!=========================================================================== ! Kinetic model A17 (v1.0 - 2021) !=========================================================================== !A.S. Semenikhin, I.V. Chechet, S.G. Matveev, S.S. Matveev, A.S. Savchenkova !========================================================================== ! SEC FDR Samara University 2021 !========================================================================== ELEMENTS AR C H HE N O END SPECIES AR N2 HE H O OH HO2 H2 H2O H2O2 O2 CH2* CH3 CH4 HCO CH2O CH3O CO CO2 C2H2 H2CC C2H3 C2H4 C2H5 C2H6 HCCO CH2CO CH3CO CH2CHO C3H3 pC3H4 aC3H4 aC3H5 CH3CCH2 C3H6 nC3H7 C2H3CHO CH3CHOCH2 CH3CH2CHO C4H4 iC4H5 C4H6 C4H6-2 C4H7 C4H81 pC4H9 cC5H9 cC5H8 SXC12H25 C12H24 PXC12H23 C11H22 PXC11H21 NC10H22 PXC10H21 SXC10H21 C10H20 PXC10H19 NC9H20 PXC9H19 SXC9H19 C9H18 PXC9H17 NC8H18 PXC8H17 C8H16 PXC8H15 NC7H16 PXC7H15 C7H14 PXC7H13 PXC6H13 SXC6H13 C6H12 PXC6H11 SAXC6H11 cC6H11 cC6H10 PXC5H11 C5H10 PXC5H9 S4XC12H25 S5XC12H25 S2XC11H23 S4XC11H23 S5XC11H23 S2XC10H21 S3XC10H21 S4XC10H21 S2XC9H19 S3XC9H19 S4XC9H19 S2XC8H17 S3XC8H17 S2XC7H15 S3XC7H15 S2XC6H13 P12OOHX2 C4H9cC6H11 C10H20-5 C4H9-2-1C6H11 PXC4H8cC6H11 SXC4H8cC6H11 S2XC4H8cC6H11 S3XC4H8cC6H11 C4H9TXcC6H10 C4H9S2XcC6H10 C4H9S3XcC6H10 C4H9S4XcC6H10 PXC4H8-2-1C6H11 PX10-5C10H19 PXC3H6-3-1C7H13 S4XC10H19 SAX4-5C10H19 SAXC10H19 C3H7cC6H11 C9H18-4 C3H7-2-1C6H11 PXC3H6cC6H11 S2XC3H6cC6H11 C3H7S2XcC6H10 C3H7S3XcC6H10 C3H7TXcC6H10 C3H7S4XcC6H10 PX9-3C9H17 PX9-4C9H17 C3H7-2-PXC6H10 PXC3H6-3-1C6H11 SAX6-4C9H17 C2H5TXcC6H10 SAXC8H15 PX1-3C8H15 PXCH2-3-1C7H13 C2H3cC6H11 C8H14-13 CH3cC6H11 C7H14-2 CH3-2-1C6H11 PXCH2cC6H11 CH3TXcC6H10 CH3S2XcC6H10 CH3-2-PXC6H10 CH3S4XcC6H10 CH3-3-PXC6H10 SXC7H13 SAXC7H13 PXCH2-5-1C6H11 CH3-3-TAXC6H10 PAXCH2-2-1C6H11 PX1-3C7H13 PXCH2-3-1C6H11 CH2cC6H10 cC6H12 CH3-2-PXC4H6 CH3-2-C4H5-13 CH3cC6H10OO CH3cC6H9OOH C4H9cC6H10OO C CH3O2 CH3OH C2H CH3CHO C2H5O C3H2 C3H2O C3H5O C3H8 C4H C4H2 C4H2O C5H4O C5H5 C5H5O C5H6 C6H2 O-C6H4 OC6H4O A1- A1O A1OH C6H12O OC6H11OOH C6H13O C6H13O4 N-C6H14 A1CHO A1CH3 HOA1CH3 C7H14O OC7H13OOH C7H15O C7H15O4 C8H2 A1C2H* A1C2H A1CHOCHO A1CHOCH2 A1C2H3 A1CH3CHO C8H16O C8H16O3 D-C8H17O C8H17O4 C9H6O C9H7 C9H8 A2O A2 A2OH A2CHO A2CH2 A2CH2O A2CH3 P2 C12H24O C12H24O3 C12H25O C12H25O4 NC12H26 A2R5C2H* A2R5C2H A3 A4R5 S-C3H5 S-C4H6 Y-C7H14 C7H15 Y-C7H15 C-C8H17 T-CH2 CH2OH I-C3H7 N-C4H5 S-C4H5 T-C4H7 T-C4H8 T-C4H9 C12H25O2 S-OH S-CH CH I-C4H3 N-C4H3 C6H6 C5H4CH2 C6H12OOH C6H13O2 A1CH2 A1CH3* A1CH2O OA1CH3 C7H14OOH C7H15O2 A1C2H3* A1C2H2 A1CH3CH2 A1C2H4 A1CH3CH3 A1C2H5 C8H16OOH C8H17O2 A2* A2- A2C2HB* A2C2HA* A2R5- A2C2HA A2R5 A2C2HB A2C2H2B A2C2H2A P2- A3- A2R5C2H2 A3* A4- A3R5- A4 A3R5 FLTN HCN HCNN H2CN CN NCO NH HNO NNH NH2 NH3 N NO NO2 N2O HCCOH HOCN HCNO HNCO HCO3 C3H5OO IC3H5CHO C5H7 BZFUR IC16H33 IC16-OOQOOH IC16H34 C3H5OH SC4H7 C2H4O NC5H10 C4H8O C4H7OH CH3CHCHOHCH3 CH3CCH2OHCH3 IC4P-QOOH IC4T-QOOH IC4H9T-OO NEOC5H11-OO NEOC5-QOOH NC5-QOOH IC16-QOOH IC16H33-OO C10H10 RTETRALIN TETRALIN CH3C10H6OH DIBZFUR BIN1A C10H6CH3 C5H3 C5H4 A3C2H2 CHRYSEN c-C4H5 A1C2HC2H2 A1C2HC2H2u BIPHEN A4-2 A4-4 A3C2H-2JS A3C2H A3C2H-2 PYC2H-1 PYC2H-2 PYC2H-4 PYC2H-2JS PYC2H-1JP PYC2H-4JS CHRYSENJ4 CHRYSENJ1 CHRYSENJ5 BEPYRENJS BAPYRJS BEPYREN BAPYR BGHIPEJS1 ANTHANJS ANTHAN BGHIPER END THERMO ALL 300.00 1000.00 5000.00 AR AR 1 G 300.00 5000.00 1000.00 1 2.50000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 2 -7.45375000E+02 4.36600000E+00 2.50000000E+00 0.00000000E+00 0.00000000E+00 3 0.00000000E+00 0.00000000E+00-7.45375000E+02 4.36600000E+00 4 N2 N 2 G 300.00 5000.00 1000.00 1 2.92664000E+00 1.48797680E-03-5.68476000E-07 1.00970380E-10-6.75335100E-15 2 -9.22797700E+02 5.98052800E+00 3.29867700E+00 1.40824040E-03-3.96322200E-06 3 5.64151500E-09-2.44485400E-12-1.02089990E+03 3.95037200E+00 4 HE HE 1 G 200.00 6000.00 1000.00 1 2.50000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 2 -7.45375000E+02 9.28723974E-01 2.50000000E+00 0.00000000E+00 0.00000000E+00 3 0.00000000E+00 0.00000000E+00-7.45375000E+02 9.28723974E-01 4 H H 1 G 200.00 3500.00 1000.00 1 2.50000001E+00-2.30842973E-11 1.61561948E-14-4.73515235E-18 4.98197357E-22 2 2.54736599E+04-4.46682914E-01 2.50000000E+00 7.05332819E-13-1.99591964E-15 3 2.30081632E-18-9.27732332E-22 2.54736599E+04-4.46682853E-01 4 O O 1 G 200.00 3500.00 1000.00 1 2.56942078E+00-8.59741137E-05 4.19484589E-08-1.00177799E-11 1.22833691E-15 2 2.92175791E+04 4.78433864E+00 3.16826710E+00-3.27931884E-03 6.64306396E-06 3 -6.12806624E-09 2.11265971E-12 2.91222592E+04 2.05193346E+00 4 OH H 1O 1 G 200.00 6000.00 1000.00 1 2.86472886E+00 1.05650448E-03-2.59082758E-07 3.05218674E-11-1.33195876E-15 2 3.71885774E+03 5.70164073E+00 4.12530561E+00-3.22544939E-03 6.52764691E-06 3 -5.79853643E-09 2.06237379E-12 3.38153812E+03-6.90432960E-01 4 HO2 H 1O 2 G 200.00 3500.00 1000.00 1 4.01721090E+00 2.23982013E-03-6.33658150E-07 1.14246370E-10-1.07908535E-14 2 1.11856713E+02 3.78510215E+00 4.30179801E+00-4.74912051E-03 2.11582891E-05 3 -2.42763894E-08 9.29225124E-12 2.94808040E+02 3.71666245E+00 