo6oxo5j 8.840E+09 1.000 -00149.0 !25 moo5-7+oh=h2o+mo5oxo7j 8.840E+09 1.000 -00149.0 !25 moo5-7+oh=h2o+mo7oxo5j 8.840E+09 1.000 -00149.0 !25 moo5-8+oh=h2o+mo5oxo8j 8.840E+09 1.000 -00149.0 !25 moo5-8+oh=h2o+mo8oxo5j 1.900E+08 1.610 -00035.0 !25 moo6-7+oh=h2o+mo6oxo7j 8.840E+09 1.000 -00149.0 !25 moo6-7+oh=h2o+mo7oxo6j 8.840E+09 1.000 -00149.0 !25 moo6-8+oh=h2o+mo6oxo8j 8.840E+09 1.000 -00149.0 !25 moo6-8+oh=h2o+mo8oxo6j 1.900E+08 1.610 -00035.0 !25 moo7-8+oh=h2o+mo7oxo8j 8.840E+09 1.000 -00149.0 !25 moo7-8+oh=h2o+mo8oxo7j 1.900E+08 1.610 -00035.0 !25 ! mnom-2+oh=h2o+mnmoxo2j 1.900E+08 1.610 -00035.0 !25 mnom-2+oh=h2o+mn2oxomj 8.840E+09 1.000 -00149.0 !25 mnom-3+oh=h2o+mnmoxo3j 1.900E+08 1.610 -00035.0 !25 mnom-3+oh=h2o+mn3oxomj 8.840E+09 1.000 -00149.0 !25 mno2-3+oh=h2o+mn2oxo3j 8.840E+09 1.000 -00149.0 !25 mno2-3+oh=h2o+mn3oxo2j 8.840E+09 1.000 -00149.0 !25 mno2-4+oh=h2o+mn2oxo4j 8.840E+09 1.000 -00149.0 !25 mno2-4+oh=h2o+mn4oxo2j 8.840E+09 1.000 -00149.0 !25 mno2-5+oh=h2o+mn2oxo5j 8.840E+09 1.000 -00149.0 !25 mno2-5+oh=h2o+mn5oxo2j 8.840E+09 1.000 -00149.0 !25 mno2-6+oh=h2o+mn2oxo6j 8.840E+09 1.000 -00149.0 !25 mno2-6+oh=h2o+mn6oxo2j 8.840E+09 1.000 -00149.0 !25 mno3-4+oh=h2o+mn3oxo4j 8.840E+09 1.000 -00149.0 !25 mno3-4+oh=h2o+mn4oxo3j 8.840E+09 1.000 -00149.0 !25 mno3-5+oh=h2o+mn3oxo5j 8.840E+09 1.000 -00149.0 !25 mno3-5+oh=h2o+mn5oxo3j 8.840E+09 1.000 -00149.0 !25 mno3-6+oh=h2o+mn3oxo6j 8.840E+09 1.000 -00149.0 !25 mno3-6+oh=h2o+mn6oxo3j 8.840E+09 1.000 -00149.0 !25 mno3-7+oh=h2o+mn3oxo7j 8.840E+09 1.000 -00149.0 !25 mno3-7+oh=h2o+mn7oxo3j 8.840E+09 1.000 -00149.0 !25 mno4-5+oh=h2o+mn4oxo5j 8.840E+09 1.000 -00149.0 !25 mno4-5+oh=h2o+mn5oxo4j 8.840E+09 1.000 -00149.0 !25 mno4-6+oh=h2o+mn4oxo6j 8.840E+09 1.000 -00149.0 !25 mno4-6+oh=h2o+mn6oxo4j 8.840E+09 1.000 -00149.0 !25 mno4-7+oh=h2o+mn4oxo7j 8.840E+09 1.000 -00149.0 !25 mno4-7+oh=h2o+mn7oxo4j 8.840E+09 1.000 -00149.0 !25 mno4-8+oh=h2o+mn4oxo8j 8.840E+09 1.000 -00149.0 !25 mno4-8+oh=h2o+mn8oxo4j 8.840E+09 1.000 -00149.0 !25 mno5-6+oh=h2o+mn5oxo6j 8.840E+09 1.000 -00149.0 !25 mno5-6+oh=h2o+mn6oxo5j 8.840E+09 1.000 -00149.0 !25 mno5-7+oh=h2o+mn5oxo7j 8.840E+09 1.000 -00149.0 !25 mno5-7+oh=h2o+mn7oxo5j 8.840E+09 1.000 -00149.0 !25 mno5-8+oh=h2o+mn5oxo8j 8.840E+09 1.000 -00149.0 !25 mno5-8+oh=h2o+mn8oxo5j 8.840E+09 1.000 -00149.0 !25 mno5-9+oh=h2o+mn5oxo9j 8.840E+09 1.000 -00149.0 !25 mno5-9+oh=h2o+mn9oxo5j 1.900E+08 1.610 -00035.0 !25 mno6-7+oh=h2o+mn6oxo7j 8.840E+09 1.000 -00149.0 !25 mno6-7+oh=h2o+mn7oxo6j 8.840E+09 1.000 -00149.0 !25 mno6-8+oh=h2o+mn6oxo8j 8.840E+09 1.000 -00149.0 !25 mno6-8+oh=h2o+mn8oxo6j 8.840E+09 1.000 -00149.0 !25 mno6-9+oh=h2o+mn6oxo9j 8.840E+09 1.000 -00149.0 !25 mno6-9+oh=h2o+mn9oxo6j 1.900E+08 1.610 -00035.0 !25 mno7-8+oh=h2o+mn7oxo8j 8.840E+09 1.000 -00149.0 !25 mno7-8+oh=h2o+mn8oxo7j 8.840E+09 1.000 -00149.0 !25 mno7-9+oh=h2o+mn7oxo9j 8.840E+09 1.000 -00149.0 !25 mno7-9+oh=h2o+mn9oxo7j 1.900E+08 1.610 -00035.0 !25 mno8-9+oh=h2o+mn8oxo9j 8.840E+09 1.000 -00149.0 !25 mno8-9+oh=h2o+mn9oxo8j 1.900E+08 1.610 -00035.0 !25 ! mdom-2+oh=h2o+mdmoxo2j 1.900E+08 1.610 -00035.0 !25 mdom-2+oh=h2o+md2oxomj 8.840E+09 1.000 -00149.0 !25 mdom-3+oh=h2o+mdmoxo3j 1.900E+08 1.610 -00035.0 !25 mdom-3+oh=h2o+md3oxomj 8.840E+09 1.000 -00149.0 !25 mdo2-3+oh=h2o+md2oxo3j 8.840E+09 1.000 -00149.0 !25 mdo2-3+oh=h2o+md3oxo2j 8.840E+09 1.000 -00149.0 !25 mdo2-4+oh=h2o+md2oxo4j 8.840E+09 1.000 -00149.0 !25 mdo2-4+oh=h2o+md4oxo2j 8.840E+09 1.000 -00149.0 !25 mdo2-5+oh=h2o+md2oxo5j 8.840E+09 1.000 -00149.0 !25 mdo2-5+oh=h2o+md5oxo2j 8.840E+09 1.000 -00149.0 !25 mdo2-6+oh=h2o+md2oxo6j 8.840E+09 1.000 -00149.0 !25 mdo2-6+oh=h2o+md6oxo2j 8.840E+09 1.000 -00149.0 !25 mdo3-4+oh=h2o+md3oxo4j 8.840E+09 1.000 -00149.0 !25 mdo3-4+oh=h2o+md4oxo3j 8.840E+09 1.000 -00149.0 !25 mdo3-5+oh=h2o+md3oxo5j 8.840E+09 1.000 -00149.0 !25 mdo3-5+oh=h2o+md5oxo3j 8.840E+09 1.000 -00149.0 !25 mdo3-6+oh=h2o+md3oxo6j 8.840E+09 1.000 -00149.0 !25 mdo3-6+oh=h2o+md6oxo3j 8.840E+09 1.000 -00149.0 !25 mdo3-7+oh=h2o+md3oxo7j 8.840E+09 1.000 -00149.0 !25 mdo3-7+oh=h2o+md7oxo3j 8.840E+09 1.000 -00149.0 !25 mdo4-5+oh=h2o+md4oxo5j 8.840E+09 1.000 -00149.0 !25 mdo4-5+oh=h2o+md5oxo4j 8.840E+09 1.000 -00149.0 !25 mdo4-6+oh=h2o+md4oxo6j 8.840E+09 1.000 -00149.0 !25 mdo4-6+oh=h2o+md6oxo4j 8.840E+09 1.000 -00149.0 !25 mdo4-7+oh=h2o+md4oxo7j 8.840E+09 1.000 -00149.0 !25 mdo4-7+oh=h2o+md7oxo4j 8.840E+09 1.000 -00149.0 !25 mdo4-8+oh=h2o+md4oxo8j 8.840E+09 1.000 -00149.0 !25 mdo4-8+oh=h2o+md8oxo4j 8.840E+09 1.000 -00149.0 !25 mdo5-6+oh=h2o+md5oxo6j 8.840E+09 1.000 -00149.0 !25 mdo5-6+oh=h2o+md6oxo5j 8.840E+09 1.000 -00149.0 !25 mdo5-7+oh=h2o+md5oxo7j 8.840E+09 1.000 -00149.0 !25 mdo5-7+oh=h2o+md7oxo5j 8.840E+09 1.000 -00149.0 !25 mdo5-8+oh=h2o+md5oxo8j 8.840E+09 1.000 -00149.0 !25 mdo5-8+oh=h2o+md8oxo5j 8.840E+09 1.000 -00149.0 !25 mdo5-9+oh=h2o+md5oxo9j 8.840E+09 1.000 -00149.0 !25 mdo5-9+oh=h2o+md9oxo5j 8.840E+09 1.000 -00149.0 !25 mdo6-7+oh=h2o+md6oxo7j 8.840E+09 1.000 -00149.0 !25 mdo6-7+oh=h2o+md7oxo6j 8.840E+09 1.000 -00149.0 !25 mdo6-8+oh=h2o+md6oxo8j 8.840E+09 1.000 -00149.0 !25 mdo6-8+oh=h2o+md8oxo6j 8.840E+09 1.000 -00149.0 !25 mdo6-9+oh=h2o+md6oxo9j 8.840E+09 1.000 -00149.0 !25 mdo6-9+oh=h2o+md9oxo6j 8.840E+09 1.000 -00149.0 !25 mdo6-10+oh=h2o+md6oxo10j 1.900E+08 1.610 -00035.0 !25 mdo6-10+oh=h2o+md10oxo6j 8.840E+09 1.000 -00149.0 !25 mdo7-8+oh=h2o+md7oxo8j 8.840E+09 1.000 -00149.0 !25 mdo7-8+oh=h2o+md8oxo7j 8.840E+09 1.000 -00149.0 !25 mdo7-9+oh=h2o+md7oxo9j 8.840E+09 1.000 -00149.0 !25 mdo7-9+oh=h2o+md9oxo7j 8.840E+09 1.000 -00149.0 !25 mdo7-10+oh=h2o+md7oxo10j 1.900E+08 1.610 -00035.0 !25 mdo7-10+oh=h2o+md10oxo7j 8.840E+09 1.000 -00149.0 !25 mdo8-9+oh=h2o+md8oxo9j 8.840E+09 1.000 -00149.0 !25 mdo8-9+oh=h2o+md9oxo8j 8.840E+09 1.000 -00149.0 !25 mdo8-10+oh=h2o+md8oxo10j 8.840E+09 1.000 -00149.0 !25 mdo8-10+oh=h2o+md10oxo8j 1.900E+08 1.610 -00035.0 !25 mdo9-10+oh=h2o+md9oxo10j 8.840E+09 1.000 -00149.0 !25 mdo9-10+oh=h2o+md10oxo9j 1.900E+08 1.610 -00035.0 !25 ! c4h8o1-2+ho2=h2o2+c2h5chjcho 6.000E+04 2.600 13910.0 !25 c4h8o1-2+ho2=h2o2+c2h5coch2 1.080E+04 2.550 10532.0 !25 c4h8o1-3+ho2=h2o2+ch3chjch2cho 6.000E+04 2.600 13910.0 !25 c4h8o1-3+ho2=h2o2+c2h4coch3 1.080E+04 2.550 10532.0 !25 c4h8o1-4+ho2=h2o2+c3h6cho 1.200E+05 2.600 13910.0 !25 c4h8o2-3+ho2=h2o2+ch3chjcoch3 2.160E+04 2.550 10532.0 !25 ! c5h10o1-2+ho2=h2o2+c3h7chjcho 6.000E+04 2.600 13910.0 !25 c5h10o1-2+ho2=h2o2+c3h7coch2 1.080E+04 2.550 10532.0 !25 c5h10o1-3+ho2=h2o2+c2h5chjch2cho 6.000E+04 2.600 13910.0 !25 c5h10o1-3+ho2=h2o2+c2h5coc2h4 1.080E+04 2.550 10532.0 !25 c5h10o1-4+ho2=h2o2+ch3chjc2h4cho 6.000E+04 2.600 13910.0 !25 c5h10o1-4+ho2=h2o2+ch3coc3h6 1.080E+04 2.550 10532.0 !25 c5h10o1-5+ho2=h2o2+c4h8cho 1.200E+05 2.600 13910.0 !25 c5h10o2-3+ho2=h2o2+c2h5chjcoch3 1.080E+04 2.550 10532.0 !25 c5h10o2-3+ho2=h2o2+c2h5coc2h4 1.080E+04 2.550 10532.0 !25 c5h10o2-4+ho2=h2o2+ch3chjch2coch3 2.160E+04 2.550 10532.0 !25 ! c6h12o1-2+ho2=h2o2+c4h9chjcho 6.000E+04 2.600 13910.0 !25 c6h12o1-2+ho2=h2o2+c4h9coch2 1.080E+04 2.550 10532.0 !25 c6h12o1-3+ho2=h2o2+c3h7chjch2cho 6.000E+04 2.600 13910.0 !25 c6h12o1-3+ho2=h2o2+c3h7coc2h4 1.080E+04 2.550 10532.0 !25 c6h12o1-4+ho2=h2o2+c2h5chjc2h4cho 6.000E+04 2.600 13910.0 !25 c6h12o1-4+ho2=h2o2+c2h5coc3h6 1.080E+04 2.550 10532.0 !25 c6h12o1-5+ho2=h2o2+ch3chjc3h6cho 6.000E+04 2.600 13910.0 !25 c6h12o1-5+ho2=h2o2+ch3coc4h8 1.080E+04 2.550 10532.0 !25 c6h12o2-3+ho2=h2o2+c3h7chjcoch3 1.080E+04 2.550 10532.0 !25 c6h12o2-3+ho2=h2o2+ch3chjcoc3h7 1.080E+04 2.550 10532.0 !25 c6h12o2-4+ho2=h2o2+c2h5chjch2coch3 1.080E+04 2.550 10532.0 !25 c6h12o2-4+ho2=h2o2+ch3chjch2coc2h5 1.080E+04 2.550 10532.0 !25 c6h12o2-5+ho2=h2o2+ch3chjc2h4coch3 2.160E+04 2.550 10532.0 !25 c6h12o3-4+ho2=h2o2+c2h5chjcoc2h5 2.160E+04 2.550 10532.0 !25 ! !c7h14o1-2+ho2=h2o2+c5h11chjcho 6.000E+04 2.600 13910.0 !25 !c7h14o1-2+ho2=h2o2+c5h11coch2 1.080E+04 2.550 10532.0 !25 !c7h14o1-3+ho2=h2o2+c4h9chjch2cho 6.000E+04 2.600 13910.0 !25 !c7h14o1-3+ho2=h2o2+c4h9coc2h4 1.080E+04 2.550 10532.0 !25 !c7h14o1-4+ho2=h2o2+c3h7chjc2h4cho 6.000E+04 2.600 13910.0 !25 !c7h14o1-4+ho2=h2o2+c3h7coc3h6 1.080E+04 2.550 10532.0 !25 !c7h14o1-5+ho2=h2o2+c2h5chjc3h6cho 6.000E+04 2.600 13910.0 !25 !c7h14o1-5+ho2=h2o2+c2h5coc4h8 1.080E+04 2.550 10532.0 !25 !c7h14o2-3+ho2=h2o2+c4h9chjcoch3 1.080E+04 2.550 10532.0 !25 !c7h14o2-3+ho2=h2o2+ch3chjcoc4h9 1.080E+04 2.550 10532.0 !25 !c7h14o2-4+ho2=h2o2+c3h7chjch2coch3 1.080E+04 2.550 10532.0 !25 !c7h14o2-4+ho2=h2o2+ch3chjch2coc3h7 1.080E+04 2.550 10532.0 !25 !c7h14o2-5+ho2=h2o2+c2h5chjc2h4coch3 1.080E+04 2.550 10532.0 !25 !c7h14o2-5+ho2=h2o2+ch3chjc2h4coc2h5 1.080E+04 2.550 10532.0 !25 !c7h14o2-6+ho2=h2o2+ch3chjc3h6coch3 2.160E+04 2.550 10532.0 !25 !c7h14o3-4+ho2=h2o2+c3h7chjcoc2h5 1.080E+04 2.550 10532.0 !25 !c7h14o3-4+ho2=h2o2+c2h5chjcoc3h7 1.080E+04 2.550 10532.0 !25 !c7h14o3-5+ho2=h2o2+c2h5chjch2coc2h5 2.160E+04 2.550 10532.0 !25 ! c8h16o1-2+ho2=h2o2+c6h13chjcho 6.000E+04 2.600 13910.0 !25 c8h16o1-2+ho2=h2o2+c6h13coch2 1.080E+04 2.550 10532.0 !25 c8h16o1-3+ho2=h2o2+c5h11chjch2cho 6.000E+04 2.600 13910.0 !25 c8h16o1-3+ho2=h2o2+c5h11coc2h4 1.080E+04 2.550 10532.0 !25 c8h16o1-4+ho2=h2o2+c4h9chjc2h4cho 6.000E+04 2.600 13910.0 !25 c8h16o1-4+ho2=h2o2+c4h9coc3h6 1.080E+04 2.550 10532.0 !25 c8h16o1-5+ho2=h2o2+c3h7chjc3h6cho 6.000E+04 2.600 13910.0 !25 c8h16o1-5+ho2=h2o2+c3h7coc4h8 1.080E+04 2.550 10532.0 !25 c8h16o2-3+ho2=h2o2+c5h11chjcoch3 1.080E+04 2.550 10532.0 !25 c8h16o2-3+ho2=h2o2+ch3chjcoc5h11 1.080E+04 2.550 10532.0 !25 c8h16o2-4+ho2=h2o2+c4h9chjch2coch3 1.080E+04 2.550 10532.0 !25 c8h16o2-4+ho2=h2o2+ch3chjch2coc4h9 1.080E+04 2.550 10532.0 !25 c8h16o2-5+ho2=h2o2+c3h7chjc2h4coch3 1.080E+04 2.550 10532.0 !25 c8h16o2-5+ho2=h2o2+ch3chjc2h4coc3h7 1.080E+04 2.550 10532.0 !25 c8h16o2-6+ho2=h2o2+c2h5chjc3h6coch3 1.080E+04 2.550 10532.0 !25 c8h16o2-6+ho2=h2o2+ch3chjc3h6coc2h5 1.080E+04 2.550 10532.0 !25 c8h16o3-4+ho2=h2o2+c4h9chjcoc2h5 1.080E+04 2.550 10532.0 !25 c8h16o3-4+ho2=h2o2+c2h5chjcoc4h9 1.080E+04 2.550 10532.0 !25 c8h16o3-5+ho2=h2o2+c3h7chjch2coc2h5 1.080E+04 2.550 10532.0 !25 c8h16o3-5+ho2=h2o2+c2h5chjch2coc3h7 1.080E+04 2.550 10532.0 !25 c8h16o3-6+ho2=h2o2+c2h5chc2h4coc2h5 2.160E+04 2.550 10532.0 !25 c8h16o4-5+ho2=h2o2+c3h7chjcoc3h7 2.160E+04 2.550 10532.0 !25 ! c9h18o1-2+ho2=h2o2+c7h15chjcho 6.000E+04 2.600 13910.0 !25 c9h18o1-2+ho2=h2o2+c7h15coch2 1.080E+04 2.550 10532.0 !25 c9h18o1-3+ho2=h2o2+c6h13chjch2cho 6.000E+04 2.600 13910.0 !25 c9h18o1-3+ho2=h2o2+c6h13coc2h4 1.080E+04 2.550 10532.0 !25 c9h18o1-4+ho2=h2o2+c5h11chjc2h4cho 6.000E+04 2.600 13910.0 !25 c9h18o1-4+ho2=h2o2+c5h11coc3h6 1.080E+04 2.550 10532.0 !25 c9h18o1-5+ho2=h2o2+c4h9chjc3h6cho 6.000E+04 2.600 13910.0 !25 c9h18o1-5+ho2=h2o2+c4h9coc4h8 1.080E+04 2.550 10532.0 !25 c9h18o2-3+ho2=h2o2+c6h13chjcoch3 1.080E+04 2.550 10532.0 !25 c9h18o2-3+ho2=h2o2+ch3chjcoc6h13 1.080E+04 2.550 10532.0 !25 c9h18o2-4+ho2=h2o2+c5h11chjch2coch3 1.080E+04 2.550 10532.0 !25 c9h18o2-4+ho2=h2o2+ch3chjch2coc5h11 1.080E+04 2.550 10532.0 !25 c9h18o2-5+ho2=h2o2+c4h9chjc2h4coch3 1.080E+04 2.550 10532.0 !25 c9h18o2-5+ho2=h2o2+ch3chjc2h4coc4h9 1.080E+04 2.550 10532.0 !25 c9h18o2-6+ho2=h2o2+c3h7chjc3h6coch3 1.080E+04 2.550 10532.0 !25 c9h18o2-6+ho2=h2o2+ch3chjc3h6coc3h7 1.080E+04 2.550 10532.0 !25 c9h18o3-4+ho2=h2o2+c5h11chjcoc2h5 1.080E+04 2.550 10532.0 !25 c9h18o3-4+ho2=h2o2+c2h5chjcoc5h11 1.080E+04 2.550 10532.0 !25 c9h18o3-5+ho2=h2o2+c4h9chjch2coc2h5 1.080E+04 2.550 10532.0 !25 c9h18o3-5+ho2=h2o2+c2h5chjch2coc4h9 1.080E+04 2.550 10532.0 !25 c9h18o3-6+ho2=h2o2+c3h7chc2h4coc2h5 1.080E+04 2.550 10532.0 !25 c9h18o3-6+ho2=h2o2+c2h5chc2h4coc3h7 1.080E+04 2.550 10532.0 !25 c9h18o3-7+ho2=h2o2+c2h5chc3h6coc2h5 2.160E+04 2.550 10532.0 !25 c9h18o4-5+ho2=h2o2+c4h9chjcoc3h7 1.080E+04 2.550 10532.0 !25 c9h18o4-5+ho2=h2o2+c3h7chjcoc4h9 1.080E+04 2.550 10532.0 !25 c9h18o4-6+ho2=h2o2+c3h7chjch2coc3h7 2.160E+04 2.550 10532.0 !25 ! meom-2+ho2=h2o2+memoxo2j 6.000E+04 2.600 13910.0 !25 meom-2+ho2=h2o2+me2oxomj 6.000E+04 2.600 13910.0 !25 ! mpom-2+ho2=h2o2+mpmoxo2j 6.000E+04 2.600 13910.0 !25 mpom-2+ho2=h2o2+mp2oxomj 1.080E+04 2.550 10532.0 !25 mpom-3+ho2=h2o2+mpmoxo3j 6.000E+04 2.600 13910.0 !25 mpom-3+ho2=h2o2+mp3oxomj 6.000E+04 2.600 13910.0 !25 mpo2-3+ho2=h2o2+mp2oxo3j 1.080E+04 2.550 10532.0 !25 mpo2-3+ho2=h2o2+mp3oxo2j 6.000E+04 2.600 13910.0 !25 ! mbom-2+ho2=h2o2+mbmoxo2j 6.000E+04 2.600 13910.0 !25 mbom-2+ho2=h2o2+mb2oxomj 1.080E+04 2.550 10532.0 !25 mbom-3+ho2=h2o2+mbmoxo3j 6.000E+04 2.600 13910.0 !25 mbom-3+ho2=h2o2+mb3oxomj 1.080E+04 2.550 10532.0 !25 mbo2-3+ho2=h2o2+mb2oxo3j 1.080E+04 2.550 10532.0 !25 mbo2-3+ho2=h2o2+mb3oxo2j 1.080E+04 2.550 10532.0 !25 mbo2-4+ho2=h2o2+mb2oxo4j 1.080E+04 2.550 10532.0 !25 mbo2-4+ho2=h2o2+mb4oxo2j 6.000E+04 2.600 13910.0 !25 mbo3-4+ho2=h2o2+mb3oxo4j 1.080E+04 2.550 10532.0 !25 mbo3-4+ho2=h2o2+mb4oxo3j 6.000E+04 2.600 13910.0 !25 ! mfom-2+ho2=h2o2+mfmoxo2j 6.000E+04 2.600 13910.0 !25 mfom-2+ho2=h2o2+mf2oxomj 1.080E+04 2.550 10532.0 !25 mfom-3+ho2=h2o2+mfmoxo3j 6.000E+04 2.600 13910.0 !25 mfom-3+ho2=h2o2+mf3oxomj 1.080E+04 2.550 10532.0 !25 mfo2-3+ho2=h2o2+mf2oxo3j 1.080E+04 2.550 10532.0 !25 mfo2-3+ho2=h2o2+mf3oxo2j 1.080E+04 2.550 10532.0 !25 mfo2-4+ho2=h2o2+mf2oxo4j 1.080E+04 2.550 10532.0 !25 mfo2-4+ho2=h2o2+mf4oxo2j 1.080E+04 2.550 10532.0 !25 mfo2-5+ho2=h2o2+mf2oxo5j 1.080E+04 2.550 10532.0 !25 mfo2-5+ho2=h2o2+mf5oxo2j 6.000E+04 2.600 13910.0 !25 mfo3-4+ho2=h2o2+mf3oxo4j 1.080E+04 2.550 10532.0 !25 mfo3-4+ho2=h2o2+mf4oxo3j 1.080E+04 2.550 10532.0 !25 mfo3-5+ho2=h2o2+mf3oxo5j 1.080E+04 2.550 10532.0 !25 mfo3-5+ho2=h2o2+mf5oxo3j 6.000E+04 2.600 13910.0 !25 mfo4-5+ho2=h2o2+mf4oxo5j 1.080E+04 2.550 10532.0 !25 mfo4-5+ho2=h2o2+mf5oxo4j 6.000E+04 2.600 13910.0 !25 ! mhom-2+ho2=h2o2+mhmoxo2j 6.000E+04 2.600 13910.0 !25 mhom-2+ho2=h2o2+mh2oxomj 1.080E+04 2.550 10532.0 !25 mhom-3+ho2=h2o2+mhmoxo3j 6.000E+04 2.600 13910.0 !25 mhom-3+ho2=h2o2+mh3oxomj 1.080E+04 2.550 10532.0 !25 mho2-3+ho2=h2o2+mh2oxo3j 1.080E+04 2.550 10532.0 !25 mho2-3+ho2=h2o2+mh3oxo2j 1.080E+04 2.550 10532.0 !25 mho2-4+ho2=h2o2+mh2oxo4j 1.080E+04 2.550 10532.0 !25 mho2-4+ho2=h2o2+mh4oxo2j 1.080E+04 2.550 10532.0 !25 mho2-5+ho2=h2o2+mh2oxo5j 1.080E+04 2.550 10532.0 !25 mho2-5+ho2=h2o2+mh5oxo2j 1.080E+04 2.550 10532.0 !25 mho2-6+ho2=h2o2+mh2oxo6j 1.080E+04 2.550 10532.0 !25 mho2-6+ho2=h2o2+mh6oxo2j 6.000E+04 2.600 13910.0 !25 mho3-4+ho2=h2o2+mh3oxo4j 1.080E+04 2.550 10532.0 !25 mho3-4+ho2=h2o2+mh4oxo3j 1.080E+04 2.550 10532.0 !25 mho3-5+ho2=h2o2+mh3oxo5j 1.080E+04 2.550 10532.0 !25 mho3-5+ho2=h2o2+mh5oxo3j 1.080E+04 2.550 10532.0 !25 mho3-6+ho2=h2o2+mh3oxo6j 1.080E+04 2.550 10532.0 !25 mho3-6+ho2=h2o2+mh6oxo3j 6.000E+04 2.600 13910.0 !25 mho4-5+ho2=h2o2+mh4oxo5j 1.080E+04 2.550 10532.0 !25 mho4-5+ho2=h2o2+mh5oxo4j 1.080E+04 2.550 10532.0 !25 mho4-6+ho2=h2o2+mh4oxo6j 1.080E+04 2.550 10532.0 !25 mho4-6+ho2=h2o2+mh6oxo4j 6.000E+04 2.600 13910.0 !25 mho5-6+ho2=h2o2+mh5oxo6j 1.080E+04 2.550 10532.0 !25 mho5-6+ho2=h2o2+mh6oxo5j 6.000E+04 2.600 13910.0 !25 ! msom-2+ho2=h2o2+msmoxo2j 6.000E+04 2.600 13910.0 !25 msom-2+ho2=h2o2+ms2oxomj 1.080E+04 2.550 10532.0 !25 msom-3+ho2=h2o2+msmoxo3j 6.000E+04 2.600 13910.0 !25 msom-3+ho2=h2o2+ms3oxomj 1.080E+04 2.550 10532.0 !25 mso2-3+ho2=h2o2+ms2oxo3j 1.080E+04 2.550 10532.0 !25 mso2-3+ho2=h2o2+ms3oxo2j 1.080E+04 2.550 10532.0 !25 mso2-4+ho2=h2o2+ms2oxo4j 1.080E+04 2.550 10532.0 !25 mso2-4+ho2=h2o2+ms4oxo2j 1.080E+04 2.550 10532.0 !25 mso2-5+ho2=h2o2+ms2oxo5j 1.080E+04 2.550 10532.0 !25 mso2-5+ho2=h2o2+ms5oxo2j 1.080E+04 2.550 10532.0 !25 mso2-6+ho2=h2o2+ms2oxo6j 1.080E+04 2.550 10532.0 !25 mso2-6+ho2=h2o2+ms6oxo2j 1.080E+04 2.550 10532.0 !25 mso3-4+ho2=h2o2+ms3oxo4j 1.080E+04 2.550 10532.0 !25 mso3-4+ho2=h2o2+ms4oxo3j 1.080E+04 2.550 10532.0 !25 mso3-5+ho2=h2o2+ms3oxo5j 1.080E+04 2.550 10532.0 !25 mso3-5+ho2=h2o2+ms5oxo3j 1.080E+04 2.550 10532.0 !25 mso3-6+ho2=h2o2+ms3oxo6j 1.080E+04 2.550 10532.0 !25 mso3-6+ho2=h2o2+ms6oxo3j 1.080E+04 2.550 10532.0 !25 mso3-7+ho2=h2o2+ms3oxo7j 1.080E+04 2.550 10532.0 !25 mso3-7+ho2=h2o2+ms7oxo3j 6.000E+04 2.600 13910.0 !25 mso4-5+ho2=h2o2+ms4oxo5j 1.080E+04 2.550 10532.0 !25 mso4-5+ho2=h2o2+ms5oxo4j 1.080E+04 2.550 10532.0 !25 mso4-6+ho2=h2o2+ms4oxo6j 1.080E+04 2.550 10532.0 !25 mso4-6+ho2=h2o2+ms6oxo4j 1.080E+04 2.550 10532.0 !25 mso4-7+ho2=h2o2+ms4oxo7j 1.080E+04 2.550 10532.0 !25 mso4-7+ho2=h2o2+ms7oxo4j 6.000E+04 2.600 13910.0 !25 mso5-6+ho2=h2o2+ms5oxo6j 1.080E+04 2.550 10532.0 !25 mso5-6+ho2=h2o2+ms6oxo5j 1.080E+04 2.550 10532.0 !25 mso5-7+ho2=h2o2+ms5oxo7j 1.080E+04 2.550 10532.0 !25 mso5-7+ho2=h2o2+ms7oxo5j 6.000E+04 2.600 13910.0 !25 mso6-7+ho2=h2o2+ms6oxo7j 1.080E+04 2.550 10532.0 !25 mso6-7+ho2=h2o2+ms7oxo6j 6.000E+04 2.600 13910.0 !25 ! moom-2+ho2=h2o2+momoxo2j 6.000E+04 2.600 13910.0 !25 moom-2+ho2=h2o2+mo2oxomj 1.080E+04 2.550 10532.0 !25 moom-3+ho2=h2o2+momoxo3j 6.000E+04 2.600 13910.0 !25 moom-3+ho2=h2o2+mo3oxomj 1.080E+04 2.550 10532.0 !25 moo2-3+ho2=h2o2+mo2oxo3j 1.080E+04 2.550 10532.0 !25 moo2-3+ho2=h2o2+mo3oxo2j 1.080E+04 2.550 10532.0 !25 moo2-4+ho2=h2o2+mo2oxo4j 1.080E+04 2.550 10532.0 !25 moo2-4+ho2=h2o2+mo4oxo2j 1.080E+04 2.550 10532.0 !25 moo2-5+ho2=h2o2+mo2oxo5j 1.080E+04 2.550 10532.0 !25 moo2-5+ho2=h2o2+mo5oxo2j 1.080E+04 2.550 10532.0 !25 moo2-6+ho2=h2o2+mo2oxo6j 1.080E+04 2.550 10532.0 !25 moo2-6+ho2=h2o2+mo6oxo2j 1.080E+04 2.550 10532.0 !25 moo3-4+ho2=h2o2+mo3oxo4j 1.080E+04 2.550 10532.0 !25 moo3-4+ho2=h2o2+mo4oxo3j 1.080E+04 2.550 10532.0 !25 moo3-5+ho2=h2o2+mo3oxo5j 1.080E+04 2.550 10532.0 !25 moo3-5+ho2=h2o2+mo5oxo3j 1.080E+04 2.550 10532.0 !25 moo3-6+ho2=h2o2+mo3oxo6j 1.080E+04 2.550 10532.0 !25 moo3-6+ho2=h2o2+mo6oxo3j 1.080E+04 2.550 10532.0 !25 moo3-7+ho2=h2o2+mo3oxo7j 1.080E+04 2.550 10532.0 !25 moo3-7+ho2=h2o2+mo7oxo3j 1.080E+04 2.550 10532.0 !25 moo4-5+ho2=h2o2+mo4oxo5j 1.080E+04 2.550 10532.0 !25 moo4-5+ho2=h2o2+mo5oxo4j 1.080E+04 2.550 10532.0 !25 moo4-6+ho2=h2o2+mo4oxo6j 1.080E+04 2.550 10532.0 !25 moo4-6+ho2=h2o2+mo6oxo4j 1.080E+04 2.550 10532.0 !25 moo4-7+ho2=h2o2+mo4oxo7j 1.080E+04 2.550 10532.0 !25 moo4-7+ho2=h2o2+mo7oxo4j 1.080E+04 2.550 10532.0 !25 moo4-8+ho2=h2o2+mo4oxo8j 1.080E+04 2.550 10532.0 !25 moo4-8+ho2=h2o2+mo8oxo4j 6.000E+04 2.600 13910.0 !25 moo5-6+ho2=h2o2+mo5oxo6j 1.080E+04 2.550 10532.0 !25 moo5-6+ho2=h2o2+mo6oxo5j 1.080E+04 2.550 10532.0 !25 moo5-7+ho2=h2o2+mo5oxo7j 1.080E+04 2.550 10532.0 !25 moo5-7+ho2=h2o2+mo7oxo5j 1.080E+04 2.550 10532.0 !25 moo5-8+ho2=h2o2+mo5oxo8j 1.080E+04 2.550 10532.0 !25 moo5-8+ho2=h2o2+mo8oxo5j 6.000E+04 2.600 13910.0 !25 moo6-7+ho2=h2o2+mo6oxo7j 1.080E+04 2.550 10532.0 !25 moo6-7+ho2=h2o2+mo7oxo6j 1.080E+04 2.550 10532.0 !25 moo6-8+ho2=h2o2+mo6oxo8j 1.080E+04 2.550 10532.0 !25 moo6-8+ho2=h2o2+mo8oxo6j 6.000E+04 2.600 13910.0 !25 moo7-8+ho2=h2o2+mo7oxo8j 1.080E+04 2.550 10532.0 !25 moo7-8+ho2=h2o2+mo8oxo7j 6.000E+04 2.600 13910.0 !25 ! mnom-2+ho2=h2o2+mnmoxo2j 6.000E+04 2.600 13910.0 !25 mnom-2+ho2=h2o2+mn2oxomj 1.080E+04 2.550 10532.0 !25 mnom-3+ho2=h2o2+mnmoxo3j 6.000E+04 2.600 13910.0 !25 mnom-3+ho2=h2o2+mn3oxomj 1.080E+04 2.550 10532.0 !25 mno2-3+ho2=h2o2+mn2oxo3j 1.080E+04 2.550 10532.0 !25 mno2-3+ho2=h2o2+mn3oxo2j 1.080E+04 2.550 10532.0 !25 mno2-4+ho2=h2o2+mn2oxo4j 1.080E+04 2.550 10532.0 !25 mno2-4+ho2=h2o2+mn4oxo2j 1.080E+04 2.550 10532.0 !25 mno2-5+ho2=h2o2+mn2oxo5j 1.080E+04 2.550 10532.0 !25 mno2-5+ho2=h2o2+mn5oxo2j 1.080E+04 2.550 10532.0 !25 mno2-6+ho2=h2o2+mn2oxo6j 1.080E+04 2.550 10532.0 !25 mno2-6+ho2=h2o2+mn6oxo2j 1.080E+04 2.550 10532.0 !25 mno3-4+ho2=h2o2+mn3oxo4j 1.080E+04 2.550 10532.0 !25 mno3-4+ho2=h2o2+mn4oxo3j 1.080E+04 2.550 10532.0 !25 mno3-5+ho2=h2o2+mn3oxo5j 1.080E+04 2.550 10532.0 !25 mno3-5+ho2=h2o2+mn5oxo3j 1.080E+04 2.550 10532.0 !25 mno3-6+ho2=h2o2+mn3oxo6j 1.080E+04 2.550 10532.0 !25 mno3-6+ho2=h2o2+mn6oxo3j 1.080E+04 2.550 10532.0 !25 mno3-7+ho2=h2o2+mn3oxo7j 1.080E+04 2.550 10532.0 !25 mno3-7+ho2=h2o2+mn7oxo3j 1.080E+04 2.550 10532.0 !25 mno4-5+ho2=h2o2+mn4oxo5j 1.080E+04 2.550 10532.0 !25 mno4-5+ho2=h2o2+mn5oxo4j 1.080E+04 2.550 10532.0 !25 mno4-6+ho2=h2o2+mn4oxo6j 1.080E+04 2.550 10532.0 !25 mno4-6+ho2=h2o2+mn6oxo4j 1.080E+04 2.550 10532.0 !25 mno4-7+ho2=h2o2+mn4oxo7j 1.080E+04 2.550 10532.0 !25 mno4-7+ho2=h2o2+mn7oxo4j 1.080E+04 2.550 10532.0 !25 mno4-8+ho2=h2o2+mn4oxo8j 1.080E+04 2.550 10532.0 !25 mno4-8+ho2=h2o2+mn8oxo4j 1.080E+04 2.550 10532.0 !25 mno5-6+ho2=h2o2+mn5oxo6j 1.080E+04 2.550 10532.0 !25 mno5-6+ho2=h2o2+mn6oxo5j 1.080E+04 2.550 10532.0 !25 mno5-7+ho2=h2o2+mn5oxo7j 1.080E+04 2.550 10532.0 !25 mno5-7+ho2=h2o2+mn7oxo5j 1.080E+04 2.550 10532.0 !25 mno5-8+ho2=h2o2+mn5oxo8j 1.080E+04 2.550 10532.0 !25 mno5-8+ho2=h2o2+mn8oxo5j 1.080E+04 2.550 10532.0 !25 mno5-9+ho2=h2o2+mn5oxo9j 1.080E+04 2.550 10532.0 !25 mno5-9+ho2=h2o2+mn9oxo5j 6.000E+04 2.600 13910.0 !25 mno6-7+ho2=h2o2+mn6oxo7j 1.080E+04 2.550 10532.0 !25 mno6-7+ho2=h2o2+mn7oxo6j 1.080E+04 2.550 10532.0 !25 mno6-8+ho2=h2o2+mn6oxo8j 1.080E+04 2.550 10532.0 !25 mno6-8+ho2=h2o2+mn8oxo6j 1.080E+04 2.550 10532.0 !25 mno6-9+ho2=h2o2+mn6oxo9j 1.080E+04 2.550 10532.0 !25 mno6-9+ho2=h2o2+mn9oxo6j 6.000E+04 2.600 13910.0 !25 mno7-8+ho2=h2o2+mn7oxo8j 1.080E+04 2.550 10532.0 !25 mno7-8+ho2=h2o2+mn8oxo7j 1.080E+04 2.550 10532.0 !25 mno7-9+ho2=h2o2+mn7oxo9j 1.080E+04 2.550 10532.0 !25 mno7-9+ho2=h2o2+mn9oxo7j 6.000E+04 2.600 13910.0 !25 mno8-9+ho2=h2o2+mn8oxo9j 1.080E+04 2.550 10532.0 !25 mno8-9+ho2=h2o2+mn9oxo8j 6.000E+04 2.600 13910.0 !25 ! mdom-2+ho2=h2o2+mdmoxo2j 6.000E+04 2.600 13910.0 !25 mdom-2+ho2=h2o2+md2oxomj 1.080E+04 2.550 10532.0 !25 mdom-3+ho2=h2o2+mdmoxo3j 6.000E+04 2.600 13910.0 !25 mdom-3+ho2=h2o2+md3oxomj 1.080E+04 2.550 10532.0 !25 mdo2-3+ho2=h2o2+md2oxo3j 1.080E+04 2.550 10532.0 !25 mdo2-3+ho2=h2o2+md3oxo2j 1.080E+04 2.550 10532.0 !25 mdo2-4+ho2=h2o2+md2oxo4j 1.080E+04 2.550 10532.0 !25 mdo2-4+ho2=h2o2+md4oxo2j 1.080E+04 2.550 10532.0 !25 mdo2-5+ho2=h2o2+md2oxo5j 1.080E+04 2.550 10532.0 !25 mdo2-5+ho2=h2o2+md5oxo2j 1.080E+04 2.550 10532.0 !25 mdo2-6+ho2=h2o2+md2oxo6j 1.080E+04 2.550 10532.0 !25 mdo2-6+ho2=h2o2+md6oxo2j 1.080E+04 2.550 10532.0 !25 mdo3-4+ho2=h2o2+md3oxo4j 1.080E+04 2.550 10532.0 !25 mdo3-4+ho2=h2o2+md4oxo3j 1.080E+04 2.550 10532.0 !25 mdo3-5+ho2=h2o2+md3oxo5j 1.080E+04 2.550 10532.0 !25 mdo3-5+ho2=h2o2+md5oxo3j 1.080E+04 2.550 10532.0 !25 mdo3-6+ho2=h2o2+md3oxo6j 1.080E+04 2.550 10532.0 !25 mdo3-6+ho2=h2o2+md6oxo3j 1.080E+04 2.550 10532.0 !25 mdo3-7+ho2=h2o2+md3oxo7j 1.080E+04 2.550 10532.0 !25 mdo3-7+ho2=h2o2+md7oxo3j 1.080E+04 2.550 10532.0 !25 mdo4-5+ho2=h2o2+md4oxo5j 1.080E+04 2.550 10532.0 !25 mdo4-5+ho2=h2o2+md5oxo4j 1.080E+04 2.550 10532.0 !25 mdo4-6+ho2=h2o2+md4oxo6j 1.080E+04 2.550 10532.0 !25 mdo4-6+ho2=h2o2+md6oxo4j 1.080E+04 2.550 10532.0 !25 mdo4-7+ho2=h2o2+md4oxo7j 1.080E+04 2.550 10532.0 !25 mdo4-7+ho2=h2o2+md7oxo4j 1.080E+04 2.550 10532.0 !25 mdo4-8+ho2=h2o2+md4oxo8j 1.080E+04 2.550 10532.0 !25 mdo4-8+ho2=h2o2+md8oxo4j 1.080E+04 2.550 10532.0 !25 mdo5-6+ho2=h2o2+md5oxo6j 1.080E+04 2.550 10532.0 !25 mdo5-6+ho2=h2o2+md6oxo5j 1.080E+04 2.550 10532.0 !25 mdo5-7+ho2=h2o2+md5oxo7j 1.080E+04 2.550 10532.0 !25 mdo5-7+ho2=h2o2+md7oxo5j 1.080E+04 2.550 10532.0 !25 mdo5-8+ho2=h2o2+md5oxo8j 1.080E+04 2.550 10532.0 !25 mdo5-8+ho2=h2o2+md8oxo5j 1.080E+04 2.550 10532.0 !25 mdo5-9+ho2=h2o2+md5oxo9j 1.080E+04 2.550 10532.0 !25 mdo5-9+ho2=h2o2+md9oxo5j 1.080E+04 2.550 10532.0 !25 mdo6-7+ho2=h2o2+md6oxo7j 1.080E+04 2.550 10532.0 !25 mdo6-7+ho2=h2o2+md7oxo6j 1.080E+04 2.550 10532.0 !25 mdo6-8+ho2=h2o2+md6oxo8j 1.080E+04 2.550 10532.0 !25 mdo6-8+ho2=h2o2+md8oxo6j 1.080E+04 2.550 10532.0 !25 mdo6-9+ho2=h2o2+md6oxo9j 1.080E+04 2.550 10532.0 !25 mdo6-9+ho2=h2o2+md9oxo6j 1.080E+04 2.550 10532.0 !25 mdo6-10+ho2=h2o2+md6oxo10j 1.080E+04 2.550 10532.0 !25 mdo6-10+ho2=h2o2+md10oxo6j 6.000E+04 2.600 13910.0 !25 mdo7-8+ho2=h2o2+md7oxo8j 1.080E+04 2.550 10532.0 !25 mdo7-8+ho2=h2o2+md8oxo7j 1.080E+04 2.550 10532.0 !25 mdo7-9+ho2=h2o2+md7oxo9j 1.080E+04 2.550 10532.0 !25 mdo7-9+ho2=h2o2+md9oxo7j 1.080E+04 2.550 10532.0 !25 mdo7-10+ho2=h2o2+md7oxo10j 1.080E+04 2.550 10532.0 !25 mdo7-10+ho2=h2o2+md10oxo7j 6.000E+04 2.600 13910.0 !25 mdo8-9+ho2=h2o2+md8oxo9j 1.080E+04 2.550 10532.0 !25 mdo8-9+ho2=h2o2+md9oxo8j 1.080E+04 2.550 10532.0 !25 mdo8-10+ho2=h2o2+md8oxo10j 1.080E+04 2.550 10532.0 !25 mdo8-10+ho2=h2o2+md10oxo8j 6.000E+04 2.600 13910.0 !25 mdo9-10+ho2=h2o2+md9oxo10j 1.080E+04 2.550 10532.0 !25 mdo9-10+ho2=h2o2+md10oxo9j 6.000E+04 2.600 13910.0 !25 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 25b/decomposition of mdxoxoyj radicals ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! ! c8h17chco+ocho=mdmoxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mpmoxo2d+c7h15-1=mdmoxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c9h18-1+choco2j=mdmoxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mbmoxo3d+c6h13-1=mdmoxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ! ch2o+c8h17coco=md2oxomj 2.000E+11 0.000 20090.0 !25b "henry et all., 2003" adition of ch3 to o of ch2o mb2oxo3d+c6h13-1=md2oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c7h15chco+ch3oco=md2oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mf2oxo4d+c5h11-1=md2oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c8h16-1+me2oxo2j=md2oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh2oxo5d+pc4h9=md2oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c7h14-1+mp2oxo3j=md2oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ms2oxo6d+nc3h7=md2oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c6h12-1+mb2oxo4j=md2oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ! ch2o+c7h15coch2co=md3oxomj 2.000E+11 0.000 20090.0 !25b "henry et all., 2003" adition of ch3 to o of ch2o mp3oxo2d+c7h15-1=md3oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c7h15cochco+ch3o=md3oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mf3oxo4d+c5h11-1=md3oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c6h13chco+me2j=md3oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh3oxo5d+pc4h9=md3oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c7h14-1+mp3oxo3j=md3oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ms3oxo6d+nc3h7=md3oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c6h12-1+mb3oxo4j=md3oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mo3oxo7d+c2h5=md3oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h10-1+mf3oxo5j=md3oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ! c6h13coch2chco+ch3o=md4oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp2d+c6h13co=md4oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mb4oxo3d+c6h13-1=md4oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc6h13+ch3oco=md4oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism c5h11chco+mp3j=md4oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh4oxo5d+pc4h9=md4oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c6h12-1+mb4oxo4j=md4oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ms4oxo6d+nc3h7=md4oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h10-1+mf4oxo5j=md4oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mo4oxo7d+c2h5=md4oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h8-1+mh4oxo6j=md4oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mn4oxo8d+ch3=md4oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ! c5h11coc2h4chco+ch3o=md5oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp2d+c5h11coch2=md5oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coc5h11+ch3oco=md5oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb3d+c5h11co=md5oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf5oxo4d+c5h11-1=md5oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc5h11+me2j=md5oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ms5oxo6d+nc3h7=md5oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h9chco+mb4j=md5oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mo5oxo7d+c2h5=md5oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h10-1+mf5oxo5j=md5oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mn5oxo8d+ch3=md5oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h8-1+mh5oxo6j=md5oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h6+ms5oxo7j=md5oxo9j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ! c4h9coc3h6chco+ch3o=md6oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp2d+c4h9coc2h4=md6oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7coc4h9+ch3oco=md6oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb3d+c4h9coch2=md6oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coc4h9+me2j=md6oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf4d+c4h9co=md6oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh6oxo5d+pc4h9=md6oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc4h9+mp3j=md6oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mo6oxo7d+c2h5=md6oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h7chco+mf5j=md6oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mn6oxo8d+ch3=md6oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h8-1+mh6oxo6j=md6oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h6+ms6oxo7j=md6oxo9j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h4+mo6oxo8j=md6oxo10j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ! mb3d+c3h7coc2h4=md7oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h9coc3h7+ch3oco=md7oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf4d+c3h7coch2=md7oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7coc3h7+me2j=md7oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh5d+c3h7co=md7oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coc3h7+mp3j=md7oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ms7oxo6d+nc3h7=md7oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc3h7+mb4j=md7oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mn7oxo8d+ch3=md7oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h5chco+mh6j=md7oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h6+ms7oxo7j=md7oxo9j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h4+mo7oxo8j=md7oxo10j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ! mf4d+c2h5coc2h4=md8oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h9coc2h5+me2j=md8oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh5d+c2h5coch2=md8oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7coc2h5+mp3j=md8oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ms6d+c2h5co=md8oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coc2h5+mb4j=md8oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mo8oxo7d+c2h5=md8oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc2h5+mf5j=md8oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch3chco+ms7j=md8oxo9j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h4+mo8oxo8j=md8oxo10j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ! mh5d+c2h4coch3=md9oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h9coch3+mp3j=md9oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ms6d+ch3coch2=md9oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7coch3+mb4j=md9oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mo7d+ch3co=md9oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coch3+mf5j=md9oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mn9oxo8d+ch3=md9oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coch3+mh6j=md9oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2co+mo8j=md9oxo10j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ! ms6d+c2h4cho=md10oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h9cho+mb4j=md10oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mo7d+ch2cho=md10oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7cho+mf5j=md10oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mn8d+hco=md10oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5cho+mh6j=md10oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3cho+ms7j=md10oxo9j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ! c2h3cho+ch3=c2h5chjcho 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C ch2co+c2h5=c2h5coch2 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h6+hco=ch3chjch2cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h4+ch3co=c2h4coch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h4+ch2cho=c3h6cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch3chco+ch3=ch3chjcoch3 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c2h3cho+c2h5=c3h7chjcho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2co+nc3h7=c3h7coch2 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h8-1+hco=c2h5chjch2cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5cho+ch3=c2h5chjch2cho 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c2h4+c2h5co=c2h5coc2h4 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h6+ch2cho=ch3chjc2h4cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h4+ch3coch2=ch3coc3h6 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h4+c2h4cho=c4h8cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coch3+ch3=c2h5chjcoch3 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c2h5chco+ch3=c2h5chjcoch3 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c3h6+ch3co=ch3chjch2coch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3cho+nc3h7=c4h9chjcho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2co+pc4h9=c4h9coch2 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h10-1+hco=c3h7chjch2cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5cho+c2h5=c3h7chjch2cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h4+c3h7co=c3h7coc2h4 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc2h5+ch3=c2h5chjc2h4cho 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c2h5chco+c2h5=c2h5chjc2h4cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h4+c2h5coch2=c2h5coc3h6 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h6+c2h4cho=ch3chjc3h6cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h4+c2h4coch3=ch3coc4h8 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coch3+c2h5=c3h7chjcoch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h7chco+ch3=c3h7chjcoch3 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C ch3chco+nc3h7=ch3chjcoc3h7 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coch3+ch3=c2h5chjch2coch3 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c4h8-1+ch3co=c2h5chjch2coch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h6+c2h5co=ch3chjch2coc2h5 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h6+ch3coch2=ch3chjc2h4coch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h5chco+c2h5=c2h5chjcoc2h5 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc2h5+ch3=c2h5chjcoc2h5 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C !c2h3cho+pc4h9=c5h11chjcho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !ch2co+c5h11-1=c5h11coch2 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !c6h12-1+hco=c4h9chjch2cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !c3h5cho+nc3h7=c4h9chjch2cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !c2h4+c4h9co=c4h9coc2h4 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !c4h7cho+c2h5=c3h7chjc2h4cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !c5h10-1+ch2cho=c3h7chjc2h4cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !c2h4+c3h7coch2=c3h7coc3h6 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !c5h9cho+ch3=c2h5chjc3h6cho 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C !c4h8-1+c2h4cho=c2h5chjc3h6cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !c2h4+c2h5coc2h4=c2h5coc4h8 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !c4h9chco+ch3=c4h9chjcoch3 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C !c2h3coch3+nc3h7=c4h9chjcoch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !ch3chco+pc4h9=ch3chjcoc4h9 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !c3h5coch3+c2h5=c3h7chjch2coch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !c5h10-1+ch3co=c3h7chjch2coch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !c3h6+c3h7co=ch3chjch2coc3h7 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !c4h7coch3+ch3=c2h5chjc2h4coch3 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C !c4h8-1+ch3coch2=c2h5chjc2h4coch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !c3h6+c2h5coch2=ch3chjc2h4coc2h5 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !c3h6+c2h4coch3=ch3chjc3h6coch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !c2h3coc2h5+c2h5=c3h7chjcoc2h5 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !c3h7chco+c2h5=c3h7chjcoc2h5 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !c2h3coc3h7+ch3=c2h5chjcoc3h7 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C !c2h5chco+nc3h7=c2h5chjcoc3h7 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !c3h5coc2h5+ch3=c2h5chjch2coc2h5 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C !c4h8-1+c2h5co=c2h5chjch2coc2h5 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3cho+c5h11-1=c6h13chjcho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2co+c6h13-1=c6h13coch2 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c7h14-1+hco=c5h11chjch2cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5cho+pc4h9=c5h11chjch2cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h11chco+ch3=c5h11chjcoch3 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c2h3coch3+pc4h9=c5h11chjcoch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h4+c5h11co=c5h11coc2h4 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7cho+nc3h7=c4h9chjc2h4cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c6h12-1+ch2cho=c4h9chjc2h4cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coch3+nc3h7=c4h9chjch2coch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c6h12-1+ch3co=c4h9chjch2coch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc2h5+nc3h7=c4h9chjcoc2h5 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h9chco+c2h5=c4h9chjcoc2h5 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h4+c4h9coch2=c4h9coc3h6 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h9cho+c2h5=c3h7chjc3h6cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h10-1+c2h4cho=c3h7chjc3h6cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7coch3+c2h5=c3h7chjc2h4coch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h10-1+ch3coch2=c3h7chjc2h4coch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coc2h5+c2h5=c3h7chjch2coc2h5 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h10-1+c2h5co=c3h7chjch2coc2h5 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc3h7+c2h5=c3h7chjcoc3h7 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h7chco+nc3h7=c3h7chjcoc3h7 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h4+c3h7coc2h4=c3h7coc4h8 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc4h9+ch3=c2h5chjcoc4h9 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h5chco+pc4h9=c2h5chjcoc4h9 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h9coch3+ch3=c2h5chjc3h6coch3 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c4h8-1+c2h4coch3=c2h5chjc3h6coch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7coc2h5+ch3=c2h5chc2h4coc2h5 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c4h8-1+c2h5coch2=c2h5chc2h4coc2h5 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coc3h7+ch3=c2h5chjch2coc3h7 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c4h8-1+c3h7co=c2h5chjch2coc3h7 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch3chco+c5h11-1=ch3chjcoc5h11 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h6+c4h9co=ch3chjch2coc4h9 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h6+c3h7coch2=ch3chjc2h4coc3h7 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h6+c2h5coc2h4=ch3chjc3h6coc2h5 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ! c2h3cho+c6h13-1=c7h15chjcho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2co+c7h15-1=c7h15coch2 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c8h16-1+hco=c6h13chjch2cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5cho+c5h11-1=c6h13chjch2cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coch3+c5h11-1=c6h13chjcoch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c6h13chco+ch3=c6h13chjcoch3 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c2h4+c6h13co=c6h13coc2h4 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7cho+pc4h9=c5h11chjc2h4cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c7h14-1+ch2cho=c5h11chjc2h4cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coch3+pc4h9=c5h11chjch2coch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c7h14-1+ch3co=c5h11chjch2coch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc2h5+pc4h9=c5h11chjcoc2h5 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h11chco+c2h5=c5h11chjcoc2h5 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h4+c5h11coch2=c5h11coc3h6 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h9cho+nc3h7=c4h9chjc3h6cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c6h12-1+c2h4cho=c4h9chjc3h6cho 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7coch3+nc3h7=c4h9chjc2h4coch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c6h12-1+ch3coch2=c4h9chjc2h4coch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coc2h5+nc3h7=c4h9chjch2coc2h5 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c6h12-1+c2h5co=c4h9chjch2coc2h5 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc3h7+nc3h7=c4h9chjcoc3h7 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h9chco+nc3h7=c4h9chjcoc3h7 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h4+c4h9coc2h4=c4h9coc4h8 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h9coch3+c2h5=c3h7chjc3h6coch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h10-1+c2h4coch3=c3h7chjc3h6coch3 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7coc2h5+c2h5=c3h7chc2h4coc2h5 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h10-1+c2h5coch2=c3h7chc2h4coc2h5 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coc3h7+c2h5=c3h7chjch2coc3h7 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h10-1+c3h7co=c3h7chjch2coc3h7 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc4h9+c2h5=c3h7chjcoc4h9 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h7chco+pc4h9=c3h7chjcoc4h9 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h9coc2h5+ch3=c2h5chc3h6coc2h5 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c4h8-1+c2h5coc2h4=c2h5chc3h6coc2h5 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7coc3h7+ch3=c2h5chc2h4coc3h7 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c4h8-1+c3h7coch2=c2h5chc2h4coc3h7 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coc4h9+ch3=c2h5chjch2coc4h9 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c4h8-1+c4h9co=c2h5chjch2coc4h9 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc5h11+ch3=c2h5chjcoc5h11 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c2h5chco+c5h11-1=c2h5chjcoc5h11 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h6+c3h7coc2h4=ch3chjc3h6coc3h7 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h6+c4h9coch2=ch3chjc2h4coc4h9 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h6+c5h11co=ch3chjch2coc5h11 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch3chco+c6h13-1=ch3chjcoc6h13 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ! ! ! ! !