4 H2 H 2 G 200.00 3500.00 1000.00 1 3.33727920E+00-4.94024731E-05 4.99456778E-07-1.79566394E-10 2.00255376E-14 2 -9.50158922E+02-3.20502331E+00 2.34433112E+00 7.98052075E-03-1.94781510E-05 3 2.01572094E-08-7.37611761E-12-9.17935173E+02 6.83010238E-01 4 H2O H 2O 1 G 200.00 3500.00 1000.00 1 3.03399249E+00 2.17691804E-03-1.64072518E-07-9.70419870E-11 1.68200992E-14 2 -3.00042971E+04 4.96677010E+00 4.19864056E+00-2.03643410E-03 6.52040211E-06 3 -5.48797062E-09 1.77197817E-12-3.02937267E+04-8.49032208E-01 4 H2O2 H 2O 2 G 200.00 3500.00 1000.00 1 4.16500285E+00 4.90831694E-03-1.90139225E-06 3.71185986E-10-2.87908305E-14 2 -1.78617877E+04 2.91615662E+00 4.27611269E+00-5.42822417E-04 1.67335701E-05 3 -2.15770813E-08 8.62454363E-12-1.77025821E+04 3.43505074E+00 4 O2 O 2 G 200.00 3500.00 1000.00 1 3.28253784E+00 1.48308754E-03-7.57966669E-07 2.09470555E-10-2.16717794E-14 2 -1.08845772E+03 5.45323129E+00 3.78245636E+00-2.99673416E-03 9.84730201E-06 3 -9.68129509E-09 3.24372837E-12-1.06394356E+03 3.65767573E+00 4 CH2* C 1H 2 G 200.00 3500.00 1000.00 1 2.29203842E+00 4.65588637E-03-2.01191947E-06 4.17906000E-10-3.39716365E-14 2 5.09259997E+04 8.62650169E+00 4.19860411E+00-2.36661419E-03 8.23296220E-06 3 -6.68815981E-09 1.94314737E-12 5.04968163E+04-7.69118967E-01 4 CH3 C 1H 3 G 200.00 3500.00 1000.00 1 2.28571772E+00 7.23990037E-03-2.98714348E-06 5.95684644E-10-4.67154394E-14 2 1.67755843E+04 8.48007179E+00 3.67359040E+00 2.01095175E-03 5.73021856E-06 3 -6.87117425E-09 2.54385734E-12 1.64449988E+04 1.60456433E+00 4 CH4 C 1H 4 G 200.00 3500.00 1000.00 1 7.48514950E-02 1.33909467E-02-5.73285809E-06 1.22292535E-09-1.01815230E-13 2 -9.46834459E+03 1.84373180E+01 5.14987613E+00-1.36709788E-02 4.91800599E-05 3 -4.84743026E-08 1.66693956E-11-1.02466476E+04-4.64130376E+00 4 HCO C 1H 1O 1 G 200.00 3500.00 1000.00 1 2.77217438E+00 4.95695526E-03-2.48445613E-06 5.89161778E-10-5.33508711E-14 2 4.01191815E+03 9.79834492E+00 4.22118584E+00-3.24392532E-03 1.37799446E-05 3 -1.33144093E-08 4.33768865E-12 3.83956496E+03 3.39437243E+00 4 CH2O C 1H 2O 1 G 200.00 3500.00 1000.00 1 1.76069008E+00 9.20000082E-03-4.42258813E-06 1.00641212E-09-8.83855640E-14 2 -1.39958323E+04 1.36563230E+01 4.79372315E+00-9.90833369E-03 3.73220008E-05 3 -3.79285261E-08 1.31772652E-11-1.43089567E+04 6.02812900E-01 4 CH3O C 1H 3O 1 G 200.00 6000.00 1000.00 1 4.75779238E+00 7.44142474E-03-2.69705176E-06 4.38090504E-10-2.63537098E-14 2 3.78111940E+02-1.96680028E+00 3.71180502E+00-2.80463306E-03 3.76550971E-05 3 -4.73072089E-08 1.86588420E-11 1.29569760E+03 6.57240864E+00 4 CO C 1O 1 G 200.00 3500.00 1000.00 1 2.71518561E+00 2.06252743E-03-9.98825771E-07 2.30053008E-10-2.03647716E-14 2 -1.41518724E+04 7.81868772E+00 3.57953347E+00-6.10353680E-04 1.01681433E-06 3 9.07005884E-10-9.04424499E-13-1.43440860E+04 3.50840928E+00 4 CO2 C 1O 2 G 200.00 3500.00 1000.00 1 3.85746029E+00 4.41437026E-03-2.21481404E-06 5.23490188E-10-4.72084164E-14 2 -4.87591660E+04 2.27163806E+00 2.35677352E+00 8.98459677E-03-7.12356269E-06 3 2.45919022E-09-1.43699548E-13-4.83719697E+04 9.90105222E+00 4 C2H2 C 2H 2 G 200.00 3500.00 1000.00 1 4.14756964E+00 5.96166664E-03-2.37294852E-06 4.67412171E-10-3.61235213E-14 2 2.59359992E+04-1.23028121E+00 8.08681094E-01 2.33615629E-02-3.55171815E-05 3 2.80152437E-08-8.50072974E-12 2.64289807E+04 1.39397051E+01 4 H2CC C 2H 2 G 200.00 6000.00 1000.00 1 4.27803400E+00 4.75628040E-03-1.63010090E-06 2.54628060E-10-1.48863790E-14 2 4.83166880E+04 6.40237010E-01 3.28154830E+00 6.97647910E-03-2.38552440E-06 3 -1.21044320E-09 9.81895450E-13 4.86217940E+04 5.92039100E+00 4 C2H3 C 2H 3 G 200.00 3500.00 1000.00 1 3.01672400E+00 1.03302292E-02-4.68082349E-06 1.01763288E-09-8.62607041E-14 2 3.46128739E+04 7.78732378E+00 3.21246645E+00 1.51479162E-03 2.59209412E-05 3 -3.57657847E-08 1.47150873E-11 3.48598468E+04 8.51054025E+00 4 C2H4 C 2H 4 G 200.00 3500.00 1000.00 1 2.03611116E+00 1.46454151E-02-6.71077915E-06 1.47222923E-09-1.25706061E-13 2 4.93988614E+03 1.03053693E+01 3.95920148E+00-7.57052247E-03 5.70990292E-05 3 -6.91588753E-08 2.69884373E-11 5.08977593E+03 4.09733096E+00 4 C2H5 C 2H 5 G 200.00 3500.00 1000.00 1 1.95465642E+00 1.73972722E-02-7.98206668E-06 1.75217689E-09-1.49641576E-13 2 1.28575200E+04 1.34624343E+01 4.30646568E+00-4.18658892E-03 4.97142807E-05 3 -5.99126606E-08 2.30509004E-11 1.28416265E+04 4.70720924E+00 4 C2H6 C 2H 6 G 200.00 3500.00 1000.00 1 1.07188150E+00 2.16852677E-02-1.00256067E-05 2.21412001E-09-1.90002890E-13 2 -1.14263932E+04 1.51156107E+01 4.29142492E+00-5.50154270E-03 5.99438288E-05 3 -7.08466285E-08 2.68685771E-11-1.15222055E+04 2.66682316E+00 4 HCCO C 2H 1O 1 G 300.00 4000.00 1000.00 1 5.62820580E+00 4.08534010E-03-1.59345470E-06 2.86260520E-10-1.94078320E-14 2 1.93272150E+04-3.93025950E+00 2.25172140E+00 1.76550210E-02-2.37291010E-05 3 1.72757590E-08-5.06648110E-12 2.00594490E+04 1.24904170E+01 4 CH2CO C 2H 2O 1 G 200.00 3500.00 1000.00 1 4.51129732E+00 9.00359745E-03-4.16939635E-06 9.23345882E-10-7.94838201E-14 2 -7.77850000E+03 6.32247205E-01 2.13583630E+00 1.81188721E-02-1.73947474E-05 3 9.34397568E-09-2.01457615E-12-7.27000000E+03 1.22156480E+01 4 CH3CO C 2H 3O 1 G 200.00 6000.00 1000.00 1 5.94477310E+00 7.86672050E-03-2.88658820E-06 4.72708750E-10-2.85998610E-14 2 -3.78730750E+03-5.01367510E+00 4.16342570E+00-2.32616100E-04 3.42678200E-05 3 -4.41052270E-08 1.72756120E-11-2.65745290E+03 7.34682800E+00 4 CH2CHO C 2H 3O 1 G 300.00 5000.00 1000.00 1 5.97566990E+00 8.13059140E-03-2.74362450E-06 4.07030410E-10-2.17601710E-14 2 -9.69500000E+02-5.03208790E+00 3.40906240E+00 1.07385740E-02 1.89149250E-06 3 -7.15858310E-09 2.86738510E-12 6.20000000E+01 9.57145350E+00 4 C3H3 C 3H 3 G 200.00 6000.00 1000.00 1 7.14221880E+00 7.61902005E-03-2.67459950E-06 4.24914801E-10-2.51475415E-14 2 3.89087427E+04-1.25848436E+01 1.35110927E+00 3.27411223E-02-4.73827135E-05 3 3.76309808E-08-1.18540923E-11 4.01057783E+04 1.52058924E+01 4 pC3H4 C 3H 4 G 200.00 6000.00 1000.00 1 6.02524000E+00 1.13365420E-02-4.02233910E-06 6.43760630E-10-3.82996350E-14 2 1.96209420E+04-8.60437850E+00 2.68038690E+00 1.57996510E-02 2.50705960E-06 3 -1.36576230E-08 6.61542850E-12 2.08023740E+04 9.87693510E+00 4 aC3H4 C 3H 4 G 200.00 6000.00 1000.00 1 6.31687220E+00 1.11337280E-02-3.96293780E-06 6.35642380E-10-3.78755400E-14 2 2.01174950E+04-1.09957660E+01 2.61304450E+00 1.21225750E-02 1.85398800E-05 3 -3.45251490E-08 1.53350790E-11 2.15415670E+04 1.02261390E+01 4 aC3H5 C 3H 5 G 300.00 3000.00 1000.00 1 6.50078770E+00 1.43247310E-02-5.67816320E-06 1.10808010E-09-9.03638870E-14 2 1.74824490E+04-1.12430500E+01 1.36318350E+00 1.98138210E-02 1.24970600E-05 3 -3.33555550E-08 1.58465710E-11 1.92456290E+04 1.71732140E+01 4 CH3CCH2 C 3H 5 G 300.00 3000.00 1000.00 1 5.42555280E+00 1.55110720E-02-5.66783500E-06 7.92243880E-10-1.68780340E-14 2 2.78430270E+04-3.35271840E+00 1.73292090E+00 2.23946200E-02-5.14906110E-06 3 -6.75964660E-09 3.82532110E-12 2.90404980E+04 1.65688780E+01 4 C3H6 C 3H 6 G 300.00 5000.00 1000.00 1 6.73225700E+00 1.49083400E-02-4.94989900E-06 7.21202200E-10-3.76620400E-14 2 -9.23570300E+02-1.33133500E+01 1.49330700E+00 2.09251800E-02 4.48679400E-06 3 -1.66891200E-08 7.15814600E-12 1.07482600E+03 1.61453400E+01 4 nC3H7 C 3H 7 G 300.00 3000.00 1000.00 1 7.70974790E+00 1.60314850E-02-5.27202380E-06 7.58883520E-10-3.88627190E-14 2 7.97622360E+03-1.55152970E+01 1.04911730E+00 2.60089730E-02 2.35425160E-06 3 -1.95951320E-08 9.37202070E-12 1.03123460E+04 2.11360340E+01 4 C2H3CHO C 3H 4O 1 G 300.00 5000.00 1000.00 1 5.81118680E+00 1.71142560E-02-7.48341610E-06 1.42522490E-09-9.17468410E-14 2 -1.07840540E+04-4.85880040E+00 1.27134980E+00 2.62310540E-02-9.29123050E-06 3 -4.78372720E-09 3.34805430E-12-9.33573440E+03 1.94980770E+01 4 CH3CHOCH2 C 3H 6O 1 G 298.15 3000.00 1000.00 1 8.69005580E+00 1.60209870E-02-5.39717530E-06 7.99415420E-10-4.26563660E-14 2 -1.54206910E+04-2.24850160E+01 4.87338360E-01 2.85196900E-02 3.00961620E-06 3 -2.26526420E-08 1.07067280E-11-1.25564340E+04 2.26052700E+01 4 CH3CH2CHO C 3H 6O 1 G 300.00 5000.00 1000.00 1 6.26374100E+00 1.99762600E-02-7.61951470E-06 1.16871180E-09-4.19599930E-14 2 -2.58859530E+04-5.77864980E+00 2.72556760E+00 2.32360050E-02 2.97406560E-06 3 -1.66134150E-08 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3.07980197E-02-1.62687983E-05 3 8.03319403E-10 1.60383861E-12 1.02710410E+04 1.97163468E+01 4 C3H8 C 3H 8 G 200.00 6000.00 1000.00 1 6.66919760E+00 2.06108751E-02-7.36512349E-06 1.18434262E-09-7.06914630E-14 2 -1.62754066E+04-1.31943379E+01 4.21093013E+00 1.70886504E-03 7.06530164E-05 3 -9.20060565E-08 3.64618453E-11-1.43810883E+04 5.61004451E+00 4 C4H C 4H 1 G 300.00 3000.00 1000.00 1 7.44934320E+00 5.23223541E-03-1.96378446E-06 3.00800587E-10-1.16291758E-14 2 9.38964332E+04-1.24963400E+01 3.24025870E+00 2.26901103E-02-3.18141591E-05 3 2.44642632E-08-7.57350752E-12 9.47982151E+04 7.88228015E+00 4 C4H2 C 4H 2 G 298.00 3000.00 1000.00 1 7.39349743E+00 9.16907157E-03-4.11069563E-06 8.99136218E-10-7.78980564E-14 2 5.26083161E+04-1.54057416E+01 3.05377849E-01 4.33986344E-02-6.70390903E-05 3 5.24207951E-08-1.58126055E-11 5.38243126E+04 1.75516790E+01 4 C4H2O C 4H 2O 1 G 300.00 3000.00 1000.00 1 8.86174171E+00 9.95809378E-03-4.04590788E-06 7.30855154E-10-4.54109593E-14 2 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6.79763480E-09-7.36374420E-13 2 1.46290749E+04 2.02548946E+01-5.13691194E+00 6.06953453E-02-4.60552837E-05 3 1.28457201E-08 7.41214849E-13 1.56186997E+04 4.61565271E+01 4 C6H2 C 6H 2 G 200.00 6000.00 1000.00 1 1.25328010E+01 8.77663210E-03-3.13296160E-06 5.03718200E-10-3.00719210E-14 2 7.97843380E+04-3.88585800E+01-5.41092160E-01 7.45326280E-02-1.35782520E-04 3 1.22266300E-07-4.18252070E-11 8.21151320E+04 2.18827100E+01 4 O-C6H4 C 6H 4 G 300.00 3000.00 1000.00 1 2.98618725E+00 3.37637843E-02-2.00238391E-05 5.63853682E-09-6.10004145E-13 2 5.12231321E+04 7.44533121E+00-3.46229657E+00 5.74016575E-02-4.92984369E-05 3 1.90680483E-08-1.95430709E-12 5.25223614E+04 3.88488771E+01 4 OC6H4O C 6H 4O 2 G 300.00 3000.00 1000.00 1 5.70290193E+00 3.85045001E-02-2.28744718E-05 6.43291874E-09-6.94257842E-13 2 -1.40768967E+04-3.71424836E+00-2.04371804E+00 6.60964467E-02-5.67977439E-05 3 2.24901031E-08-2.67349671E-12-1.24369410E+04 3.43096110E+01 4 A1- C 6H 5 G 300.00 3000.00 1000.00 1 1.38016336E+00 4.04032009E-02-2.42250885E-05 6.88723321E-09-7.50960802E-13 2 3.83846442E+04 1.55219066E+01-4.87654845E+00 6.26805782E-02-4.87402286E-05 3 1.41122287E-08 5.18518310E-13 3.96142361E+04 4.59962317E+01 4 A1O C 6H 5O 1 G 300.00 3000.00 1000.00 1 3.39256520E+00 4.17379690E-02-2.49836783E-05 7.08827005E-09-7.71343006E-13 2 3.60336039E+03 6.16401148E+00-4.51502441E+00 7.03951529E-02-5.92556211E-05 3 2.12909623E-08-1.45168676E-12 5.19173466E+03 4.47023480E+01 4 A1OH C 6H 6O 1 G 300.00 3000.00 1000.00 1 9.33151850E-01 5.06597504E-02-3.17618838E-05 9.37558892E-09-1.05294081E-12 2 -1.37575260E+04 1.87340783E+01-3.56571190E+00 6.60135435E-02-3.92957818E-05 3 -3.62253930E-09 8.62415610E-12-1.31101467E+04 4.01377192E+01 4 C6H12O C 6H 12O 1 G 300.00 5000.00 1390.00 1 1.98237675E+01 2.83076305E-02-9.79700725E-06 1.53290291E-09-8.94136512E-14 2 -2.86156250E+04-7.97147353E+01-2.60027118E+00 8.25140327E-02-6.19868951E-05 3 2.52986585E-08-4.35196287E-12-2.08474661E+04 4.03432783E+01 4 OC6H11OOH C 6H 12O 3 G 300.00 5000.00 1431.00 1 1.76692622E+01 2.98180137E-02-9.43179071E-06 1.38583919E-09-7.72738616E-14 2 -4.67026645E+04-4.87302952E+01 3.38273518E+00 6.51971936E-02-4.27848450E-05 3 1.55394912E-08-2.34685173E-12-4.20179622E+04 2.71536226E+01 4 C6H13O C 6H 13O 1 G 300.00 5000.00 1391.00 1 2.04847348E+01 2.93216823E-02-1.00270389E-05 1.55645319E-09-9.02886762E-14 2 -2.24313312E+04-7.93220600E+01-2.75164321E-01 7.54319868E-02-4.89209083E-05 3 1.64641255E-08-2.29328813E-12-1.49282944E+04 3.31091672E+01 4 C6H13O4 C 6H 13O 4 G 300.00 5000.00 1389.00 1 2.66186151E+01 3.09468927E-02-1.06908607E-05 1.67084906E-09-9.73866542E-14 2 -3.85495334E+04-1.02076914E+02 3.39387651E+00 8.19934339E-02-5.32521257E-05 3 1.78042706E-08-2.46129787E-12-3.00828885E+04 2.39268930E+01 4 N-C6H14 C 6H 14 G 300.00 5000.00 1390.00 1 1.89634117E+01 3.04480204E-02-1.03794829E-05 1.60775457E-09-9.31269728E-14 2 -3.01628739E+04-7.62839355E+01-9.69606184E-01 7.29085608E-02-4.38853919E-05 3 1.32312807E-08-1.58437423E-12-2.27803862E+04 3.23069798E+01 4 A1CHO C 7H 6O 1 G 300.00 3000.00 1000.00 1 1.87355756E+00 5.26231551E-02-3.17644962E-05 9.06403069E-09-9.90306123E-13 2 -7.23603865E+03 1.49787009E+01-3.47171048E+00 6.92891889E-02-4.32603509E-05 3 3.43871096E-09 4.81010261E-12-6.14558774E+03 4.14094024E+01 4 A1CH3 C 7H 8 G 300.00 3000.00 1000.00 1 -1.01117220E+00 5.85301912E-02-3.47595069E-05 9.82180993E-09-1.06680870E-12 2 3.99363395E+03 2.83610783E+01-4.54072038E+00 6.85427145E-02-3.57113024E-05 3 -4.19397642E-09 7.41779795E-12 4.64121087E+03 4.57564849E+01 4 HOA1CH3 C 7H 8O 1 G 300.00 3000.00 1000.00 1 -6.71722270E-02 6.31866960E-02-3.90767950E-05 1.14166541E-08-1.27265055E-12 2 -1.78554350E+04 2.72088941E+01-2.49882920E+00 6.91527256E-02-2.88085659E-05 3 -1.72912650E-08 1.36326668E-11-1.76336196E+04 3.87490183E+01 4 C7H14O C 7H 14O 1 G 300.00 3500.00 1000.00 1 8.46981869E+00 5.96841930E-02-2.70199354E-05 4.51229286E-09 0.00000000E+00 2 -2.92188822E+04-1.37168565E+01-4.35014619E+00 1.01435718E-01-7.70541034E-05 3 3.06059134E-08-4.99101265E-12-2.61218264E+04 5.06557622E+01 4 OC7H13OOH C 7H 14O 3 G 300.00 3500.00 1000.00 1 1.33203201E+01 6.05344258E-02-2.79935416E-05 4.75489693E-09 0.00000000E+00 2 -5.38228654E+04-3.13441561E+01-1.45570671E+00 1.08772384E-01-8.59757426E-05 3 3.51095315E-08-5.83436499E-12-5.02602030E+04 4.28185431E+01 4 C7H15O C 7H 15O 1 G 300.00 5000.00 1000.00 1 7.08994686E+00 6.32468545E-02-2.84621689E-05 4.74318493E-09 0.00000000E+00 2 -1.96708300E+04-2.36654973E+00-4.59189934E-01 8.74464647E-02-5.69015135E-05 3 1.92195908E-08-2.68753465E-12-1.78233113E+04 3.56475170E+01 4 C7H15O4 C 7H 15O 4 G 300.00 3500.00 1000.00 1 1.42983169E+01 6.47818453E-02-2.91260263E-05 4.80222288E-09 0.00000000E+00 2 -3.52075456E+04-3.17211685E+01 1.89718004E+00 1.06229796E-01-8.02770218E-05 3 3.23649093E-08-5.45850472E-12-3.22790229E+04 3.02474612E+01 4 C8H2 C 8H 2 G 200.00 6000.00 1000.00 1 1.63586996E+01 1.08592595E-02-3.91654796E-06 6.34107033E-10-3.80413156E-14 2 1.02366984E+05-5.56746562E+01-3.26701608E-01 9.43328676E-02-1.72876384E-04 3 1.56816538E-07-5.40488426E-11 1.05392079E+05 2.20322120E+01 4 A1C2H* C 8H 5 G 300.00 3000.00 1000.00 1 7.23812069E+00 3.83812108E-02-2.18850731E-05 5.97161247E-09-6.30351467E-13 2 6.40146902E+04-1.17510451E+01-4.42757639E+00 8.36668645E-02-8.70106362E-05 3 4.70285661E-08-1.01816985E-11 6.63921125E+04 4.48120490E+01 4 A1C2H C 8H 6 G 300.00 3000.00 1000.00 1 5.81520488E+00 4.40872933E-02-2.52053858E-05 6.90275228E-09-7.31378908E-13 2 3.30271906E+04-6.49320690E+00-5.21036925E+00 8.65551944E-02-8.45007483E-05 3 4.21920706E-08-8.16766167E-12 3.52488620E+04 4.69445057E+01 4 A1CHOCHO C 8H 6O 2 G 300.00 3000.00 1000.00 1 3.92023646E+00 5.90009596E-02-3.59224864E-05 1.02976725E-08-1.12780488E-12 2 -2.20802686E+04 8.20067367E+00-1.05921174E+00 7.25550600E-02-3.97445378E-05 3 -2.80273311E-09 