~ch2co+ocho=memoxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism ch2o+hcoco=me2oxomj 2.000E+11 0.000 20090.0 !25b henry et all., 2003 adition of ch3 to o of ch2o ! ch3chco+ocho=mpmoxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism c2h4+choco2j=mpmoxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism ch2o+ch3coco=mp2oxomj 2.000E+11 0.000 20090.0 !25b henry et all., 2003 adition of ch3 to o of ch2o !~ch2co+ch3oco=mp2oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism ch2o+choch2co=mp3oxomj 2.000E+11 0.000 20090.0 !25b henry et all., 2003 adition of ch3 to o of ch2o chochco+ch3o=mp3oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism ! c2h5chco+ocho=mbmoxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mpmoxo2d+ch3=mbmoxo2j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c3h6+choco2j=mbmoxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism ch2o+c2h5coco=mb2oxomj 2.000E+11 0.000 20090.0 !25b henry et all., 2003 adition of ch3 to o of ch2o ch3chco+ch3oco=mb2oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism !~c2h4+me2oxo2j=mb2oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2o+ch3coch2co=mb3oxomj 2.000E+11 0.000 20090.0 !25b henry et all., 2003 adition of ch3 to o of ch2o ch3cochco+ch3o=mb3oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp3oxo2d+ch3=mb3oxo2j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C !~ch2co+me2j=mb3oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C choch2chco+ch3o=mb4oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp2d+hco=mb4oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3cho+ch3oco=mb4oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism ! c3h7chco+ocho=mfmoxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mpmoxo2d+c2h5=mfmoxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h8-1+choco2j=mfmoxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mbmoxo3d+ch3=mfmoxo3j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C ch2o+c3h7coco=mf2oxomj 2.000E+11 0.000 20090.0 !25b henry et all., 2003 adition of ch3 to o of ch2o c2h5chco+ch3oco=mf2oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb2oxo3d+ch3=mf2oxo3j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c3h6+me2oxo2j=mf2oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !~c2h4+mp2oxo3j=mf2oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2o+c2h5coch2co=mf3oxomj 2.000E+11 0.000 20090.0 !25b henry et all., 2003 adition of ch3 to o of ch2o c2h5cochco+ch3o=mf3oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp3oxo2d+c2h5=mf3oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch3chco+me2j=mf3oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !~c2h4+mp3oxo3j=mf3oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch3coch2chco+ch3o=mf4oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp2d+ch3co=mf4oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coch3+ch3oco=mf4oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb4oxo3d+ch3=mf4oxo3j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C !~ch2co+mp3j=mf4oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C choc2h4chco+ch3o=mf5oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp2d+ch2cho=mf5oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5cho+ch3oco=mf5oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb3d+hco=mf5oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3cho+me2j=mf5oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ! c4h9chco+ocho=mhmoxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mpmoxo2d+nc3h7=mhmoxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h10-1+choco2j=mhmoxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mbmoxo3d+c2h5=mhmoxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2o+c4h9coco=mh2oxomj 2.000E+11 0.000 20090.0 !25b henry et all., 2003 adition of ch3 to o of ch2o c3h7chco+ch3oco=mh2oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb2oxo3d+c2h5=mh2oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h8-1+me2oxo2j=mh2oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf2oxo4d+ch3=mh2oxo4j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c3h6+mp2oxo3j=mh2oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !~c2h4+mb2oxo4j=mh2oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2o+c3h7coch2co=mh3oxomj 2.000E+11 0.000 20090.0 !25b henry et all., 2003 adition of ch3 to o of ch2o c3h7cochco+ch3o=mh3oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp3oxo2d+nc3h7=mh3oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h5chco+me2j=mh3oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf3oxo4d+ch3=mh3oxo4j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c3h6+mp3oxo3j=mh3oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !~c2h4+mb3oxo4j=mh3oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h5coch2chco+ch3o=mh4oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp2d+c2h5co=mh4oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc2h5+ch3oco=mh4oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb4oxo3d+c2h5=mh4oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch3chco+mp3j=mh4oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !~c2h4+mb4oxo4j=mh4oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch3coc2h4chco+ch3o=mh5oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp2d+ch3coch2=mh5oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coch3+ch3oco=mh5oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb3d+ch3co=mh5oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coch3+me2j=mh5oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf5oxo4d+ch3=mh5oxo4j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C !~ch2co+mb4j=mh5oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C choc3h6chco+ch3o=mh6oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp2d+c2h4cho=mh6oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7cho+ch3oco=mh6oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb3d+ch2cho=mh6oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5cho+me2j=mh6oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf4d+hco=mh6oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3cho+mp3j=mh6oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ! c5h11chco+ocho=msmoxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mpmoxo2d+pc4h9=msmoxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c6h12-1+choco2j=msmoxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mbmoxo3d+nc3h7=msmoxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2o+c5h11coco=ms2oxomj 2.000E+11 0.000 20090.0 !25b henry et all., 2003 adition of ch3 to o of ch2o c4h9chco+ch3oco=ms2oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb2oxo3d+nc3h7=ms2oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf2oxo4d+c2h5=ms2oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h10-1+me2oxo2j=ms2oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh2oxo5d+ch3=ms2oxo5j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c4h8-1+mp2oxo3j=ms2oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h6+mb2oxo4j=ms2oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2o+c4h9coch2co=ms3oxomj 2.000E+11 0.000 20090.0 !25b henry et all., 2003 adition of ch3 to o of ch2o c4h9cochco+ch3o=ms3oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp3oxo2d+pc4h9=ms3oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf3oxo4d+c2h5=ms3oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h7chco+me2j=ms3oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh3oxo5d+ch3=ms3oxo5j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c4h8-1+mp3oxo3j=ms3oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h6+mb3oxo4j=ms3oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !~c2h4+mf3oxo5j=ms3oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h7coch2chco+ch3o=ms4oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp2d+c3h7co=ms4oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc3h7+ch3oco=ms4oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mb4oxo3d+nc3h7=ms4oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh4oxo5d+ch3=ms4oxo5j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c2h5chco+mp3j=ms4oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h6+mb4oxo4j=ms4oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !~c2h4+mf4oxo5j=ms4oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h5coc2h4chco+ch3o=ms5oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp2d+c2h5coch2=ms5oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coc2h5+ch3oco=ms5oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb3d+c2h5co=ms5oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc2h5+me2j=ms5oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf5oxo4d+c2h5=ms5oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch3chco+mb4j=ms5oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !~c2h4+mf5oxo5j=ms5oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch3coc3h6chco+ch3o=ms6oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp2d+c2h4coch3=ms6oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7coch3+ch3oco=ms6oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb3d+ch3coch2=ms6oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coch3+me2j=ms6oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf4d+ch3co=ms6oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coch3+mp3j=ms6oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh6oxo5d+ch3=ms6oxo5j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C !~ch2co+mf5j=ms6oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h9cho+ch3oco=ms7oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb3d+c2h4cho=ms7oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7cho+me2j=ms7oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf4d+ch2cho=ms7oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5cho+mp3j=ms7oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh5d+hco=ms7oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3cho+mb4j=ms7oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ! c6h13chco+ocho=momoxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mpmoxo2d+c5h11-1=momoxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c7h14-1+choco2j=momoxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mbmoxo3d+pc4h9=momoxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2o+c6h13coco=mo2oxomj 2.000E+11 0.000 20090.0 !25b henry et all., 2003 adition of ch3 to o of ch2o c5h11chco+ch3oco=mo2oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb2oxo3d+pc4h9=mo2oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c6h12-1+me2oxo2j=mo2oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf2oxo4d+nc3h7=mo2oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h10-1+mp2oxo3j=mo2oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh2oxo5d+c2h5=mo2oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h8-1+mb2oxo4j=mo2oxo6j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C ms2oxo6d+ch3=mo2oxo6j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C ch2o+c5h11coch2co=mo3oxomj 2.000E+11 0.000 20090.0 !25b henry et all., 2003 adition of ch3 to o of ch2o c5h11cochco+ch3o=mo3oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp3oxo2d+c5h11-1=mo3oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h9chco+me2j=mo3oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf3oxo4d+nc3h7=mo3oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h10-1+mp3oxo3j=mo3oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh3oxo5d+c2h5=mo3oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h8-1+mb3oxo4j=mo3oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ms3oxo6d+ch3=mo3oxo6j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c3h6+mf3oxo5j=mo3oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h9coch2chco+ch3o=mo4oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp2d+c4h9co=mo4oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc4h9+ch3oco=mo4oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb4oxo3d+pc4h9=mo4oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h7chco+mp3j=mo4oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh4oxo5d+c2h5=mo4oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h8-1+mb4oxo4j=mo4oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ms4oxo6d+ch3=mo4oxo6j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c3h6+mf4oxo5j=mo4oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !~c2h4+mh4oxo6j=mo4oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h7coc2h4chco+ch3o=mo5oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp2d+c3h7coch2=mo5oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coc3h7+ch3oco=mo5oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb3d+c3h7co=mo5oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc3h7+me2j=mo5oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf5oxo4d+nc3h7=mo5oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h5chco+mb4j=mo5oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ms5oxo6d+ch3=mo5oxo6j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c3h6+mf5oxo5j=mo5oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !~c2h4+mh5oxo6j=mo5oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h5coc3h6chco+ch3o=mo6oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp2d+c2h5coc2h4=mo6oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7coc2h5+ch3oco=mo6oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb3d+c2h5coch2=mo6oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coc2h5+me2j=mo6oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf4d+c2h5co=mo6oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc2h5+mp3j=mo6oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh6oxo5d+c2h5=mo6oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch3chco+mf5j=mo6oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !~c2h4+mh6oxo6j=mo6oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h9coch3+ch3oco=mo7oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb3d+c2h4coch3=mo7oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7coch3+me2j=mo7oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf4d+ch3coch2=mo7oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coch3+mp3j=mo7oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh5d+ch3co=mo7oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coch3+mb4j=mo7oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ms7oxo6d+ch3=mo7oxo6j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C !~mh6j+ch2co=mo7oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h9cho+me2j=mo8oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf4d+c2h4cho=mo8oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7cho+mp3j=mo8oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh5d+ch2cho=mo8oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5cho+mb4j=mo8oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ms6d+hco=mo8oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3cho+mf5j=mo8oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ! c7h15chco+ocho=mnmoxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mpmoxo2d+c6h13-1=mnmoxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c8h16-1+choco2j=mnmoxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mbmoxo3d+c5h11-1=mnmoxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2o+c7h15coco=mn2oxomj 2.000E+11 0.000 20090.0 !25b henry et all., 2003 adition of ch3 to o of ch2o c6h13chco+ch3oco=mn2oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb2oxo3d+c5h11-1=mn2oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c7h14-1+me2oxo2j=mn2oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf2oxo4d+pc4h9=mn2oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c6h12-1+mp2oxo3j=mn2oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh2oxo5d+nc3h7=mn2oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h10-1+mb2oxo4j=mn2oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ms2oxo6d+c2h5=mn2oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2o+c6h13coch2co=mn3oxomj 2.000E+11 0.000 20090.0 !25b henry et all., 2003 adition of ch3 to o of ch2o c6h13cochco+ch3o=mn3oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp3oxo2d+c6h13-1=mn3oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h11chco+me2j=mn3oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf3oxo4d+pc4h9=mn3oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c6h12-1+mp3oxo3j=mn3oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh3oxo5d+nc3h7=mn3oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h10-1+mb3oxo4j=mn3oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ms3oxo6d+c2h5=mn3oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h8-1+mf3oxo5j=mn3oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mo3oxo7d+ch3=mn3oxo7j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c5h11coch2chco+ch3o=mn4oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp2d+c5h11co=mn4oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc5h11+ch3oco=mn4oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb4oxo3d+c5h11-1=mn4oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h9chco+mp3j=mn4oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh4oxo5d+nc3h7=mn4oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h10-1+mb4oxo4j=mn4oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ms4oxo6d+c2h5=mn4oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h8-1+mf4oxo5j=mn4oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mo4oxo7d+ch3=mn4oxo7j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c3h6+mh4oxo6j=mn4oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h9coc2h4chco+ch3o=mn5oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp2d+c4h9coch2=mn5oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coc4h9+ch3oco=mn5oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb3d+c4h9co=mn5oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc4h9+me2j=mn5oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf5oxo4d+pc4h9=mn5oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h7chco+mb4j=mn5oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ms5oxo6d+c2h5=mn5oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h8-1+mf5oxo5j=mn5oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mo5oxo7d+ch3=mn5oxo7j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c3h6+mh5oxo6j=mn5oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !~c2h4+ms5oxo7j=mn5oxo9j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h7coc3h6chco+ch3o=mn6oxo2j 5.000E+11 0.000 -01000.0 !25b from mb mechanism mp2d+c3h7coc2h4=mn6oxo2j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7coc3h7+ch3oco=mn6oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb3d+c3h7coch2=mn6oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coc3h7+me2j=mn6oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf4d+c3h7co=mn6oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc3h7+mp3j=mn6oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh6oxo5d+nc3h7=mn6oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h5chco+mf5j=mn6oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mo6oxo7d+ch3=mn6oxo7j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C c3h6+mh6oxo6j=mn6oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !~c2h4+ms6oxo7j=mn6oxo9j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h9coc2h5+ch3oco=mn7oxo3j 1.055E+11 0.000 07350.0 !25b from mb mechanism mb3d+c2h5coc2h4=mn7oxo3j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7coc2h5+me2j=mn7oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf4d+c2h5coch2=mn7oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coc2h5+mp3j=mn7oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh5d+c2h5co=mn7oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coc2h5+mb4j=mn7oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ms7oxo6d+c2h5=mn7oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch3chco+mh6j=mn7oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C !~c2h4+ms7oxo7j=mn7oxo9j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h9coch3+me2j=mn8oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mf4d+c2h4coch3=mn8oxo4j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7coch3+mp3j=mn8oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh5d+ch3coch2=mn8oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5coch3+mb4j=mn8oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ms6d+ch3co=mn8oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3coch3+mf5j=mn8oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mo8oxo7d+ch3=mn8oxo7j 1.760E+04 2.480 06130.0 !25b addition of CH3 to C=C !