7.21999995E-12-2.09983131E+04 3.32342592E+01 4 A1CHOCH2 C 8H 7O 1 G 300.00 3000.00 1000.00 1 5.25955102E+00 5.44879576E-02-3.20685601E-05 8.97677768E-09-9.66803716E-13 2 6.61511721E+03-1.14571359E-01-3.91654934E+00 8.75542631E-02-7.17106548E-05 3 2.57664520E-08-2.00458849E-12 8.48223476E+03 4.46893143E+01 4 A1C2H3 C 8H 8 G 300.00 3000.00 1000.00 1 5.40554217E-01 6.17302362E-02-3.73947305E-05 1.07046587E-08-1.17304984E-12 2 1.50413170E+04 2.14502681E+01-5.38499941E+00 8.20365155E-02-5.34461878E-05 3 5.59095007E-09 5.61139050E-12 1.60857559E+04 5.01104513E+01 4 A1CH3CHO C 8H 8O 1 G 300.00 3000.00 1000.00 1 9.22059379E-01 6.50623128E-02-3.90202529E-05 1.10866861E-08-1.20786311E-12 2 -1.13895901E+04 2.29799582E+01-2.28640538E+00 7.20780836E-02-3.23578774E-05 3 -1.04515180E-08 9.86065956E-12-1.07389561E+04 3.92085598E+01 4 C8H16O C 8H 16O 1 G 300.00 5000.00 1396.00 1 2.69194750E+01 3.64715497E-02-1.25621541E-05 1.95953108E-09-1.14063115E-13 2 -4.03678092E+04-1.16350513E+02-5.50853620E+00 1.13385440E-01-8.29188825E-05 3 3.15205162E-08-4.92028745E-12-2.92118082E+04 5.74129811E+01 4 C8H16O3 C 8H 16O 3 G 300.00 5000.00 1395.00 1 3.29156373E+01 3.51547897E-02-1.20988802E-05 1.88636243E-09-1.09770918E-13 2 -6.16395715E+04-1.38208100E+02 4.02157642E-01 1.13203621E-01-8.45311281E-05 3 3.28035992E-08-5.21694930E-12-5.05565676E+04 3.56681599E+01 4 D-C8H17O C 8H 17O 1 G 300.00 5000.00 1000.00 1 1.04791401E+01 6.91930393E-02-3.13856849E-05 5.27482162E-09 0.00000000E+00 2 -2.54260262E+04-2.47627639E+01-3.80491312E+00 1.15184609E-01-8.57614185E-05 3 3.31877927E-08-5.24475393E-12-2.19418053E+04 4.71111423E+01 4 C8H17O4 C 8H 17O 4 G 300.00 5000.00 1388.00 1 3.59167660E+01 3.73517271E-02-1.29696842E-05 2.03425618E-09-1.18872912E-13 2 -4.84712569E+04-1.50538250E+02 3.70943296E+00 1.06532813E-01-6.74885336E-05 3 2.05932783E-08-2.38483543E-12-3.66985222E+04 2.45549083E+01 4 C9H6O C 9H 6O 1 G 300.00 4000.00 1000.00 1 1.52421074E+01 3.28483103E-02-1.48451611E-05 3.13037354E-09-2.51864673E-13 2 5.11757751E+02-5.73773011E+01-9.79956537E+00 1.21481525E-01-1.46437364E-04 3 1.00581826E-07-2.97026562E-11 6.62818594E+03 6.76462131E+01 4 C9H7 C 9H 7 G 300.00 4000.00 1000.00 1 1.40925252E+01 3.36504564E-02-1.50730940E-05 3.15831565E-09-2.52938691E-13 2 2.65973353E+04-5.32839911E+01-1.19141936E+01 1.27380531E-01-1.55486600E-04 3 1.06821981E-07-3.12264529E-11 3.28223057E+04 7.60295607E+01 4 C9H8 C 9H 8 G 300.00 4000.00 1000.00 1 1.32672546E+01 3.77350694E-02-1.69114895E-05 3.54398337E-09-2.83812556E-13 2 1.22543620E+04-4.94704875E+01-1.17487420E+01 1.25095830E-01-1.45097369E-04 3 9.78974470E-08-2.87961608E-11 1.84327086E+04 7.57430065E+01 4 A2O C 10H 7O 1 G 200.00 6000.00 1000.00 1 2.10591364E+01 2.82563070E-02-1.03328686E-05 1.68867034E-09-1.01974767E-13 2 4.09143507E+03-8.84963398E+01-1.15176448E+00 6.11354512E-02 3.20151083E-05 3 -9.94285290E-08 4.79990043E-11 1.14058756E+04 3.25584836E+01 4 A2 C 10H 8 G 300.00 3000.00 1000.00 1 1.76826275E+00 6.89143506E-02-4.14322176E-05 1.17914309E-08-1.28597061E-12 2 1.45412795E+04 1.06257927E+01-8.72434585E+00 1.05376008E-01-8.01710690E-05 3 2.18545974E-08 1.42066606E-12 1.66588912E+04 6.19828860E+01 4 A2OH C 10H 8O 1 G 200.00 6000.00 1000.00 1 2.08930252E+01 3.10560066E-02-1.14407562E-05 1.87872866E-09-1.13823881E-13 2 -1.35886443E+04-8.88597101E+01-2.08768263E+00 7.68099506E-02-1.53593023E-05 3 -4.04657632E-08 2.33759779E-11-6.29056385E+03 3.43331051E+01 4 A2CHO C 11H 8O 1 G 300.00 3000.00 1000.00 1 -5.55792190E-01 8.73748443E-02-5.61818352E-05 1.67233286E-08-1.88092851E-12 2 1.03455228E+03 2.63086898E+01-4.87929110E+00 9.83093630E-02-4.54845339E-05 3 -2.01808344E-08 1.77149134E-11 1.63189711E+03 4.72936201E+01 4 A2CH2 C 11H 9 G 300.00 3000.00 1000.00 1 4.97463689E+00 7.11469171E-02-4.20246831E-05 1.18025539E-08-1.27461838E-12 2 2.96267836E+04-3.38251552E+00-9.33279584E+00 1.23840886E-01-1.08233582E-04 3 4.33681755E-08-5.01787746E-12 3.25141112E+04 6.62741498E+01 4 A2CH2O C 11H 9O 1 G 300.00 3000.00 1000.00 1 3.88859655E+00 7.80883481E-02-4.70476187E-05 1.33962476E-08-1.46069161E-12 2 2.16424127E+04 6.09699174E+00-7.78907165E+00 1.18258386E-01-8.92609860E-05 3 2.40235423E-08 1.63301166E-12 2.40306202E+04 6.33842546E+01 4 A2CH3 C 11H 10 G 300.00 3000.00 1000.00 1 1.43553166E+00 8.12453307E-02-4.85900900E-05 1.37795894E-08-1.49924613E-12 2 1.04031044E+04 1.42736010E+01-7.20788596E+00 1.09244669E-01-7.11311046E-05 3 9.43727348E-09 6.02816350E-12 1.21406213E+04 5.68169697E+01 4 P2 C 12H 10 G 300.00 3000.00 1000.00 1 5.73686527E+00 7.54659445E-02-4.38684869E-05 1.21616109E-08-1.30012291E-12 2 1.66022411E+04-7.75535705E+00-1.19438051E+01 1.42163159E-01-1.33497449E-04 3 6.20505718E-08-1.05766664E-11 2.01936932E+04 7.81851355E+01 4 C12H24O C 12H 24O 1 G 300.00 5000.00 1395.00 1 4.04607075E+01 5.37349188E-02-1.84947509E-05 2.88345059E-09-1.67781317E-13 2 -5.60448221E+04-1.82037718E+02-5.15650839E+00 1.60827187E-01-1.15426441E-04 3 4.32183852E-08-6.67483843E-12-4.02093059E+04 6.28440247E+01 4 C12H24O3 C 12H 24O 3 G 300.00 5000.00 1394.00 1 4.55898728E+01 5.31250908E-02-1.82691611E-05 