~ch2co+ms7j=mn8oxo9j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c5h9cho+mp3j=mn9oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mh5d+c2h4cho=mn9oxo5j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c4h7cho+mb4j=mn9oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ms6d+ch2cho=mn9oxo6j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c3h5cho+mf5j=mn9oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C mo7d+hco=mn9oxo7j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C c2h3cho+mh6j=mn9oxo8j 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ! coco=co+co 1.000E+16 0.000 172200.0 !25b estimated co+hco=hcoco 8.800E+03 2.480 06130.0 !25b addition of R. to C=C co+ch3co=ch3coco 8.800E+03 2.480 06130.0 !25b addition of R. to C=C coco+ch3=ch3coco 8.800E+03 2.480 06130.0 !25b addition of R. to C=C co+c2h5co=c2h5coco 8.800E+03 2.480 06130.0 !25b addition of R. to C=C coco+c2h5=c2h5coco 8.800E+03 2.480 06130.0 !25b addition of R. to C=C co+c3h7co=c3h7coco 8.800E+03 2.480 06130.0 !25b addition of R. to C=C coco+nc3h7=c3h7coco 8.800E+03 2.480 06130.0 !25b addition of R. to C=C co+c4h9co=c4h9coco 8.800E+03 2.480 06130.0 !25b addition of R. to C=C coco+pc4h9=c4h9coco 8.800E+03 2.480 06130.0 !25b addition of R. to C=C co+c5h11co=c5h11coco 8.800E+03 2.480 06130.0 !25b addition of R. to C=C coco+c5h11-1=c5h11coco 8.800E+03 2.480 06130.0 !25b addition of R. to C=C co+c6h13co=c6h13coco 8.800E+03 2.480 06130.0 !25b addition of R. to C=C coco+c6h13-1=c6h13coco 8.800E+03 2.480 06130.0 !25b addition of R. to C=C co+c7h15co=c7h15coco 8.800E+03 2.480 06130.0 !25b addition of R. to C=C coco+c7h15-1=c7h15coco 8.800E+03 2.480 06130.0 !25b addition of R. to C=C co+c8h17co=c8h17coco 8.800E+03 2.480 06130.0 !25b addition of R. to C=C coco+c8h17-1=c8h17coco 8.800E+03 2.480 06130.0 !25b addition of R. to C=C co+ch2cho=choch2co 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2co+hco=choch2co 8.800E+03 2.480 06130.0 !25b addition of R. to C=C co+ch3coch2=ch3coch2co 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2co+ch3co=ch3coch2co 8.800E+03 2.480 06130.0 !25b addition of R. to C=C co+c2h5coch2=c2h5coch2co 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2co+c2h5co=c2h5coch2co 8.800E+03 2.480 06130.0 !25b addition of R. to C=C co+c3h7coch2=c3h7coch2co 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2co+c3h7co=c3h7coch2co 8.800E+03 2.480 06130.0 !25b addition of R. to C=C co+c4h9coch2=c4h9coch2co 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2co+c4h9co=c4h9coch2co 8.800E+03 2.480 06130.0 !25b addition of R. to C=C co+c5h11coch2=c5h11coch2co 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2co+c5h11co=c5h11coch2co 8.800E+03 2.480 06130.0 !25b addition of R. to C=C co+c6h13coch2=c6h13coch2co 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2co+c6h13co=c6h13coch2co 8.800E+03 2.480 06130.0 !25b addition of R. to C=C co+c7h15coch2=c7h15coch2co 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ch2co+c7h15co=c7h15coch2co 8.800E+03 2.480 06130.0 !25b addition of R. to C=C ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 26/mdxdyooh decomposition to mdxdyo + OH ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! ! md2dmooh=oh+md2dmo 6.310E+14 0.000 42330.0 !26 md2d2ooh=oh+md2d2o 6.310E+14 0.000 42330.0 !26 md2d3ooh=oh+md2d3o 6.310E+14 0.000 42330.0 !26 md2d4ooh=oh+md2d4o 6.310E+14 0.000 42330.0 !26 md2d5ooh=oh+md2d5o 6.310E+14 0.000 42330.0 !26 md2d6ooh=oh+md2d6o 6.310E+14 0.000 42330.0 !26 md2d7ooh=oh+md2d7o 6.310E+14 0.000 42330.0 !26 md3dmooh=oh+md3dmo 6.310E+14 0.000 42330.0 !26 md3d2ooh=oh+md3d2o 6.310E+14 0.000 42330.0 !26 md3d3ooh=oh+md3d3o 6.310E+14 0.000 42330.0 !26 md3d4ooh=oh+md3d4o 6.310E+14 0.000 42330.0 !26 md3d5ooh=oh+md3d5o 6.310E+14 0.000 42330.0 !26 md3d6ooh=oh+md3d6o 6.310E+14 0.000 42330.0 !26 md3d7ooh=oh+md3d7o 6.310E+14 0.000 42330.0 !26 md3d8ooh=oh+md3d8o 6.310E+14 0.000 42330.0 !26 md4d2ooh=oh+md4d2o 6.310E+14 0.000 42330.0 !26 md4d3ooh=oh+md4d3o 6.310E+14 0.000 42330.0 !26 md4d4ooh=oh+md4d4o 6.310E+14 0.000 42330.0 !26 md4d5ooh=oh+md4d5o 6.310E+14 0.000 42330.0 !26 md4d6ooh=oh+md4d6o 6.310E+14 0.000 42330.0 !26 md4d7ooh=oh+md4d7o 6.310E+14 0.000 42330.0 !26 md4d8ooh=oh+md4d8o 6.310E+14 0.000 42330.0 !26 md4d9ooh=oh+md4d9o 6.310E+14 0.000 42330.0 !26 md5d2ooh=oh+md5d2o 6.310E+14 0.000 42330.0 !26 md5d3ooh=oh+md5d3o 6.310E+14 0.000 42330.0 !26 md5d4ooh=oh+md5d4o 6.310E+14 0.000 42330.0 !26 md5d5ooh=oh+md5d5o 6.310E+14 0.000 42330.0 !26 md5d6ooh=oh+md5d6o 6.310E+14 0.000 42330.0 !26 md5d7ooh=oh+md5d7o 6.310E+14 0.000 42330.0 !26 md5d8ooh=oh+md5d8o 6.310E+14 0.000 42330.0 !26 md5d9ooh=oh+md5d9o 6.310E+14 0.000 42330.0 !26 md5d10ooh=oh+md5d10o 6.310E+14 0.000 42330.0 !26 md6d2ooh=oh+md6d2o 6.310E+14 0.000 42330.0 !26 md6d3ooh=oh+md6d3o 6.310E+14 0.000 42330.0 !26 md6d4ooh=oh+md6d4o 6.310E+14 0.000 42330.0 !26 md6d5ooh=oh+md6d5o 6.310E+14 0.000 42330.0 !26 md6d6ooh=oh+md6d6o 6.310E+14 0.000 42330.0 !26 md6d7ooh=oh+md6d7o 6.310E+14 0.000 42330.0 !26 md6d8ooh=oh+md6d8o 6.310E+14 0.000 42330.0 !26 md6d9ooh=oh+md6d9o 6.310E+14 0.000 42330.0 !26 md6d10ooh=oh+md6d10o 6.310E+14 0.000 42330.0 !26 md7d3ooh=oh+md7d3o 6.310E+14 0.000 42330.0 !26 md7d4ooh=oh+md7d4o 6.310E+14 0.000 42330.0 !26 md7d5ooh=oh+md7d5o 6.310E+14 0.000 42330.0 !26 md7d6ooh=oh+md7d6o 6.310E+14 0.000 42330.0 !26 md7d7ooh=oh+md7d7o 6.310E+14 0.000 42330.0 !26 md7d8ooh=oh+md7d8o 6.310E+14 0.000 42330.0 !26 md7d9ooh=oh+md7d9o 6.310E+14 0.000 42330.0 !26 md7d10ooh=oh+md7d10o 6.310E+14 0.000 42330.0 !26 md8d4ooh=oh+md8d4o 6.310E+14 0.000 42330.0 !26 md8d5ooh=oh+md8d5o 6.310E+14 0.000 42330.0 !26 md8d6ooh=oh+md8d6o 6.310E+14 0.000 42330.0 !26 md8d7ooh=oh+md8d7o 6.310E+14 0.000 42330.0 !26 md8d8ooh=oh+md8d8o 6.310E+14 0.000 42330.0 !26 md8d9ooh=oh+md8d9o 6.310E+14 0.000 42330.0 !26 md8d10ooh=oh+md8d10o 6.310E+14 0.000 42330.0 !26 md9d5ooh=oh+md9d5o 6.310E+14 0.000 42330.0 !26 md9d6ooh=oh+md9d6o 6.310E+14 0.000 42330.0 !26 md9d7ooh=oh+md9d7o 6.310E+14 0.000 42330.0 !26 md9d8ooh=oh+md9d8o 6.310E+14 0.000 42330.0 !26 md9d9ooh=oh+md9d9o 6.310E+14 0.000 42330.0 !26 md9d10ooh=oh+md9d10o 6.310E+14 0.000 42330.0 !26 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 26b/Decomposition of the radicals from reaction type 26 ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! ! h+mdmoxo2d=md2dmo 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h da2doj+ch2o=md2dmo 1.000E+11 0.000 11900.0 !26b Huge mechanism ch3o+ch2o ch3oco+c7h15chco=md2d2o 1.055E+11 0.000 07350.0 !26b from mb mechanism c6h13-1+mb2oxo3d=md2d2o 8.800E+03 2.480 06130.0 !26b Curran, 2006 c2h5+c3h6 c7h15-1+mp3oxo2d=md2d3o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho ch3o+c7h15cochco=md2d3o 5.000E-11 0.000 -01000.0 !26b from mb mechanism h+md4oxo2d=md2d4o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h c6h13-1+mb4oxo2d=md2d4o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mp2d3j+c6h13cho=md2d4o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md5oxo2d=md2d5o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h c5h11-1+mf5oxo2d=md2d5o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mb3d2j+c5h11cho=md2d5o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md6oxo2d=md2d6o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h pc4h9+mh6oxo2d=md2d6o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mf2d5j+c4h9cho=md2d6o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md7oxo2d=md2d7o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h nc3h7+ms7oxo2d=md2d7o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mh2d6j+c3h7cho=md2d7o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho ! h+mdmoxo3d=md3dmo 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h da3doj+ch2o=md3dmo 1.000E+11 0.000 11900.0 !26b Huge mechanism ch3o+ch2o h+md2oxo3d=md3d2o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h ch3oco+c6h13c2h2cho=md3d2o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c8h15-11+me2oxo=md3d2o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho me2j+c6h13chco=md3d3o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c5h11-1+mf3oxo4d=md3d3o 8.800E+03 2.480 06130.0 !26b Curran, 2006 c2h5+c3h6 c6h13-1+mb4oxo3d=md3d4o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho ch3oco+c2h3coc6h13=md3d4o 1.055E+11 0.000 07350.0 !26b from mb mechanism h+md5oxo3d=md3d5o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h c5h11-1+mf5oxo3d=md3d5o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mb3d4j+c5h11cho=md3d5o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md6oxo3d=md3d6o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h pc4h9+mh6oxo3d=md3d6o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mf4d3j+c4h9cho=md3d6o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md7oxo3d=md3d7o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h nc3h7+ms7oxo3d=md3d7o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mh3d6j+c3h7cho=md3d7o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md8oxo3d=md3d8o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h c2h5+mo8oxo3d=md3d8o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho ms3d7j+c2h5cho=md3d8o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho ! h+md2oxo4d=md4d2o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h ch3oco+c5h11c2h2ch2cho=md4d2o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c8h15-13+me2oxo=md4d2o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md3oxo4d=md4d3o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h me2j+c5h11c2h2cho=md4d3o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c7h13-11+mp3oxo=md4d3o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mp3j+c5h11chco=md4d4o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho pc4h9+mh4oxo5d=md4d4o 8.800E+03 2.480 06130.0 !26b Curran, 2006 c2h5+c3h6 c5h11-1+mf5oxo4d=md4d5o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho me2j+c2h3coc5h11=md4d5o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md6oxo4d=md4d6o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h pc4h9+mh6oxo4d=md4d6o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mf4d5j+c4h9cho=md4d6o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md7oxo4d=md4d7o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h nc3h7+ms7oxo4d=md4d7o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mh5d4j+c3h7cho=md4d7o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md8oxo4d=md4d8o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h c2h5+mo8oxo4d=md4d8o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho ms4d7j+c2h5cho=md4d8o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md9oxo4d=md4d9o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h ch3+mn9oxo4d=md4d9o 1.000E+11 0.000 09256.0 !26b Curran, 2006 ch3+ch3cho mo4d8j+ch3cho=md4d9o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho ! h+md2oxo5d=md5d2o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h ch3oco+c4h9c2h2c2h4cho=md5d2o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c8h15-31+me2oxo=md5d2o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md3oxo5d=md5d3o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h me2j+c4h9c2h2ch2cho=md5d3o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c7h13-13+mp3oxo=md5d3o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md4oxo5d=md5d4o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h mp3j+c4h9c2h2cho=md5d4o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c6h11-11+mb4oxo=md5d4o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mb4j+c4h9chco=md5d5o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho nc3h7+ms5oxo6d=md5d5o 8.800E+03 2.480 06130.0 !26b Curran, 2006 c2h5+c3h6 pc4h9+mh6oxo5d=md5d6o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mp3j+c2h3coc4h9=md5d6o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md7oxo5d=md5d7o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h nc3h7+ms7oxo5d=md5d7o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mh5d6j+c3h7cho=md5d7o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md8oxo5d=md5d8o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h c2h5+mo8oxo5d=md5d8o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho ms6d5j+c2h5cho=md5d8o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md9oxo5d=md5d9o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h ch3+mn9oxo5d=md5d9o 1.000E+11 0.000 09256.0 !26b Curran, 2006 ch3+ch3cho mo5d8j+ch3cho=md5d9o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md10oxo5d=md5d10o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h mn5d9j+ch2o=md5d10o 5.000E+10 0.000 03457.0 !26b Curran, 2006 ch2o+nc3h7 ! h+md2oxo6d=md6d2o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h ch3oco+c3h7c2h2c3h6cho=md6d2o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c8h15-41+me2oxo=md6d2o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md3oxo6d=md6d3o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h me2j+c3h7c2h2c2h4cho=md6d3o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c7h13-31+mp3oxo=md6d3o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md4oxo6d=md6d4o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h mp3j+c3h7c2h2ch2cho=md6d4o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c6h11-13+mb4oxo=md6d4o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md5oxo6d=md6d5o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h mb4j+c3h7c2h2cho=md6d5o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c5h9-11+mf5oxo=md6d5o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mf5j+c3h7chco=md6d6o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c2h5+mo6oxo7d=md6d6o 8.800E+03 2.480 06130.0 !26b Curran, 2006 c2h5+c3h6 nc3h7+ms7oxo6d=md6d7o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mb4j+c2h3coc3h7=md6d7o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md8oxo6d=md6d8o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h c2h5+mo8oxo6d=md6d8o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho ms6d7j+c2h5cho=md6d8o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md9oxo6d=md6d9o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h ch3+mn9oxo6d=md6d9o 1.000E+11 0.000 09256.0 !26b Curran, 2006 ch3+ch3cho mo7d6j+ch3cho=md6d9o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md10oxo6d=md6d10o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h mn6d9j+ch2o=md6d10o 5.000E+10 0.000 03457.0 !26b Curran, 2006 ch2o+nc3h7 ! h+md2oxo7d=md7d2o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h ch3oco+c2h5c2h2c4h8cho=md7d2o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c8h15-38+me2oxo=md7d2o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md3oxo7d=md7d3o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h me2j+c2h5c2h2c3h6cho=md7d3o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c7h13-37+mp3oxo=md7d3o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md4oxo7d=md7d4o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h mp3j+c2h5c2h2c2h4cho=md7d4o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c6h11-31+mb4oxo=md7d4o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md5oxo7d=md7d5o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h mb4j+c2h5c2h2ch2cho=md7d5o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c5h9-13+mf5oxo=md7d5o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md6oxo7d=md7d6o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h mf5j+c2h5c2h2cho=md7d6o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c4h7-11+mh6oxo=md7d6o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mh6j+c2h5chco=md7d7o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho ch3+mn7oxo8d=md7d7o 1.760E+04 2.480 06130.0 !26b Curran, 2006 ch3+c3h6 c2h5+mo8oxo7d=md7d8o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mf5j+c2h3coc2h5=md7d8o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md9oxo7d=md7d9o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h mo7d8j+ch3cho=md7d9o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho ch3+mn9oxo7d=md7d9o 1.000E+11 0.000 09256.0 !26b Curran, 2006 ch3+ch3cho h+md10oxo7d=md7d10o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h mn8d7j+ch2o=md7d10o 5.000E+10 0.000 03457.0 !26b Curran, 2006 ch2o+nc3h7 ! h+md2oxo8d=md8d2o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h ch3oco+ch3c2h2c5h10cho=md8d2o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c8h15-28+me2oxo=md8d2o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md3oxo8d=md8d3o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h me2j+ch3c2h2c4h8cho=md8d3o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c7h13-27+mp3oxo=md8d3o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md4oxo8d=md8d4o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h mp3j+ch3c2h2c3h6cho=md8d4o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c6h11-26+mb4oxo=md8d4o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md5oxo8d=md8d5o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h mb4j+ch3c2h2c2h4cho=md8d5o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c5h9-25+mf5oxo=md8d5o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md6oxo8d=md8d6o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h mf5j+ch3c2h2ch2cho=md8d6o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c4h7-13+mh6oxo=md8d6o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md7oxo8d=md8d7o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h mh6j+ch3c2h2cho=md8d7o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho c3h5-s+ms7oxo=md8d7o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho ms7j+ch3chco=md8d8o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho ch3+mn9oxo8d=md8d9o 1.000E+11 0.000 09256.0 !26b Curran, 2006 ch3+ch3cho mh6j+c2h3coch3=md8d9o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md10oxo8d=md8d10o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h mn8d9j+ch2o=md8d10o 5.000E+10 0.000 03457.0 !26b Curran, 2006 ch2o+nc3h7 ! h+md2oxo9d=md9d2o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h c8h15-18+me2oxo=md9d2o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho ch3oco+c2h3c6h12cho=md9d2o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md3oxo9d=md9d3o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h c7h13-17+mp3oxo=md9d3o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho me2j+c2h3c5h10cho=md9d3o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md4oxo9d=md9d4o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h c6h11-16+mb4oxo=md9d4o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mp3j+c2h3c4h8cho=md9d4o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md5oxo9d=md9d5o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h c5h9-15+mf5oxo=md9d5o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mb4j+c2h3c3h6cho=md9d5o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md6oxo9d=md9d6o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h c4h7-14+mh6oxo=md9d6o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mf5j+c2h3c2h4cho=md9d6o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md7oxo9d=md9d7o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h c3h5-a+ms7oxo=md9d7o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mh6j+c3h5cho=md9d7o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md8oxo9d=md9d8o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h c2h3+mo8oxo=md9d8o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho ms7j+c2h3cho=md9d8o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho mo8j+ch2co=md9d9o 3.330E+10 0.000 06397.0 !26b Curran, 2006 c2h5+ch3cho h+md10oxo9d=md9d10o 2.000E+12 0.000 07270.0 !26b Curran, 2006 ch3coch3+h ms7j+c2h3cho=md9d10o 8.800E+03 2.480 06130.0 !26b Curran, 2006 c2h5+c3h6 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 27/hydroperoxy cyclic ether to alkoxy cyclic ether ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! ! mdcym2-3=mdcym23o+oh 6.310E+14 0.000 42330.0 !27 mdcym2-4=mdcym24o+oh 6.310E+14 0.000 42330.0 !27 mdcym2-5=mdcym25o+oh 6.310E+14 0.000 42330.0 !27 mdcym2-6=mdcym26o+oh 6.310E+14 0.000 42330.0 !27 ! mdcym3-2=mdcym32o+oh 6.310E+14 0.000 42330.0 !27 mdcym3-4=mdcym34o+oh 6.310E+14 0.000 42330.0 !27 mdcym3-5=mdcym35o+oh 6.310E+14 0.000 42330.0 !27 mdcym3-6=mdcym36o+oh 6.310E+14 0.000 42330.0 !27 mdcym3-7=mdcym37o+oh 6.310E+14 0.000 42330.0 !27 ! mdcy23-m=mdcy23mo+oh 6.310E+14 0.000 42330.0 !27 mdcy23-4=mdcy234o+oh 6.310E+14 0.000 42330.0 !27 mdcy23-5=mdcy235o+oh 6.310E+14 0.000 42330.0 !27 mdcy23-6=mdcy236o+oh 6.310E+14 0.000 42330.0 !27 mdcy23-7=mdcy237o+oh 6.310E+14 0.000 42330.0 !27 ! mdcy24-m=mdcy24mo+oh 6.310E+14 0.000 42330.0 !27 mdcy24-3=mdcy243o+oh 6.310E+14 0.000 42330.0 !27 mdcy24-5=mdcy245o+oh 6.310E+14 0.000 42330.0 !27 mdcy24-6=mdcy246o+oh 6.310E+14 0.000 42330.0 !27 mdcy24-7=mdcy247o+oh 6.310E+14 0.000 42330.0 !27 mdcy24-8=mdcy248o+oh 6.310E+14 0.000 42330.0 !27 ! mdcy25-m=mdcy25mo+oh 6.310E+14 0.000 42330.0 !27 mdcy25-3=mdcy253o+oh 6.310E+14 0.000 42330.0 !27 mdcy25-4=mdcy254o+oh 6.310E+14 0.000 42330.0 !27 mdcy25-6=mdcy256o+oh 6.310E+14 0.000 42330.0 !27 mdcy25-7=mdcy257o+oh 6.310E+14 0.000 42330.0 !27 mdcy25-8=mdcy258o+oh 6.310E+14 0.000 42330.0 !27 mdcy25-9=mdcy259o+oh 6.310E+14 0.000 42330.0 !27 ! mdcy26-m=mdcy26mo+oh 6.310E+14 0.000 42330.0 !27 mdcy26-3=mdcy263o+oh 6.310E+14 0.000 42330.0 !27 mdcy26-4=mdcy264o+oh 