2.84676741E-09-1.65589525E-13 2 -7.80336986E+04-2.00571761E+02-3.25554994E-01 1.61211360E-01-1.16344903E-04 3 4.37404170E-08-6.77235945E-12-6.21377088E+04 4.57845957E+01 4 C12H25O C 12H 25O 1 G 300.00 5000.00 1390.00 1 3.99249371E+01 5.57920289E-02-1.91825516E-05 2.98850606E-09-1.73803939E-13 2 -4.72455191E+04-1.75397489E+02-1.27096470E+00 1.46874543E-01-9.55240174E-05 3 3.20177188E-08-4.42534407E-12-3.23115525E+04 4.78652888E+01 4 C12H25O4 C 12H 25O 4 G 300.00 5000.00 1388.00 1 4.87897452E+01 5.52855994E-02-1.91572543E-05 3.00051469E-09-1.75161440E-13 2 -6.50166309E+04-2.14208496E+02 3.14841764E+00 1.53204599E-01-9.64230273E-05 3 2.94570879E-08-3.45152229E-12-4.82915577E+04 3.40092586E+01 4 NC12H26 C 12H 26 G 300.00 5000.00 1391.00 1 3.85095037E+01 5.63550048E-02-1.91493200E-05 2.96024862E-09-1.71244150E-13 2 -5.48843465E+04-1.72670922E+02-2.62181594E+00 1.47237711E-01-9.43970271E-05 3 3.07441268E-08-4.03602230E-12-4.00654253E+04 5.00994626E+01 4 A2R5C2H* C 14H 7 G 300.00 3000.00 1000.00 1 1.06117453E+01 6.82675505E-02-4.04202391E-05 1.13372400E-08-1.22096366E-12 2 8.23239340E+04-3.02026385E+01-9.09090029E+00 1.41918164E-01-1.40371367E-04 3 6.90982381E-08-1.29788015E-11 8.64296336E+04 6.59091598E+01 4 A2R5C2H C 14H 8 G 300.00 3000.00 1000.00 1 9.29417049E+00 7.37696223E-02-4.35832594E-05 1.22153596E-08-1.31549318E-12 2 5.14110057E+04-2.48717979E+01-9.95199604E+00 1.45413562E-01-1.39200806E-04 3 6.55032994E-08-1.13836596E-11 5.53993662E+04 6.89952390E+01 4 A3 C 14H 10 G 300.00 3000.00 1000.00 1 3.38725839E+00 9.21885604E-02-5.57286994E-05 1.59123919E-08-1.73884258E-12 2 1.91061794E+04 2.24294382E+00-1.15461369E+01 1.43758163E-01-1.10869124E-04 3 3.12180141E-08 1.45975232E-12 2.21687904E+04 7.54982708E+01 4 A4R5 C 18H 10 G 300.00 3000.00 1000.00 1 6.20190827E+00 1.06656275E-01-6.50829301E-05 1.86776130E-08-2.04647350E-12 2 3.34439422E+04-1.42387586E+01-1.47695663E+01 1.79658022E-01-1.48189900E-04 3 4.97722102E-08-2.06437335E-12 3.78467972E+04 8.88184030E+01 4 S-C3H5 C 3H 5 G 298.00 3000.00 1000.00 1 2.88965689E+00 2.06484496E-02-1.02005529E-05 2.45220758E-09-2.32477736E-13 2 3.04802242E+04 1.09594051E+01 1.56451650E+00 2.36197016E-02-1.07382165E-05 3 -8.68979222E-11 1.19817981E-12 3.08476047E+04 1.78994346E+01 4 S-C4H6 C 4H 6 G 200.00 6000.00 1000.00 1 7.26055302E+00 1.80160845E-02-6.47062409E-06 1.04411453E-09-6.24741250E-14 2 1.39644246E+04-1.29484347E+01 5.39211846E+00 2.98346178E-03 5.22542032E-05 3 -6.64726627E-08 2.56305331E-11 1.55148209E+04 1.71080366E+00 4 Y-C7H14 C 7H 14 G 300.00 5000.00 1000.00 1 5.51949920E+00 5.83988213E-02-2.60086064E-05 4.29182035E-09 0.00000000E+00 2 -1.61420030E+04-7.15568220E-02-8.42232649E-01 7.89798297E-02-5.04574475E-05 3 1.68934048E-08-2.37201987E-12-1.45971538E+04 3.19096189E+01 4 C7H15 C 7H 15 G 300.00 5000.00 1000.00 1 3.74721159E+00 6.49345162E-02-3.01341025E-05 5.17418142E-09 0.00000000E+00 2 -3.37018357E+03 1.42780413E+01-3.79155767E-02 7.56726570E-02-4.07473634E-05 3 9.32678943E-09-4.92360745E-13-2.35605303E+03 3.37321506E+01 4 Y-C7H15 C 7H 15 G 300.00 5000.00 1000.00 1 2.64218915E+00 6.61233015E-02-3.01694174E-05 5.07586154E-09 0.00000000E+00 2 -6.15969086E+03 1.76336954E+01 1.30897106E+00 6.96136442E-02-3.31150057E-05 3 5.82888256E-09 3.54427314E-14-5.78512513E+03 2.45658235E+01 4 C-C8H17 C 8H 17 G 300.00 5000.00 1000.00 1 5.37958758E+00 7.27997671E-02-3.35089976E-05 5.69648672E-09 0.00000000E+00 2 -1.02203872E+04 1.09221142E+00-9.73159697E-02 8.92653724E-02-5.12873814E-05 3 1.37640528E-08-1.27788396E-12-8.81147302E+03 2.89791898E+01 4 T-CH2 C 1H 2 G 298.00 3000.00 1000.00 1 3.03963103E+00 3.06098054E-03-9.34182390E-07 1.07128289E-10-9.30010209E-16 2 4.62928160E+04 5.45440820E+00 3.40215504E+00 3.46667360E-03-3.77573716E-06 3 3.12335389E-09-9.43817916E-13 4.61091515E+04 3.19557878E+00 4 CH2OH C 1H 3O 1 G 298.00 3000.00 1000.00 1 4.00727361E+00 8.29366647E-03-3.67893214E-06 8.10551112E-10-7.17299662E-14 2 -3.40058619E+03 4.01290816E+00 2.82495458E+00 1.12705233E-02-4.57074212E-06 3 -1.60781616E-09 1.44390945E-12-3.10796166E+03 1.00763394E+01 4 I-C3H7 C 3H 7 G 298.00 3000.00 1000.00 1 7.45963945E-01 2.96693348E-02-1.48952386E-05 3.63056876E-09-3.48223210E-13 2 9.22929138E+03 2.21086946E+01 2.52276438E+00 1.59475347E-02 1.75812516E-05 3 -2.72667484E-08 1.00176034E-11 9.13905822E+03 1.50261961E+01 4 N-C4H5 C 4H 5 G 298.00 3000.00 1000.00 1 7.29521441E+00 1.91513156E-02-9.57154022E-06 2.33661465E-09-2.25148097E-13 2 4.01314083E+04-1.28323791E+01-3.18360247E+00 5.81813715E-02-6.38641527E-05 3 3.57450182E-08-7.89217819E-12 4.23740398E+04 3.84495969E+01 4 S-C4H5 C 4H 5 G 200.00 6000.00 1000.00 1 7.62618778E+00 1.47321922E-02-5.22511622E-06 8.36085367E-10-4.97358383E-14 2 3.33816425E+04-1.26664026E+01 4.41575788E+00 1.36823548E-02 1.76533170E-05 3 -3.06168262E-08 1.27850098E-11 3.47871254E+04 6.39669972E+00 4 T-C4H7 C 4H 7 G 298.00 3000.00 1000.00 1 3.82412534E+00 2.95960754E-02-1.46407966E-05 3.52663060E-09-3.35051666E-13 2 1.41960801E+04 4.75160803E+00-1.75459721E+00 4.92910718E-02-4.04373485E-05 3 