6.310E+14 0.000 42330.0 !27 mdcy26-5=mdcy265o+oh 6.310E+14 0.000 42330.0 !27 mdcy26-7=mdcy267o+oh 6.310E+14 0.000 42330.0 !27 mdcy26-8=mdcy268o+oh 6.310E+14 0.000 42330.0 !27 mdcy26-9=mdcy269o+oh 6.310E+14 0.000 42330.0 !27 mdcy26-10=mdcy26xo+oh 6.310E+14 0.000 42330.0 !27 ! mdcy34-m=mdcy34mo+oh 6.310E+14 0.000 42330.0 !27 mdcy34-2=mdcy342o+oh 6.310E+14 0.000 42330.0 !27 mdcy34-5=mdcy345o+oh 6.310E+14 0.000 42330.0 !27 mdcy34-6=mdcy346o+oh 6.310E+14 0.000 42330.0 !27 mdcy34-7=mdcy347o+oh 6.310E+14 0.000 42330.0 !27 mdcy34-8=mdcy348o+oh 6.310E+14 0.000 42330.0 !27 ! mdcy35-m=mdcy35mo+oh 6.310E+14 0.000 42330.0 !27 mdcy35-2=mdcy352o+oh 6.310E+14 0.000 42330.0 !27 mdcy35-4=mdcy354o+oh 6.310E+14 0.000 42330.0 !27 mdcy35-6=mdcy356o+oh 6.310E+14 0.000 42330.0 !27 mdcy35-7=mdcy357o+oh 6.310E+14 0.000 42330.0 !27 mdcy35-8=mdcy358o+oh 6.310E+14 0.000 42330.0 !27 mdcy35-9=mdcy359o+oh 6.310E+14 0.000 42330.0 !27 ! mdcy36-m=mdcy36mo+oh 6.310E+14 0.000 42330.0 !27 mdcy36-2=mdcy362o+oh 6.310E+14 0.000 42330.0 !27 mdcy36-4=mdcy364o+oh 6.310E+14 0.000 42330.0 !27 mdcy36-5=mdcy365o+oh 6.310E+14 0.000 42330.0 !27 mdcy36-7=mdcy367o+oh 6.310E+14 0.000 42330.0 !27 mdcy36-8=mdcy368o+oh 6.310E+14 0.000 42330.0 !27 mdcy36-9=mdcy369o+oh 6.310E+14 0.000 42330.0 !27 mdcy36-10=mdcy36xo+oh 6.310E+14 0.000 42330.0 !27 ! mdcy37-m=mdcy37mo+oh 6.310E+14 0.000 42330.0 !27 mdcy37-2=mdcy372o+oh 6.310E+14 0.000 42330.0 !27 mdcy37-4=mdcy374o+oh 6.310E+14 0.000 42330.0 !27 mdcy37-5=mdcy375o+oh 6.310E+14 0.000 42330.0 !27 mdcy37-6=mdcy376o+oh 6.310E+14 0.000 42330.0 !27 mdcy37-8=mdcy378o+oh 6.310E+14 0.000 42330.0 !27 mdcy37-9=mdcy379o+oh 6.310E+14 0.000 42330.0 !27 mdcy37-10=mdcy37xo+oh 6.310E+14 0.000 42330.0 !27 ! mdcy45-2=mdcy452o+oh 6.310E+14 0.000 42330.0 !27 mdcy45-3=mdcy453o+oh 6.310E+14 0.000 42330.0 !27 mdcy45-6=mdcy456o+oh 6.310E+14 0.000 42330.0 !27 mdcy45-7=mdcy457o+oh 6.310E+14 0.000 42330.0 !27 mdcy45-8=mdcy458o+oh 6.310E+14 0.000 42330.0 !27 mdcy45-9=mdcy459o+oh 6.310E+14 0.000 42330.0 !27 ! mdcy46-2=mdcy462o+oh 6.310E+14 0.000 42330.0 !27 mdcy46-3=mdcy463o+oh 6.310E+14 0.000 42330.0 !27 mdcy46-5=mdcy465o+oh 6.310E+14 0.000 42330.0 !27 mdcy46-7=mdcy467o+oh 6.310E+14 0.000 42330.0 !27 mdcy46-8=mdcy468o+oh 6.310E+14 0.000 42330.0 !27 mdcy46-9=mdcy469o+oh 6.310E+14 0.000 42330.0 !27 mdcy46-10=mdcy46xo+oh 6.310E+14 0.000 42330.0 !27 ! mdcy47-2=mdcy472o+oh 6.310E+14 0.000 42330.0 !27 mdcy47-3=mdcy473o+oh 6.310E+14 0.000 42330.0 !27 mdcy47-5=mdcy475o+oh 6.310E+14 0.000 42330.0 !27 mdcy47-6=mdcy476o+oh 6.310E+14 0.000 42330.0 !27 mdcy47-8=mdcy478o+oh 6.310E+14 0.000 42330.0 !27 mdcy47-9=mdcy479o+oh 6.310E+14 0.000 42330.0 !27 mdcy47-10=mdcy47xo+oh 6.310E+14 0.000 42330.0 !27 ! mdcy48-2=mdcy482o+oh 6.310E+14 0.000 42330.0 !27 mdcy48-3=mdcy483o+oh 6.310E+14 0.000 42330.0 !27 mdcy48-5=mdcy485o+oh 6.310E+14 0.000 42330.0 !27 mdcy48-6=mdcy486o+oh 6.310E+14 0.000 42330.0 !27 mdcy48-7=mdcy487o+oh 6.310E+14 0.000 42330.0 !27 mdcy48-9=mdcy489o+oh 6.310E+14 0.000 42330.0 !27 mdcy48-10=mdcy48xo+oh 6.310E+14 0.000 42330.0 !27 ! mdcy56-2=mdcy562o+oh 6.310E+14 0.000 42330.0 !27 mdcy56-3=mdcy563o+oh 6.310E+14 0.000 42330.0 !27 mdcy56-4=mdcy564o+oh 6.310E+14 0.000 42330.0 !27 mdcy56-7=mdcy567o+oh 6.310E+14 0.000 42330.0 !27 mdcy56-8=mdcy568o+oh 6.310E+14 0.000 42330.0 !27 mdcy56-9=mdcy569o+oh 6.310E+14 0.000 42330.0 !27 mdcy56-10=mdcy56xo+oh 6.310E+14 0.000 42330.0 !27 ! mdcy57-2=mdcy572o+oh 6.310E+14 0.000 42330.0 !27 mdcy57-3=mdcy573o+oh 6.310E+14 0.000 42330.0 !27 mdcy57-4=mdcy574o+oh 6.310E+14 0.000 42330.0 !27 mdcy57-6=mdcy576o+oh 6.310E+14 0.000 42330.0 !27 mdcy57-8=mdcy578o+oh 6.310E+14 0.000 42330.0 !27 mdcy57-9=mdcy579o+oh 6.310E+14 0.000 42330.0 !27 mdcy57-10=mdcy57xo+oh 6.310E+14 0.000 42330.0 !27 ! mdcy58-2=mdcy582o+oh 6.310E+14 0.000 42330.0 !27 mdcy58-3=mdcy583o+oh 6.310E+14 0.000 42330.0 !27 mdcy58-4=mdcy584o+oh 6.310E+14 0.000 42330.0 !27 mdcy58-6=mdcy586o+oh 6.310E+14 0.000 42330.0 !27 mdcy58-7=mdcy587o+oh 6.310E+14 0.000 42330.0 !27 mdcy58-9=mdcy589o+oh 6.310E+14 0.000 42330.0 !27 mdcy58-10=mdcy58xo+oh 6.310E+14 0.000 42330.0 !27 ! mdcy59-2=mdcy592o+oh 6.310E+14 0.000 42330.0 !27 mdcy59-3=mdcy593o+oh 6.310E+14 0.000 42330.0 !27 mdcy59-4=mdcy594o+oh 6.310E+14 0.000 42330.0 !27 mdcy59-6=mdcy596o+oh 6.310E+14 0.000 42330.0 !27 mdcy59-7=mdcy597o+oh 6.310E+14 0.000 42330.0 !27 mdcy59-8=mdcy598o+oh 6.310E+14 0.000 42330.0 !27 mdcy59-10=mdcy59xo+oh 6.310E+14 0.000 42330.0 !27 ! mdcy67-2=mdcy672o+oh 6.310E+14 0.000 42330.0 !27 mdcy67-3=mdcy673o+oh 6.310E+14 0.000 42330.0 !27 mdcy67-4=mdcy674o+oh 6.310E+14 0.000 42330.0 !27 mdcy67-5=mdcy675o+oh 6.310E+14 0.000 42330.0 !27 mdcy67-8=mdcy678o+oh 6.310E+14 0.000 42330.0 !27 mdcy67-9=mdcy679o+oh 6.310E+14 0.000 42330.0 !27 mdcy67-10=mdcy67xo+oh 6.310E+14 0.000 42330.0 !27 ! mdcy68-2=mdcy682o+oh 6.310E+14 0.000 42330.0 !27 mdcy68-3=mdcy683o+oh 6.310E+14 0.000 42330.0 !27 mdcy68-4=mdcy684o+oh 6.310E+14 0.000 42330.0 !27 mdcy68-5=mdcy685o+oh 6.310E+14 0.000 42330.0 !27 mdcy68-7=mdcy687o+oh 6.310E+14 0.000 42330.0 !27 mdcy68-9=mdcy689o+oh 6.310E+14 0.000 42330.0 !27 mdcy68-10=mdcy68xo+oh 6.310E+14 0.000 42330.0 !27 ! mdcy69-2=mdcy692o+oh 6.310E+14 0.000 42330.0 !27 mdcy69-3=mdcy693o+oh 6.310E+14 0.000 42330.0 !27 mdcy69-4=mdcy694o+oh 6.310E+14 0.000 42330.0 !27 mdcy69-5=mdcy695o+oh 6.310E+14 0.000 42330.0 !27 mdcy69-7=mdcy697o+oh 6.310E+14 0.000 42330.0 !27 mdcy69-8=mdcy698o+oh 6.310E+14 0.000 42330.0 !27 mdcy69-10=mdcy69xo+oh 6.310E+14 0.000 42330.0 !27 ! mdcy70-2=mdcy702o+oh 6.310E+14 0.000 42330.0 !27 mdcy70-3=mdcy703o+oh 6.310E+14 0.000 42330.0 !27 mdcy70-4=mdcy704o+oh 6.310E+14 0.000 42330.0 !27 mdcy70-5=mdcy705o+oh 6.310E+14 0.000 42330.0 !27 mdcy70-7=mdcy707o+oh 6.310E+14 0.000 42330.0 !27 mdcy70-8=mdcy708o+oh 6.310E+14 0.000 42330.0 !27 mdcy70-9=mdcy709o+oh 6.310E+14 0.000 42330.0 !27 ! mdcy78-3=mdcy783o+oh 6.310E+14 0.000 42330.0 !27 mdcy78-4=mdcy784o+oh 6.310E+14 0.000 42330.0 !27 mdcy78-5=mdcy785o+oh 6.310E+14 0.000 42330.0 !27 mdcy78-6=mdcy786o+oh 6.310E+14 0.000 42330.0 !27 mdcy78-9=mdcy789o+oh 6.310E+14 0.000 42330.0 !27 mdcy78-10=mdcy78xo+oh 6.310E+14 0.000 42330.0 !27 ! mdcy79-3=mdcy793o+oh 6.310E+14 0.000 42330.0 !27 mdcy79-4=mdcy794o+oh 6.310E+14 0.000 42330.0 !27 mdcy79-5=mdcy795o+oh 6.310E+14 0.000 42330.0 !27 mdcy79-6=mdcy796o+oh 6.310E+14 0.000 42330.0 !27 mdcy79-8=mdcy798o+oh 6.310E+14 0.000 42330.0 !27 mdcy79-10=mdcy79xo+oh 6.310E+14 0.000 42330.0 !27 ! mdcy80-3=mdcy803o+oh 6.310E+14 0.000 42330.0 !27 mdcy80-4=mdcy804o+oh 6.310E+14 0.000 42330.0 !27 mdcy80-5=mdcy805o+oh 6.310E+14 0.000 42330.0 !27 mdcy80-6=mdcy806o+oh 6.310E+14 0.000 42330.0 !27 mdcy80-8=mdcy808o+oh 6.310E+14 0.000 42330.0 !27 mdcy80-9=mdcy809o+oh 6.310E+14 0.000 42330.0 !27 ! mdcy89-4=mdcy894o+oh 6.310E+14 0.000 42330.0 !27 mdcy89-5=mdcy895o+oh 6.310E+14 0.000 42330.0 !27 mdcy89-6=mdcy896o+oh 6.310E+14 0.000 42330.0 !27 mdcy89-7=mdcy897o+oh 6.310E+14 0.000 42330.0 !27 mdcy89-10=mdcy89xo+oh 6.310E+14 0.000 42330.0 !27 ! mdcy90-4=mdcy904o+oh 6.310E+14 0.000 42330.0 !27 mdcy90-5=mdcy905o+oh 6.310E+14 0.000 42330.0 !27 mdcy90-6=mdcy906o+oh 6.310E+14 0.000 42330.0 !27 mdcy90-7=mdcy907o+oh 6.310E+14 0.000 42330.0 !27 mdcy90-9=mdcy909o+oh 6.310E+14 0.000 42330.0 !27 ! mdcy100-5=mdcy9x5o+oh 6.310E+14 0.000 42330.0 !27 mdcy100-6=mdcy9x6o+oh 6.310E+14 0.000 42330.0 !27 mdcy100-7=mdcy9x7o+oh 6.310E+14 0.000 42330.0 !27 mdcy100-8=mdcy9x8o+oh 6.310E+14 0.000 42330.0 !27 ! ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! 27b/decomposition reactions of radicals from reaction type 27 ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! ! h+mdcym23oxo=mdcym23o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcym23o=>c7h15-1+cym23 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcym23o=>cym23j+c7h15cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cym23j=>co+hco+ch2o 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o duplicate cym23j=>co+hco+ch2o 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o duplicate ! h+mdcym24oxo=mdcym24o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcym24o=>c6h13-1+cym24 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcym24o=>cym24j+c6h13cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cym24j=>ch2o+co2+c2h3 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o duplicate cym24j=>ch2o+co2+c2h3 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 duplicate ! h+mdcym25oxo=mdcym25o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcym25o=>c5h11-1+cym25 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcym25o=>cym23j+c2h4+c5h11cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcym26oxo=mdcym26o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcym26o=>pc4h9+cym26 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcym26o=>cym24j+c2h4+c4h9cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcym32oxo=mdcym32o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcym32o=>c6h13-1+cym32 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcym32o=>c7h15cho+ch2o+hco+co 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcym32o=>c6h13-1+co2+ch2o+c2h3cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcym34oxo=mdcym34o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcym34o=>c6h13-1+cym34 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcym34o=>cym34j+c6h13cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cym34j=>ch2o+ch2cho+co 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cym34j=>co2+ch2o+c2h3 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcym35oxo=mdcym35o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcym35o=>c5h11-1+cym35 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcym35o=>cym35j+c5h11cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cym35j=>ch2o+co2+c3h5-a 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cym35j=>ch2co+ch2o+ch2cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcym36oxo=mdcym36o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcym36o=>pc4h9+cym36 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcym36o=>cym34j+c2h4+c4h9cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcym37oxo=mdcym37o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcym37o=>nc3h7+cym37 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcym37o=>cym35j+c2h4+c3h7cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy23moxo=mdcy23mo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy23mo=>ch2o+co2+cy23mj 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy23mj=>cyc2h2o+c7h15-1 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy23mj=>c2h3cho+c6h13-1 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy234oxo=mdcy234o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy234o=>c6h13-1+cy234 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy234o=>c6h13cho+cy234j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy234j=>ch3oco+cyc2h2o 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy234j=>ch3o+chochco 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy235oxo=mdcy235o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy235o=>c5h11-1+cy235 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy235o=>cy235j+c5h11cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy235j=>cy235ja 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy235j=>cy235jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy235ja=>me2oxo+c2h3 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy235ja=>ch3o+c2h3ochco 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy235jb=>me2oxo+c2h3 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy235jb=>ch3oco+c2h3cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy236oxo=mdcy236o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy236o=>pc4h9+cy236 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy236o=>c4h9cho+c2h4+cy234j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy237oxo=mdcy237o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy237o=>nc3h7+cy237 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy237o=>c3h7cho+c2h4+cy235j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy24moxo=mdcy24mo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy24mo=>ch2o+co2+cy24mj 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy24mj=>cy24mja 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy24mj=>cy24mjb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy24mja=>c2h3oc2h3+c5h11-1 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy24mja=>c6h13cho+c2h3 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy24mjb=>c3h5cho+c5h11-1 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy24mjb=>c8h16-1+hco 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 ! h+mdcy243oxo=mdcy243o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy243o=>cy243ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy243o=>cy243jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy243ja=>me2oxo+cy342jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy243ja=>cy243a+ch3o 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy243jb=>c5h11-1+cy243b 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy243jb=>c6h13cho+ch3o+chochco 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy245oxo=mdcy245o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy245o=>c5h11-1+cy245 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy245o=>c5h11cho+cy245j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy245j=>cy235ja 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy245j=>cy245jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy245jb=>mp2d+hco 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy245jb=>choch2chco+ch3o 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy246oxo=mdcy246o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy246o=>pc4h9+cy246 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy246o=>c4h9cho+cy246j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy246j=>cy246ja 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy246j=>cy246jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy246ja=>mp2d+ch2cho 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy246ja=>c2h3oc2h3+ch3oco 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy246jb=>c3h5cho+ch3oco 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy246jb=>me2oxo+c3h5-a 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy247oxo=mdcy247o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy247o=>nc3h7+cy247 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy247o=>c3h7cho+c2h4+cy245j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy248oxo=mdcy248o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy248o=>c2h5+cy248 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy248o=>c2h5cho+c2h4+cy246j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy25moxo=mdcy25mo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy25mo=>ch2o+co2+cy25mj 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy25mj=>cy25mja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy25mj=>cy25mjb 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy25mja=>c2h3c2h4cho+pc4h9 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy25mja=>c7h14-1+ch2cho 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy25mjb=>c2h3oc2h3+c5h11-1 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy25mjb=>c7h14-1+ch2cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy253oxo=mdcy253o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy253o=>cy253ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy253o=>cy253jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy253ja=>me2oxo+cy253jc 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy253ja=>ch3o+cy253a 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy253jb=>c5h11-1+cy253b 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy253jb=>c7h14-1+cy253jd 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy253jc=>c7h14-1+hco 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy253jc=>c3h5cho+pc4h9 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy253jd=>me2oxo+hco 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy253jd=>chocho+ch3oco 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy254oxo=mdcy254o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy254o=>cy254ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy254o=>cy254jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy254ja=>pc4h9+cy254a 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy254ja=>c5h11cho+cy245jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy254jb=>mp2d+cy254jd 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy254jb=>ch3oco+cy254b 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy254jd=>chocho+c5h11-1 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy254jd=>c5h11cho+hco 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy256oxo=mdcy256o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy256o=>pc4h9+cy256 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy256o=>c4h9cho+cy256j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy256j=>cy256ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy256j=>cy246ja 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy256ja=>mp2d+ch2cho 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy256ja=>ch3o+choc2h4chco 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy257oxo=mdcy257o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy257o=>nc3h7+cy257 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy257o=>c3h7cho+cy257j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy257j=>cy257ja+c2h4 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy257j=>cy257jb 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy257ja=>me2oxo+c2h3 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy257ja=>ch3o+c2h3ochco 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy257jb=>me2oxo+c4h7-14 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy257jb=>ch3oco+c2h3c2h4cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy258oxo=mdcy258o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy258o=>c2h5+cy258 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy258o=>c2h5cho+c2h4+cy256j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy259oxo=mdcy259o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy259o=>ch3+cy259 4.380E+16 -0.890 16530.0 !27b "Curran, 2006" sc4h9o=c2h5cho+ch3 mdcy259o=>ch3cho+c2h4+cy257j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy26moxo=mdcy26mo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy26mo=>ch2o+co2+cy26mj 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy26mj=>cy26mja+c2h4 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy26mj=>cy26mjb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy26mja=>c2h3oc2h3+nc3h7 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy26mja=>c4h9cho+c2h3 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy26mjb=>c2h3c3h6cho+nc3h7 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy26mjb=>c6h12-1+c2h4cho 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 ! h+mdcy263oxo=mdcy263o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy263o=>cy263ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy263o=>cy263jb+c2h4 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy263ja=>ch3o+cy263a 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy263ja=>me2oxo+cy263jc 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy263jb=>nc3h7+cy263b 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy263jb=>c4h9cho+chochco+ch3o 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy263jc=>c2h3c2h4cho+nc3h7 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy263jc=>c6h12-1+ch2cho 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 ! h+mdcy264oxo=mdcy264o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy264o=>cy264ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy264o=>cy264jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy264ja=>pc4h9+cy264a 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy264ja=>c6h12-1+cy264jc 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy264jb=>mp2d+cy264jd 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy264jb=>cy264b+ch3oco 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy264jc=>me2oxo+ch2cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy264jc=>choch2cho+ch3oco 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy264jd=>choch2cho+pc4h9 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy264jd=>c4h9cho+ch2cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy265oxo=mdcy265o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy265o=>cy265ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy265o=>cy265jb+c2h4 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy265ja=>nc3h7+cy265a 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy265ja=>c4h9cho+cy256ja 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy265jb=>ch3o+cy265b 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy265jb=>me2oxo+cy562j 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy267oxo=mdcy267o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy267o=>nc3h7+cy267 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy267o=>c3h7cho+cy267ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy267ja=>cy267jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy267ja=>cy235ja+c2h4 