1.83479315E-08-3.47607453E-12 1.54490344E+04 3.23361598E+01 4 T-C4H8 C 4H 8 G 298.00 3000.00 1000.00 1 2.49259256E+00 3.40780744E-02-1.69295755E-05 4.08832733E-09-3.88990590E-13 2 -4.32288125E+03 1.13884489E+01 1.54830321E+00 3.32263039E-02-7.91779321E-06 3 -7.60486417E-09 4.08847846E-12-3.92883001E+03 1.70356113E+01 4 T-C4H9 C 4H 9 G 298.00 3000.00 1000.00 1 3.86010078E+00 3.49137619E-02-1.71617290E-05 4.10778602E-09-3.88006080E-13 2 6.19352809E+03 6.34511318E+00-2.58482506E-01 4.86220061E-02-3.30549314E-05 3 1.12417927E-08-1.21847128E-12 7.13831478E+03 2.68632497E+01 4 C12H25O2 C 12H 25O 2 G 300.00 5000.00 1389.00 1 4.12070751E+01 5.69826386E-02-1.96259133E-05 3.06096125E-09-1.78149456E-13 2 -4.96208699E+04-1.78214197E+02 1.58304260E+00 1.42768096E-01-8.97641809E-05 3 2.90200208E-08-3.87985556E-12-3.50130986E+04 3.72784659E+01 4 S-OH H 1O 1 G 200.00 6000.00 1000.00 1 2.75582920E+00 1.39848756E-03-4.19428493E-07 6.33453282E-11-3.56042218E-15 2 5.09751756E+04 5.62581429E+00 3.46084428E+00 5.01872172E-04-2.00254474E-06 3 3.18901984E-09-1.35451838E-12 5.07349466E+04 1.73976415E+00 4 S-CH C 1H 1 G 200.00 6000.00 1000.00 1 2.78220752E+00 1.47246754E-03-4.63436227E-07 7.32736021E-11-4.19705404E-15 2 1.04547060E+05 5.17421018E+00 3.47250101E+00 4.26443626E-04-1.95181794E-06 3 3.51755043E-09-1.60436174E-12 1.04334869E+05 1.44799533E+00 4 CH C 1H 1 G 298.00 3000.00 1000.00 1 2.74348624E+00 1.52989360E-03-5.52389459E-07 8.80014113E-11-4.60454258E-15 2 7.08809970E+04 6.08287339E+00 3.59786591E+00-5.44427017E-04 6.03986457E-07 3 5.80967707E-10-4.34005808E-13 7.06409577E+04 1.62018856E+00 4 I-C4H3 C 4H 3 G 298.00 3000.00 1000.00 1 6.71973206E+00 1.32516489E-02-6.37495931E-06 1.49521196E-09-1.38610648E-13 2 5.71729802E+04-6.83903579E+00 3.06680066E+00 2.96551029E-02-3.49500536E-05 3 2.40468166E-08-6.86564368E-12 5.78567214E+04 1.04431702E+01 4 N-C4H3 C 4H 3 G 298.00 3000.00 1000.00 1 6.56422141E+00 1.34042507E-02-6.44807027E-06 1.51313639E-09-1.40377197E-13 2 6.28861229E+04-6.98957064E+00 2.13222535E-02 4.24805575E-02-5.63260303E-05 3 4.02118860E-08-1.14945744E-11 6.41130074E+04 2.40088149E+01 4 C6H6 C 6H 6 G 300.00 3000.00 1000.00 1 -2.06240612E-01 4.64122440E-02-2.77653536E-05 7.88910537E-09-8.60365259E-13 2 8.09883905E+03 2.06566629E+01-5.51558393E+00 6.45453225E-02-4.41402928E-05 3 7.47712161E-09 3.10282254E-12 9.11031457E+03 4.65332293E+01 4 C5H4CH2 C 6H 6 G 300.00 3000.00 1000.00 1 2.78194214E+00 4.06322016E-02-2.35029327E-05 6.51056017E-09-6.96809087E-13 2 2.43155607E+04 7.84215958E+00-5.34007612E+00 7.17283827E-02-6.45824457E-05 3 2.78691157E-08-3.95001455E-12 2.58936616E+04 4.70844323E+01 4 C6H12OOH C 6H 13O 2 G 300.00 5000.00 1381.00 1 2.38593295E+01 2.77001513E-02-9.38048736E-06 1.44747147E-09-8.36483981E-14 2 -1.86370755E+04-9.08862665E+01 2.73162048E+00 7.10071545E-02-4.02803985E-05 3 9.93346571E-09-6.60631550E-13-1.07652751E+04 2.46121021E+01 4 C6H13O2 C 6H 13O 2 G 300.00 5000.00 1389.00 1 2.19650660E+01 3.03701905E-02-1.04272562E-05 1.62279244E-09-9.43033608E-14 2 -2.42974128E+04-8.31463186E+01 2.67131403E+00 7.09041292E-02-4.20887090E-05 3 1.25922652E-08-1.52334312E-12-1.70476404E+04 2.22417885E+01 4 A1CH2 C 7H 7 G 300.00 3000.00 1000.00 1 3.30049696E+00 4.80055340E-02-2.78443022E-05 7.72371356E-09-8.27154136E-13 2 2.17498572E+04 5.42371919E+00-6.07053038E+00 8.35201507E-02-7.41700083E-05 3 3.13153847E-08-4.23670868E-12 2.35894712E+04 5.07932172E+01 4 A1CH3* C 7H 7 G 300.00 3000.00 1000.00 1 5.19780822E-01 5.26219754E-02-3.12983433E-05 8.84817377E-09-9.61252202E-13 2 3.45681510E+04 2.33397406E+01-3.91657299E+00 6.65870094E-02-3.99725038E-05 3 2.04680797E-09 4.98559390E-12 3.54243469E+04 4.51374437E+01 4 A1CH2O C 7H 7O 1 G 300.00 3000.00 1000.00 1 2.07930551E+00 5.52718914E-02-3.31303125E-05 9.40679473E-09-1.02414852E-12 2 1.17599254E+04 1.58657771E+01-4.75332952E+00 7.85832217E-02-5.57118748E-05 3 1.19664685E-08 2.51904475E-12 1.31155256E+04 4.93043758E+01 4 OA1CH3 C 7H 7O 1 G 300.00 3000.00 1000.00 1 4.14521668E+00 5.02784126E-02-2.90785098E-05 8.02843592E-09-8.55794251E-13 2 -1.22524065E+03 5.33490308E+00-3.88641950E+00 7.84259616E-02-6.20806903E-05 3 2.17166947E-08-1.65778530E-12 4.71681386E+02 4.48067664E+01 4 C7H14OOH C 7H 15O 2 G 300.00 3500.00 1000.00 1 9.54031950E+00 6.46084540E-02-2.96758488E-05 5.01243246E-09 0.00000000E+00 2 -1.74883860E+04-1.04500638E+01 8.49786005E-01 9.25107196E-02-6.25359834E-05 3 2.17880390E-08-3.12720398E-12-1.53640679E+04 3.32997487E+01 4 C7H15O2 C 7H 15O 2 G 300.00 3500.00 1000.00 1 9.89841175E+00 6.24384509E-02-2.75935765E-05 4.50200409E-09 0.00000000E+00 2 -2.38388710E+04-1.47702893E+01 3.55252917E-01 9.42381007E-02-6.66955106E-05 3 2.54795583E-08-4.13211105E-12-2.15795254E+04 3.29433435E+01 4 A1C2H3* C 8H 7 G 300.00 3000.00 1000.00 1 4.06264219E+00 5.10827774E-02-3.00105831E-05 8.40592235E-09-9.06853910E-13 2 4.45649710E+04 5.16069015E+00-5.36599417E+00 8.67271644E-02-7.54664658E-05 3 3.00990721E-08-3.35987159E-12 4.63906908E+04 5.07571616E+01 4 A1C2H2 C 8H 7 G 300.00 3000.00 1000.00 1 3.43527979E+00 