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy267jb=>ch3o+choc3h6chco 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy267jb=>mp2d+c2h4cho 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 ! h+mdcy268oxo=mdcy268o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy268o=>c2h5+cy268a 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy268o=>c2h5cho+cy268ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy268ja=>cy246ja+c2h4 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy268ja=>cy268jc 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy268jc=>me2oxo+c5h9-15 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy268jc=>c2h3c3h6cho+ch3oco 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy269oxo=mdcy269o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy269o=>ch3cho+c2h4+cy267ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy269o=>ch3+cy269 4.380E+16 -0.890 16530.0 !27b "Curran, 2006" sc4h9o=c2h5cho+ch3 ! h+mdcy26xoxo=mdcy26xo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy26xo=>ch2o+c2h4+cy268ja 1.570E+21 -2.440 16840.0 !27b "Curran, 2006" pc4h9o=ch2o+nc3h7 ! h+mdcy34moxo=mdcy34mo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy34mo=>ch2o+co2+cy34mja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy34mja=>cy24mja 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy34mja=>cy34mjc 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy34mjc=>c6h13cho+c2h3 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy34mjc=>c2h3cho+c6h13-1 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy342oxo=mdcy342o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy342o=>ch3oco+cy342a 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy342o=>me2oxo+cy342ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy342ja=>c6h13-1+cyc2h2o 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy342ja=>cy342jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy342jb=>c2h3cho+c5h11-1 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 ! h+mdcy345oxo=mdcy345o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy345o=>c5h11-1+cy345a 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy345o=>c5h11cho+cy345ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy345ja=>cyc2h2o+me2j 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy345ja=>c2h3cho+ch3oco 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy346oxo =mdcy346o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy346o=>pc4h9+cy346a 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy346o=>c4h9cho+cy346ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy346ja=>cy346jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy346ja=>cy346jc 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy346jb=>mp3oxo+c2h3 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy346jb=>c2h3cho+me2j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy346jc=>mp3oxo+c2h3 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy346jc=>c2h3oc2h3+ch3oco 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 ! h+mdcy347oxo=mdcy347o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy347o=>nc3h7+cy347 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy347o=>c3h7cho+c2h4+cy345ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy348oxo=mdcy348o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy348o=>c2h5+cy348 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy348o=>c2h5cho+c2h4+cy346ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy35moxo=mdcy35mo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy35mo=>ch2o+co2+cy35mj 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy35mj=>cy35mja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy35mj=>cy25mjb 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy35mja=>c3h5cho+c5h11-1 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy35mja=>c5h11cho+c3h5-a 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy352oxo=mdcy352o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy352o=>ch3oco+cy352 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy352o=>me2oxo+cy352j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy352j=>cy253jc 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy352j=>cy352jb 1.220E+12 0.640 29370.0 !27b "Curran, 2006" 2c5h11=c2h5+c3h6 cy352jb=>c2h3oc2h3+pc4h9 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy352jb=>c5h11cho+c2h3 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy354oxo=mdcy354o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy354o=>cy354ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy354o=>cy354jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy354ja=>pc4h9+cy354a 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy354ja=>c5h11cho+ch3oco+c2h3cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy354jb=>mp3oxo+cy453j 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy354jb=>ch3oco+cy354b 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy356oxo=mdcy356o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy356o=>pc4h9+cy356 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy356o=>c4h9cho+cy356j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy356j=>cy356ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy356j=>cy346jc 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy356ja=>mb3d+hco 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy356ja=>c3h5cho+ch3oco 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy357oxo=mdcy357o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy357o=>nc3h7+cy357 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy357o=>c3h7cho+cy357j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy357j=>cy357ja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy357j=>cy357jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy357ja=>mp3oxo+c3h5-a 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy357ja=>c3h5cho+me2j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy357jb=>mb3d+ch2cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy357jb=>c2h3oc2h3+me2j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy358oxo=mdcy358o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy358o=>c2h5+cy358 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy358o=>c2h5cho+c2h4+cy356j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy359oxo=mdcy359o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy359o=>ch3+cy359 4.380E+16 -0.890 16530.0 !27b "Curran, 2006" sc4h9o=c2h5cho+ch3 mdcy359o=>ch3cho+c2h4+cy357j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy36moxo=mdcy36mo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy36mo=>ch2o+co2+cy36mj 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy36mj=>c2h4+cy36mja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy36mj=>cy36mjb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy36mjb=>c4h9cho+c4h7-14 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy36mjb=>c2h3c2h4cho+pc4h9 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy36mja=>c2h3oc2h3+nc3h7 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy36mja=>c2h3+c4h9cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy362oxo=mdcy362o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy362o=>ch3oco+cy362 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy362o=>me2oxo+cy362j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy362j=>cy362ja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy362j=>cy263jc 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy362ja=>c2h3oc2h3+pc4h9 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy362ja=>c6h12-1+ch2cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy364oxo=mdcy364o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy364o=>cy364ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy364o=>cy364jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy364ja=>pc4h9+cy364a 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy364ja=>c6h12-1+cy364jc 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy364jb=>mp3oxo+cy364jd 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy364jb=>ch3oco+cy364b 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy364jc=>mp3oxo+hco 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy364jc=>chocho+me2j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy364jd=>c3h5cho+nc3h7 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy364jd=>hco+c6h12-1 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy365oxo=mdcy365o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy365o=>cy365ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy365o=>cy365jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy365ja=>nc3h7+cy365a 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy365ja=>c4h9cho+cy356ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy365jb=>me2j+cy365b 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy365jb=>mb3d+cy365jd 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy365jd=>chocho+pc4h9 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy365jd=>c4h9cho+hco 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy367oxo=mdcy367o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy367o=>nc3h7+cy367 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy367o=>c3h7cho+cy367j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy367j=>cy357jb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy367j=>cy367jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy367jb=>ch3oco+c2h3c2h4cho 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy367jb=>mb3d+ch2cho 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy368oxo=mdcy368o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy368o=>c2h5+cy368 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy368o=>c2h5cho+cy368j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy368j=>cy346jc+c2h4 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy368j=>cy368jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy368jb=>mp3oxo+c4h7-14 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy368jb=>c2h3c2h4cho+me2j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy369oxo=mdcy369o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy369o=>ch3+cy369 4.380E+16 -0.890 16530.0 !27b "Curran, 2006" sc4h9o=c2h5cho+ch3 mdcy369o=>ch3cho+c2h4+cy367j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy36xoxo=mdcy36xo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy36xo=>ch2o+c2h4+cy368j 1.570E+21 -2.440 16840.0 !27b "Curran, 2006" pc4h9o=ch2o+nc3h7 ! h+mdcy37moxo=mdcy37mo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy37mo=>ch2o+co2+cy37mj 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy37mj=>cy37mja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy37mj=>cy37mjb+c2h4 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy37mja=>c2h3c3h6cho+nc3h7 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy37mja=>c3h7cho+c5h9-15 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy37mjb=>c2h3oc2h3+nc3h7 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy37mjb=>c5h10-1+ch2cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy372oxo=mdcy372o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy372o=>ch3oco+cy372 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy372o=>me2oxo+cy372j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy372j=>cy372ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy372j=>cy372jb+c2h4 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy372ja=>c2h3c3h6cho+c2h5 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy372ja=>c5h10-1+c2h4cho 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy372jb=>c2h3oc2h3+c2h5 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy372jb=>c3h7cho+c2h3 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy374oxo=mdcy374o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy374o=>cy374ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy374o=>c2h4+cy374jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy374ja=>mp3oxo+cy374jc 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy374ja=>ch3oco+cy374a 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy374jb=>c2h5+cy374b 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy374jb=>c3h7cho+ch3oco+c2h3cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy374jc=>c2h3c2h4cho+c2h5 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy374jc=>c5h10-1+ch2cho 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy375oxo=mdcy375o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy375o=>cy375ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy375o=>cy375jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy375ja=>nc3h7+cy375a 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy375ja=>c5h10-1+cy375jc 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy375jb=>me2j+cy375b 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy375jb=>mb3d+cy375jd 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy375jc=>mp3oxo+ch2cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy375jc=>choch2cho+me2j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy375jd=>choch2cho+nc3h7 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy375jd=>c3h7cho+ch2cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy376oxo=mdcy376o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy376o=>cy376ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy376o=>cy376jb+c2h4 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy376ja=>c2h5+cy376a 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy376ja=>c3h7cho+cy367jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy376jb=>mp3oxo+c2h5+c2h3cho 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy376jb=>ch3oco+cy376b 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy378oxo=mdcy378o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy378o=>c2h5+cy378 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy378o=>c2h5cho+cy378j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy378j=>c2h4+cy346jc 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy378j=>cy378jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy378jb=>mb3d+c2h4cho 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy378jb=>c2h3c3h6cho+ch3oco 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy379oxo=mdcy379o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy379o=>ch3+cy379 4.380E+16 -0.890 16530.0 !27b "Curran, 2006" sc4h9o=c2h5cho+ch3 mdcy379o=>ch3cho+cy379j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy379j=>c2h4+cy357jb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy379j=>cy379jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy379jb=>mp3oxo+c5h9-15 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy379jb=>c2h3c3h6cho+me2j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy37xoxo=mdcy37xo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy37xo=>ch2o+c2h4+cy378j 1.570E+21 -2.440 16840.0 !27b "Curran, 2006" pc4h9o=ch2o+nc3h7 ! h+mdcy452oxo=mdcy452o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy452o=>ch3oco+cy452 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy452o=>me2oxo+cy452j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy452j=>cy452ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy452j=>cy352jb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy452ja=>c5h11cho+c2h3 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy452ja=>c2h3cho+c5h11-1 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy453oxo=mdcy453o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy453o=>me2j+cy453 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy453o=>mp3oxo+cy453j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy453j=>c2h3cho+pc4h9 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy453j=>c5h11-1+cyc2h2o 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy456oxo=mdcy456o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy456o=>pc4h9+cy456 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy456o=>c4h9cho+cy456j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy456j=>cyc2h2o+mp3j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy456j=>c2h3cho+me2j 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy457oxo=mdcy457o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy457o=>nc3h7+cy457 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy457o=>c3h7cho+cy457j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy457j=>cy457ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy457j=>cy457jb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy457ja=>mb4oxo+c2h3 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy457ja=>c2h3cho+mp3j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy457jb=>c2h3oc2h3+me2j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy457jb=>mb4oxo+c2h3 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy458oxo=mdcy458o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy458o=>c2h5+cy458 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy458o=>c2h5cho+c2h4+cy456j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy459oxo=mdcy459o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy459o=>ch3+cy459 4.380E+16 -0.890 16530.0 !27b "Curran, 2006" sc4h9o=c2h5cho+ch3 mdcy459o=>ch3cho+c2h4+cy457j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy462oxo=mdcy462o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy462o=>ch3oco+cy462 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy462o=>me2oxo+cy462j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy462j=>cy362ja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy462j=>cy462jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy462jb=>c3h5cho+pc4h9 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy462jb=>c4h9cho+c3h5-a 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy463oxo=mdcy463o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy463o=>me2j+cy463 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy463o=>mp3oxo+cy463j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy463j=>cy26mja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy463j=>cy364jd 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy465oxo=mdcy465o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy465o=>cy465ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy465o=>cy465jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy465ja=>nc3h7+cy465a 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy465ja=>c4h9cho+cy456j 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy465jb=>me2j+cy465b 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy465jb=>mb4oxo+cy562j 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy467oxo=mdcy467o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy467o=>nc3h7+cy467 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy467o=>c3h7cho+cy467j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy467j=>cy457jb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy467j=>cy467jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy467jb=>mf4d+hco 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy467jb=>c3h5cho+me2j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy468oxo=mdcy468o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy468o=>c2h5+cy468 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy468o=>c2h5cho+cy468j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy468j=>cy468ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy468j=>cy468jb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy468ja=>mb4oxo+c3h5-a 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy468ja=>c3h5cho+mp3j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy468jb=>mf4d+ch2cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy468jb=>c2h3oc2h3+mp3j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy469oxo=mdcy469o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy469o=>ch3+cy469 4.380E+16 -0.890 16530.0 !27b "Curran, 2006" sc4h9o=c2h5cho+ch3 mdcy469o=>ch3cho+c2h4+cy467j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy46xoxo=mdcy46xo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy46xo=>ch2o+c2h4+cy468j 1.570E+21 -2.440 16840.0 !27b "Curran, 2006" pc4h9o=ch2o+nc3h7 ! h+mdcy472oxo=mdcy472o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy472o=>ch3oco+cy472 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy472o=>me2oxo+cy472j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy472j=>cy472ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy472j=>c2h4+cy372jb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy472ja=>c2h3c2h4cho+nc3h7 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy472ja=>c3h7cho+c4h7-14 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy473oxo=mdcy473o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy473o=>me2j+cy473 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy473o=>mp3oxo+cy473j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy473j=>cy374jc 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy473j=>cy37mjb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy475oxo=mdcy475o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy475o=>cy475ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy475o=>cy475jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy475ja=>mb4oxo+cy475jc 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy475ja=>me2j+cy475a 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy475jb=>nc3h7+cy475b 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy475jb=>c5h10-1+cy475jd 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy475jc=>c3h5cho+c2h5 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy475jc=>c5h10-1+hco 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy475jd=>mb4oxo+hco 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy475jd=>chocho+mp3j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy476oxo=mdcy476o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy476o=>cy476ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy476o=>cy476jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy476ja=>c2h5+cy476a 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy476ja=>c3h7cho+cy476jc 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy476jb=>mf4d+cy476jd 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy476jb=>mp3j+cy476b 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy476jc=>mf4d+hco 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy476jc=>me2j+c3h5cho 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy476jd=>nc3h7+chocho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy476jd=>hco+c3h7cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy478oxo=mdcy478o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy478o=>c2h5+cy478 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy478o=>c2h5cho+cy478j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy478j=>cy478ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy478j=>cy468jb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy478ja=>mf4d+ch2cho 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy478ja=>c2h3c2h4cho+me2j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy479oxo=mdcy479o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy479o=>ch3+cy479 4.380E+16 -0.890 16530.0 !27b "Curran, 2006" sc4h9o=c2h5cho+ch3 mdcy479o=>ch3cho+cy479j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy479j=>cy479ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy479j=>cy457jb+c2h4 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy479ja=>mb4oxo+c4h7-14 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy479ja=>c2h3c2h4cho+mp3j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy47xoxo=mdcy47xo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy47xo=>ch2o+c2h4+cy478j 1.570E+21 -2.440 16840.0 !27b "Curran, 2006" pc4h9o=ch2o+nc3h7 ! h+mdcy482oxo=mdcy482o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy482o=>ch3oco+cy482 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy482o=>me2oxo+cy482j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy482j=>cy482ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy482j=>c2h4+cy372jb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy482ja=>c2h3c3h6cho+c2h5 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy482ja=>c2h5cho+c5h9-15 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy483oxo=mdcy483o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy483o=>me2j+cy483 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy483o=>mp3oxo+cy483j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy483j=>cy483ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy483j=>c2h4+cy483jb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy483ja=>c2h3c3h6cho+ch3 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy483ja=>c4h8-1+c2h4cho 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy483jb=>c2h3oc2h3+ch3 4.790E+10 1.040 30360.0 !27b "Curran, 2006" sc4h9o=c3h6+ch3 cy483jb=>c2h5cho+c2h3 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy485oxo=mdcy485o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy485o=>cy485ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy485o=>c2h4+cy485jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy485ja=>mb4oxo+cy485jc 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy485ja=>me2j+cy485c 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy485jb=>ch3+cy485d 4.790E+10 1.040 30360.0 !27b "Curran, 2006" sc4h9o=c3h6+ch3 cy485jb=>c2h5cho+c2h3cho+me2j 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy485jc=>c2h3c2h4cho+ch3 4.790E+10 1.040 30360.0 !27b "Curran, 2006" sc4h9o=c3h6+ch3 cy485jc=>c4h8-1+ch2cho 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy486oxo=mdcy486o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy486o=>cy486ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy486o=>cy486jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy486ja=>c2h5+cy486a 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy486ja=>c4h8-1+cy486jc 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy486jb=>mf4d+cy486jd 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy486jb=>mp3j+cy486b 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy486jc=>mb4oxo+ch2cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy486jc=>choch2cho+mp3j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy486jd=>choch2cho+c2h5 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy486jd=>c2h5cho+ch2cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy487oxo=mdcy487o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy487o=>cy487ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy487o=>cy487jb+c2h4 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy487ja=>ch3+cy487a 4.790E+10 1.040 30360.0 !27b "Curran, 2006" sc4h9o=c3h6+ch3 cy487ja=>c2h5cho+cy478ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy487jb=>mb4oxo+ch3+c2h3cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy487jb=>me2j+cy487b 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy489oxo=mdcy489o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy489o=>ch3+cy489 4.380E+16 -0.890 16530.0 !27b "Curran, 2006" sc4h9o=c2h5cho+ch3 mdcy489o=>ch3cho+cy489j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy489j=>cy489ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy489j=>cy457jb+c2h4 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy489ja=>mf4d+c2h4cho 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy489ja=>c2h3c3h6cho+me2j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy48xoxo=mdcy48xo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy48xo=>ch2o+cy4810j 1.570E+21 -2.440 16840.0 !27b "Curran, 2006" pc4h9o=ch2o+nc3h7 cy4810j=>cy4810ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy4810j=>cy468jb+c2h4 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy4810ja=>mb4oxo+c5h9-15 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy4810ja=>c2h3c3h6cho+mp3j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy562oxo=mdcy562o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy562o=>ch3oco+cy562 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy562o=>me2oxo+c2h4+cy562j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy562j=>pc4h9+cyc2h2o 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy562j=>c2h3cho+nc3h7 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy563oxo=mdcy563o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy563o=>me2j+cy563 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy563o=>mp3oxo+cy563j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy563j=>cy26mja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy563j=>cy563jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy563jb=>c4h9cho+c2h3 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy563jb=>c2h3cho+pc4h9 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy564oxo=mdcy564o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy564o=>mp3j+cy564 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy564o=>mb4oxo+cy562j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy567oxo=mdcy567o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy567o=>c3h7cho+cy567j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy567o=>nc3h7+cy567 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy567j=>cyc2h2o+mb4j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy567j=>c2h3cho+mp3j 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy568oxo=mdcy568o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy568o=>c2h5+cy568 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy568o=>c2h5cho+cy568j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy568j=>cy568ja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy568j=>cy568jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy568ja=>mf5oxo+c2h3 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy568ja=>c2h3oc2h3+mp3j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy568jb=>mf5oxo+c2h3 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy568jb=>c2h3cho+mb4j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy569oxo=mdcy569o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy569o=>ch3+cy569 4.380E+16 -0.890 16530.0 !27b "Curran, 2006" sc4h9o=c2h5cho+ch3 mdcy569o=>ch3cho+c2h4+cy567j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy56xoxo=mdcy56xo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy56xo=>ch2o+c2h4+cy568j 1.570E+21 -2.440 16840.0 !27b "Curran, 2006" pc4h9o=ch2o+nc3h7 ! h+mdcy572oxo=mdcy572o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy572o=>ch3oco+cy572 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy572o=>me2oxo+c2h4+cy572j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy572j=>cy475jc 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy572j=>cy572jb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy572jb=>c2h5+c2h3oc2h3 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy572jb=>c3h7cho+c2h3 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy573oxo=mdcy573o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy573o=>me2j+cy573 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy573o=>mp3oxo+cy573j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy573j=>cy573ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy573j=>cy37mjb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy573ja=>c3h5cho+nc3h7 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy573ja=>c3h7cho+c3h5-a 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy574oxo=mdcy574o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy574o=>mp3j+cy574 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy574o=>mb4oxo+cy572j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy576oxo=mdcy576o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy576o=>cy576ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy576o=>cy576jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy576ja=>c2h5+cy576a 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy576ja=>c3h7cho+cy567j 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy576jb=>mf5oxo+cy673j 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy576jb=>mp3j+cy576b 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy578oxo=mdcy578o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy578o=>c2h5+cy578 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy578o=>c2h5cho+cy578j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy578j=>cy578ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy578j=>cy568ja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy578ja=>mh5d+hco 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy578ja=>c3h5cho+mp3j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy579oxo=mdcy579o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy579o=>ch3+cy579 4.380E+16 -0.890 16530.0 !27b "Curran, 2006" sc4h9o=c2h5cho+ch3 mdcy579o=>ch3cho+cy579j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy579j=>cy579ja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy579j=>cy579jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy579ja=>c2h3oc2h3+mb4j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy579ja=>mh5d+ch2cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy579jb=>mf5oxo+c3h5-a 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy579jb=>c3h5cho+mb4j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy57xoxo=mdcy57xo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy57xo=>ch2o+c2h4+cy578j 1.570E+21 -2.440 16840.0 !27b "Curran, 2006" pc4h9o=ch2o+nc3h7 ! h+mdcy582oxo=mdcy582o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy582o=>ch3oco+cy582 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy582o=>me2oxo+c2h4+cy582j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy582j=>cy582ja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy582j=>cy485jc 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy582ja=>c2h3oc2h3+c2h5 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy582ja=>c4h8-1+ch2cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy583oxo=mdcy583o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy583o=>me2j+cy583 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy583o=>mp3oxo+cy583j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy583j=>c2h4+cy483jb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy583j=>cy583jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy583jb=>c2h3c2h4cho+c2h5 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy583jb=>c2h5cho+c4h7-14 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy584oxo=mdcy584o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy584o=>mp3j+cy584 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy584o=>mb4oxo+cy582j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy586oxo=mdcy586o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy586o=>cy586ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy586o=>cy586jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy586ja=>c2h5+cy586a 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy586ja=>c4h8-1+cy586jc 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy586jb=>mf5oxo+cy586jd 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy586jb=>mp3j+cy586b 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy586jc=>mf5oxo+hco 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy586jc=>chocho+mb4j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy586jd=>c3h5cho+ch3 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy586jd=>c4h8-1+hco 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy587oxo=mdcy587o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy587o=>cy587ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy587o=>cy587jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy587ja=>mh5d+cy587jc 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy587ja=>mb4j+cy587a 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy587jb=>ch3+cy587b 4.790E+10 1.040 30360.0 !27b "Curran, 2006" sc4h9o=c3h6+ch3 cy587jb=>c2h5cho+cy578ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy587jc=>c2h5cho+hco 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy587jc=>chocho+c2h5 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy589oxo=mdcy589o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy589o=>ch3+cy589 4.380E+16 -0.890 16530.0 !27b "Curran, 2006" sc4h9o=c2h5cho+ch3 mdcy589o=>ch3cho+cy589j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy589j=>cy579ja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy589j=>cy589jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy589jb=>mh5d+ch2cho 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy589jb=>c2h3c2h4cho+mp3j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy58xoxo=mdcy58xo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy58xo=>ch2o+cy5810j 1.570E+21 -2.440 16840.0 !27b "Curran, 2006" pc4h9o=ch2o+nc3h7 cy5810j=>c2h4+cy568ja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy5810j=>cy5810jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy5810jb=>mf5oxo+c4h7-14 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy5810jb=>c2h3c2h4cho+mb4j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy592oxo=mdcy592o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy592o=>ch3oco+cy592 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy592o=>me2oxo+c2h4+cy592j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy592j=>cy592ja+c2h4 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy592j=>cy592jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy592ja=>ch3cho+c2h3 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy592jb=>c3h6+c2h4cho 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy593oxo=mdcy593o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy593o=>me2j+cy593 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy593o=>mp3oxo+cy593j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy593j=>c2h4+cy593ja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy593j=>cy593jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy593ja=>c2h3oc2h3+ch3 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy593ja=>c3h6+ch2cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy593jb=>c2h3c3h6cho+ch3 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy593jb=>ch3cho+c5h9-15 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy594oxo=mdcy594o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy594o=>mp3j+cy594 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy594o=>mb4oxo+cy592j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy596oxo=mdcy596o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy596o=>cy596ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy596o=>cy596jb+c2h4 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy596ja=>mf5oxo+cy596jc 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy596ja=>mp3j+cy596a 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy596jb=>ch3cho+cy567j 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy596jc=>c3h6+ch2cho 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy597oxo=mdcy597o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy597o=>cy597ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy597o=>cy597jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy597ja=>ch3+cy597a 4.790E+10 1.040 30360.0 !27b "Curran, 2006" sc4h9o=c3h6+ch3 cy597ja=>c3h6+cy597jc 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy597jb=>mh5d+cy597jd 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy597jb=>mb4j+cy597b 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy597jc=>mf5oxo+ch2cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy597jc=>choch2cho+mb4j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy597jd=>choch2cho+ch3 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy597jd=>ch3cho+ch2cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy598oxo=mdcy598o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy598o=>cy598ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy598o=>cy598jb+c2h4 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy598ja=>ch3cho+cy589jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy598jb=>mf5oxo+c2h3cho+h 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy598jb=>mb4j+cy598 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy59xoxo=mdcy59xo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy59xo=>ch2o+cy5910j 1.570E+21 -2.440 16840.0 !27b "Curran, 2006" pc4h9o=ch2o+nc3h7 cy5910j=>cy568ja+c2h4 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy5910j=>cy5910jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy5910jb=>mh5d+c2h4cho 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy5910jb=>c2h3c3h6cho+mp3j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy672oxo=mdcy672o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy672o=>ch3oco+cy672 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy672o=>me2oxo+cy672j+c2h4 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy672j=>cy672ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy672j=>cy372jb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy672ja=>c2h3cho+nc3h7 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy672ja=>c3h7cho+c2h3 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy673oxo=mdcy673o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy673o=>me2j+cy673 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy673o=>mp3oxo+c2h4+cy673j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy673j=>nc3h7+cyc2h2o 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy673j=>c2h3cho+c2h5 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy674oxo=mdcy674o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy674o=>mp3j+cy674 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy674o=>mb4oxo+cy672j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy675oxo=mdcy675o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy675o=>mb4j+cy675 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy675o=>mf5oxo+cy673j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy678oxo=mdcy678o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy678o=>c2h5+cy678 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy678o=>c2h5cho+cy678j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy678j=>cyc2h2o+mf5j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy678j=>c2h3cho+mb4j 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy679oxo=mdcy679o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy679o=>ch3+cy679 4.380E+16 -0.890 16530.0 !27b "Curran, 2006" sc4h9o=c2h5cho+ch3 mdcy679o=>ch3cho+cy679j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy679j=>cy679ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy679j=>cy679jb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy679ja=>mh6oxo+c2h3 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy679ja=>c2h3cho+mf5j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy679jb=>mh6oxo+c2h3 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy679jb=>c2h3oc2h3+mb4j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy67xoxo=mdcy67xo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy67xo=>ch2o+c2h4+cy678j 1.570E+21 -2.440 16840.0 !27b "Curran, 2006" pc4h9o=ch2o+nc3h7 ! h+mdcy682oxo=mdcy682o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy682o=>ch3oco+cy682 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy682o=>me2oxo+c2h4+cy682j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy682j=>cy582ja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy682j=>cy682jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy682jb=>c3h5cho+c2h5 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy682jb=>c2h5cho+c3h5-a 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy683oxo=mdcy683o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy683o=>me2j+cy683 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy683o=>mp3oxo+c2h4+cy683j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy683j=>cy483jb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy683j=>cy586jd 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy684oxo=mdcy684o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy684o=>mp3j+cy684 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy684o=>mb4oxo+cy682j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy685oxo=mdcy685o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy685o=>mb4j+cy685 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy685o=>mf5oxo+cy683j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy687oxo=mdcy687o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy687o=>cy687ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy687o=>cy687jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy687ja=>ch3+cy687 4.790E+10 1.040 30360.0 !27b "Curran, 2006" sc4h9o=c3h6+ch3 cy687ja=>c2h5cho+c2h3cho+mb4j 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy687jb=>mh6oxo+cy784j 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy687jb=>mb4j+cy687b 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy689oxo=mdcy689o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy689o=>ch3+cy689 4.380E+16 -0.890 16530.0 !27b "Curran, 2006" sc4h9o=c2h5cho+ch3 mdcy689o=>ch3cho+cy689j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy689j=>cy679jb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy689j=>cy689jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy689jb=>ms6d+hco 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy689jb=>c3h5cho+mb4j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy68xoxo=mdcy68xo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy68xo=>ch2o+cy6810j 1.570E+21 -2.440 16840.0 !27b "Curran, 2006" pc4h9o=ch2o+nc3h7 cy6810j=>cy6810ja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy6810j=>cy6810jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy6810ja=>ms6d+ch2cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy6810ja=>c2h3oc2h3+mf5j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy6810jb=>mh6oxo+c3h5-a 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy6810jb=>c3h5cho+mf5j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy692oxo=mdcy692o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy692o=>ch3oco+cy692 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy692o=>me2oxo+c2h4+cy692j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy692j=>cy692ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy692j=>c2h4+cy592ja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy692ja=>ch3+c2h3c2h4cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy692ja=>ch3cho+c4h7-14 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy693oxo=mdcy693o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy693o=>me2j+cy693 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy693o=>mp3oxo+c2h4+cy693j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy693j=>c3h6+ch2cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy693j=>cy593ja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy694oxo=mdcy694o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy694o=>mp3j+cy694 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy694o=>mb4oxo+cy692j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy695oxo=mdcy695o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy695o=>mb4j+cy695 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy695o=>mf5oxo+cy693j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy697oxo=mdcy697o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy697o=>cy697ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy697o=>cy697jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy697ja=>ch3+cy697a 4.790E+10 1.040 30360.0 !27b "Curran, 2006" sc4h9o=c3h6+ch3 cy697ja=>c3h6+cy697jc 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy697jb=>mh6oxo+c3h6+hco 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy697jb=>mb4j+cy697b 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy697jc=>mh6oxo+hco 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy697jc=>chocho+mf5j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy698oxo=mdcy698o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy698o=>cy698ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy698o=>cy698jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy698ja=>ch3cho+cy689jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy698jb=>ms6d+cy698jd 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy698jb=>mf5j+cy698 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy698jd=>chocho+ch3 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy698jd=>ch3cho+hco 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy69xoxo=mdcy69xo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy69xo=>ch2o+cy6910j 1.570E+21 -2.440 16840.0 !27b "Curran, 2006" pc4h9o=ch2o+nc3h7 cy6910j=>cy6910ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy6910j=>cy6810ja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy6910ja=>ms6d+ch2cho 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy6910ja=>c2h3c2h4cho+mb4j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy702oxo=mdcy702o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy702o=>ch3oco+cy702 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy702o=>me2oxo+c2h4+cy702j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy702j=>ch2o+c5h9-15 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy702j=>c2h4+c2h4+ch2cho 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy703oxo=mdcy703o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy703o=>me2j+cy703 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy703o=>mp3oxo+c2h4+cy703j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy703j=>c2h4+c2h4+hco 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy703j=>c2h4+ch2o+c2h3 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy704oxo=mdcy704o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy704o=>mp3j+cy704 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy704o=>mb4oxo+cy702j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy705oxo=mdcy705o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy705o=>mb4j+cy705 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy705o=>mf5oxo+cy703j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy707oxo=mdcy707o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy707o=>cy707ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy707o=>c2h4+ch2o+c2h3cho+mb4j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy707ja=>mb4j+cy707 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy707ja=>mh6oxo+c2h4+ch2cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy708oxo=mdcy708o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy708o=>c2h4+cy708ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy708o=>cy708jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy708ja=>mh6oxo+ch2cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy708ja=>choch2cho+mf5j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy708jb=>ms6d+ch2o+ch2cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy708jb=>mf5j+cy708 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy709oxo=mdcy709o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy709o=>c2h4+cy709ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy709o=>ch2o+cy6910ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy709ja=>mh6oxo+ch2cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy709ja=>mb4j+cy709 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy783oxo=mdcy783o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy783o=>me2j+cy783 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy783o=>mp3oxo+c2h4+cy783j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy783j=>cy483jb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy783j=>cy783jb 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy783jb=>c2h3cho+c2h5 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy783jb=>c2h5cho+c2h3 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy784oxo=mdcy784o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy784o=>mp3j+cy784 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy784o=>mb4oxo+c2h4+cy784j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy784j=>c2h5+cyc2h2o 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy784j=>c2h3cho+ch3 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy785oxo=mdcy785o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy785o=>mb4j+cy785 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy785o=>mf5oxo+cy783j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy786oxo=mdcy786o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy786o=>mf5j+cy786 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy786o=>mh6oxo+cy784j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy789oxo=mdcy789o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy789o=>ch3+cy789 4.380E+16 -0.890 16530.0 !27b "Curran, 2006" sc4h9o=c2h5cho+ch3 mdcy789o=>ch3cho+cy789j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy789j=>c2h3cho+mf5j 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy789j=>cyc2h2o+mh6j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy78xoxo=mdcy78xo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy78xo=>ch2o+cy7810j 1.570E+21 -2.440 16840.0 !27b "Curran, 2006" pc4h9o=ch2o+nc3h7 cy7810j=>cy7810ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy7810j=>cy7810jb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy7810ja=>ms7oxo+c2h3 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy7810ja=>c2h3cho+mh6j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy7810jb=>ms7oxo+c2h3 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy7810jb=>c2h3oc2h3+mf5j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy793oxo=mdcy793o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy793o=>me2j+cy793 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy793o=>mp3oxo+c2h4+cy793j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy793j=>cy793ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy793j=>cy593ja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy793ja=>c3h5cho+ch3 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy793ja=>ch3cho+c3h5-a 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy794oxo=mdcy794o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy794o=>mp3j+cy794 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy794o=>mb4oxo+c2h4+cy794j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy794j=>c3h6+hco 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy794j=>cy592ja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy795oxo=mdcy795o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy795o=>mb4j+cy795 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy795o=>mf5oxo+cy793j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy796oxo=mdcy796o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy796o=>mf5j+cy796 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy796o=>mh6oxo+cy794j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy798oxo=mdcy798o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy798o=>ch3cho+cy789j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy798o=>cy798j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy798j=>ms7oxo+c2h3cho+h 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy798j=>mf5j+cy798 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy79xoxo=mdcy79xo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy79xo=>ch2o+cy7910j 1.570E+21 -2.440 16840.0 !27b "Curran, 2006" pc4h9o=ch2o+nc3h7 cy7910j=>cy7910ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy7910j=>cy7810jb 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy7910ja=>mo7d+hco 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy7910ja=>c3h5cho+mf5j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy803oxo=mdcy803o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy803o=>me2j+cy803 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy803o=>mp3oxo+c2h4+cy803j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy803j=>ch2o+c2h4+c2h3 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 duplicate cy803j=>c2h4+ch2o+c2h3 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o duplicate ! h+mdcy804oxo=mdcy804o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy804o=>mp3j+cy804 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy804o=>mb4oxo+c2h4+cy804j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy804j=>c2h4+ch2cho 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 duplicate cy804j=>c2h4+ch2cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o duplicate ! h+mdcy805oxo=mdcy805o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy805o=>mb4j+cy805 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy805o=>mf5oxo+cy803j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy806oxo=mdcy806o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy806o=>mf5j+cy806 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy806o=>mh6oxo+cy804j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy808oxo=mdcy808o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy808o=>cy808ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy808o=>c2h4+cy808jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy808ja=>ms7oxo+c2h4cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy808ja=>mf5j+cy808 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy808jb=>ms7oxo+hco 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy808jb=>chocho+mh6j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy809oxo=mdcy809o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy809o=>ch2o+cy7910ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy809o=>cy809jb 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy809jb=>mo7d+ch2o+hco 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy809jb=>mh6j+cy809 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy894oxo=mdcy894o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy894o=>mp3j+cy894 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy894o=>mb4oxo+c2h4+cy894j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy894j=>cy592ja 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy894j=>cy894ja 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy894ja=>c2h3cho+ch3 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy894ja=>ch3cho+c2h3 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy895oxo=mdcy895o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy895o=>mb4j+cy895 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy895o=>mf5oxo+c2h4+cy895j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy895j=>ch3+cyc2h2o 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy895j=>c2h3cho+h 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy896oxo=mdcy896o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy896o=>mf5j+cy896 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy896o=>mh6oxo+cy894j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy897oxo=mdcy897o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy897o=>mh6j+cy897 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy897o=>ms7oxo+cy895j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy89xoxo=mdcy89xo 4.000E+12 0.000 06260.0 !27b "Curran, 2006" c2h5cho+h=nc3h7o mdcy89xo=>ch2o+cy8910j 1.570E+21 -2.440 16840.0 !27b "Curran, 2006" pc4h9o=ch2o+nc3h7 cy8910j=>cyc2h2o+ms7j 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy8910j=>c2h3cho+mh6j 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy904oxo=mdcy904o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy904o=>mp3j+cy904 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy904o=>mb4oxo+c2h4+cy904j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy904j=>ch2o+c3h5-a 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 cy904j=>c2h4+ch2cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o ! h+mdcy905oxo=mdcy905o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy905o=>mb4j+cy905 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy905o=>mf5oxo+c2h4+cy905j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy905j=>c2h4cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy905j=>ch2o+c2h3 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 c2h4+hco=c2h4cho 1.320E+04 2.480 06130.0 !27b "Curran, 2006" c2h4+c2h5=pc4h9 ! h+mdcy906oxo=mdcy906o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy906o=>mf5j+cy906 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy906o=>mh6oxo+cy904j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy907oxo=mdcy907o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy907o=>mh6j+cy907 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy907o=>ms7oxo+cy905j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy909oxo=mdcy909o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy909o=>cy909ja 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy909o=>ch2o+c2h3cho+mh6j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy909ja=>mo8oxo+ch2cho 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o cy909ja=>mh6j+cy909 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 ! h+mdcy9x5oxo=mdcy9x5o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy9x5o=>mb4j+cy1005 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy9x5o=>mf5oxo+c2h4+cy1005j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 cy1005j=>ch2o+c2h3 1.220E+12 0.640 29370.0 !27b "Curran, 2007" 2c5h11=c2h5+c3h6 duplicate cy1005j=>ch2o+c2h3 4.384E+19 -2.010 25190.0 !27b Huge Mechanism ch3och2o=ch3o+ch2o duplicate ! h+mdcy9x6oxo=mdcy9x6o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy9x6o=>mf5j+cy1006 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy9x6o=>mh6oxo+c2h4+ch2cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy9x7oxo=mdcy9x7o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy9x7o=>mh6j+cy1007 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy9x7o=>ms7oxo+cy1005j 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! h+mdcy9x8oxo=mdcy9x8o 2.000E+12 0.000 07270.0 !27b "Curran, 2006" ch3coch3+h=ic3h7o mdcy9x8o=>ms7j+cy1008 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 mdcy9x8o=>mo8oxo+ch2cho 5.510E+22 -2.760 13980.0 !27b "Curran, 2006" sc4h9o=ch3cho+c2h5 ! ! ! end ! ! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !! C4/Reactions of C4 species !! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! ! !C4-1/Unimolecular Initiations ! ! !C4-2/H-atom abstractions ! ! !C4-3/Decompositions !Radicals from Additions ! ! !C4-4/High temperature direct abstraction (not in the Huge Mechanism) ! ! !C4-5/Isomerizations ! ! !C4-6/H-atom abstraction from olefins ! ! !C4-7/Additions ! ! !C4-8/Decomposiitons and isomerizations ! !Isomerizations ! ! !C4-9/Unimolecular Initiations and Molecular Decompositions ! !Retroene ! ! !C4-10/First Addition to o2 ! ! !C4-11/R+R'O2=RO+R'O ! ! !C4-11b/RO2+H=ROOH ! ! !C4-12-I/Isomerization to QOOH ! ! !C4-12-II/RO2=olefin+HO2 ! ! !C4-12-III/RO2=aldehyde+OH ! ! !C4-13/RO2+HO2=ROOH+O2 ! ! !C4-14/RO2+H2O2=ROOH+HO2 ! ! !C4-15/RO2+CH3O2=RO+CH3O+O2 ! ! !C4-16/RO2+R'O2=RO+R'O+O2 ! ! !C4-17/ROOH=RO+OH ! ! !C4-18/RO decomposition ! ! !C4-19/Decomposiiton to Cyclic Ethers ! ! !C4-20-I/qooh = olefin + ho2 ! ! !C4-21/qooh=olefin+carbonyl+oh ! ! !C4-22-QOOH+O2=OOQOOH ! ! !C4-23/OOQOOH isomerization to ketohydroperoxyde + oh ! ! !C4-23a/OOQOOH to alkeneooh + ho2 ! ! !C4-23b/OOQOOH to HOOQOOH !except when HOOQOOH leads to a keto compounds + oh (see reaction type 23) ! ! !C4-23c/HOOQOOH to olefinHP + ho2 ! ! !C4-23d/HOOQOOH to HP cyclic ether + OH ! ! !C4-24/hydroperoxyketone decomposition ! ! !C4-24b/Decomposition of the radicals from reaction type 24 ! ! !C4-25/Decomposition of cyclic ethers ! ! !C4-25b/decomposition of radicals from reaction type 25 ! ! !C4-26/mdxdyooh decomposition to mdxdyo + OH ! ! !C4-26b/Decomposition of the radicals from reaction type 26 ! ! !C4-27/hydroperoxy cyclic ether to alkoxy cyclic ether ! ! !C4-27b/decomposition reactions of radicals from reaction type 27 ! ! ! !