5.37164001E-02-3.22969568E-05 9.18383828E-09-1.00050531E-12 2 4.43501269E+04 7.46015529E+00-4.84446826E+00 8.27250591E-02-6.41711916E-05 3 1.90253231E-08 3.03333733E-13 4.60291514E+04 4.79766323E+01 4 A1CH3CH2 C 8H 9 G 300.00 3000.00 1000.00 1 2.36833258E+00 6.03935028E-02-3.50507105E-05 9.72810282E-09-1.04236133E-12 2 1.76344521E+04 1.35706841E+01-5.06171538E+00 8.70708264E-02-6.45749806E-05 3 1.84648642E-08 4.97871788E-13 1.90750247E+04 4.96831365E+01 4 A1C2H4 C 8H 9 G 200.00 6000.00 1000.00 1 1.61326962E+01 2.82904273E-02-1.01801876E-05 1.64176637E-09-9.81375329E-14 2 2.08791061E+04-6.00115413E+01 7.33299107E-01 4.59053158E-02 3.78257231E-05 3 -9.12367411E-08 4.25589678E-11 2.61572945E+04 2.50411074E+01 4 A1CH3CH3 C 8H 10 G 300.00 3000.00 1000.00 1 -1.95577967E+00 7.09552723E-02-4.19975432E-05 1.18372259E-08-1.28339716E-12 2 -6.91883225E+01 3.59161008E+01-3.46066830E+00 7.17789316E-02-2.55611032E-05 3 -1.74870775E-08 1.22856956E-11 1.62314629E+02 4.36521185E+01 4 A1C2H5 C 8H 10 G 200.00 6000.00 1000.00 1 1.56901336E+01 3.23663075E-02-1.16864578E-05 1.88989562E-09-1.13201791E-13 2 -4.38669907E+03-6.04442403E+01 1.24076722E+00 3.59132829E-02 7.54222474E-05 3 -1.31904301E-07 5.74746803E-11 1.18391719E+03 2.24682133E+01 4 C8H16OOH C 8H 17O 2 G 300.00 5000.00 1386.00 1 3.01516942E+01 3.67482122E-02-1.24906804E-05 1.93177283E-09-1.11799171E-13 2 -2.72092925E+04-1.21960256E+02 2.27328019E+00 9.54480428E-02-5.68558246E-05 3 1.58213809E-08-1.53046111E-12-1.69395627E+04 2.99535633E+01 4 C8H17O2 C 8H 17O 2 G 300.00 5000.00 1388.00 1 2.88539796E+01 3.87250890E-02-1.33542732E-05 2.08457254E-09-1.21395954E-13 2 -3.33660857E+04-1.17725200E+02 2.31555413E+00 9.46696742E-02-5.71280014E-05 3 1.72280162E-08-2.08138332E-12-2.34350483E+04 2.71322464E+01 4 A2* C 10H 7 G 300.00 3000.00 1000.00 1 3.29950506E+00 6.30133365E-02-3.79760083E-05 1.08180756E-08-1.18007697E-12 2 4.47516414E+04 5.41223132E+00-8.00768796E+00 1.03041289E-01-8.38190998E-05 3 2.76491726E-08-8.88842209E-13 4.70598674E+04 6.07299723E+01 4 A2- C 10H 7 G 300.00 3000.00 1000.00 1 3.22892303E+00 6.31264486E-02-3.80582381E-05 1.08454069E-08-1.18342512E-12 2 4.49042392E+04 5.82007730E+00-8.02718034E+00 1.02924518E-01-8.34272010E-05 3 2.72135383E-08-7.24559554E-13 4.72004896E+04 6.08901367E+01 4 A2C2HB* C 12H 7 G 300.00 3000.00 1000.00 1 8.88789581E+00 6.15504161E-02-3.60748511E-05 1.00510071E-08-1.07767823E-12 2 7.05249421E+04-2.10417570E+01-7.35510706E+00 1.22525336E-01-1.18741281E-04 3 5.74311178E-08-1.05232765E-11 7.38800535E+04 5.80872560E+01 4 A2C2HA* C 12H 7 G 300.00 3000.00 1000.00 1 8.88459555E+00 6.15767170E-02-3.60988783E-05 1.00592710E-08-1.07867529E-12 2 7.01513012E+04-2.12172075E+01-7.36585075E+00 1.22557991E-01-1.18737276E-04 3 5.73940282E-08-1.05058631E-11 7.35089911E+04 5.79533678E+01 4 A2R5- C 12H 7 G 300.00 3000.00 1000.00 1 4.90108932E+00 6.98931618E-02-4.24225860E-05 1.21346296E-08-1.32683710E-12 2 5.74618387E+04-3.00627597E+00-9.79699017E+00 1.22277213E-01-1.04932509E-04 3 3.87946408E-08-3.16289660E-12 6.05067428E+04 6.89677152E+01 4 A2C2HA C 12H 8 G 300.00 3000.00 1000.00 1 7.55690939E+00 6.71073273E-02-3.92895768E-05 1.09479979E-08-1.17460930E-12 2 3.91372224E+04-1.57914447E+01-8.23047877E+00 1.26053176E-01-1.17499124E-04 3 5.36790980E-08-8.85462308E-12 4.23747629E+04 6.10991972E+01 4 A2R5 C 12H 8 G 300.00 3000.00 1000.00 1 3.65432884E+00 7.52647236E-02-4.54864951E-05 1.29795341E-08-1.41730827E-12 2 2.65223472E+04 7.23303392E-01-1.05497902E+01 1.25536790E-01-1.03646045E-04 3 3.52989130E-08-1.64508384E-12 2.94426605E+04 7.02667419E+01 4 A2C2HB C 12H 8 G 300.00 3000.00 1000.00 1 7.63899557E+00 6.69335855E-02-3.91500110E-05 1.08999883E-08-1.16865999E-12 2 3.92947046E+04-1.61008215E+01-8.22579974E+00 1.26247551E-01-1.18140742E-04 3 5.43987363E-08-9.12584671E-12 4.25495114E+04 6.11604165E+01 4 A2C2H2B C 12H 9 G 300.00 3000.00 1000.00 1 7.59341132E+00 7.02776920E-02-4.10737558E-05 1.14009233E-08-1.21860863E-12 2 5.29378620E+04-1.44753573E+01-9.38518818E+00 1.34825796E-01-1.28962273E-04 3 6.14480428E-08-1.09467156E-11 5.63724233E+04 6.79544608E+01 4 A2C2H2A C 12H 9 G 300.00 3000.00 1000.00 1 8.53385239E+00 6.87542797E-02-4.01750101E-05 1.11481146E-08-1.19062243E-12 2 5.27583345E+04-1.97684170E+01-9.26784872E+00 1.35043130E-01-1.29791842E-04 3 6.27220331E-08-1.16348577E-11 5.64832554E+04 6.71406964E+01 4 P2- C 12H 9 G 300.00 3000.00 1000.00 1 3.44504514E+00 7.94333671E-02-4.79778923E-05 1.37004715E-08-1.49781371E-12 2 4.80416816E+04 6.39833930E+00-9.12735261E+00 1.23234626E-01-9.48059795E-05 3 2.62424613E-08 1.55942289E-12 5.05758677E+04 6.79131989E+01 4 A3- C 14H 9 G 300.00 3000.00 1000.00 1 4.46763153E+00 8.67630728E-02-5.25251935E-05 1.50088160E-08-1.64066607E-12 2 4.98182711E+04-5.78823247E-01-1.05520158E+01 1.38692491E-01-1.09216086E-04 3 3.26809354E-08 4.68335992E-13 5.29303432E+04 7.31712961E+01 4 A2R5C2H2 C 14H 9 G 300.00 3000.00 1000.00 1 7.80126948E+00 8.14615345E-02-4.87650376E-05 1.38133442E-08-1.50000241E-12 2 6.50870635E+04-1.66224782E+01-9.79888742E+00 1.45400515E-01-1.28359949E-04 3 5.15868534E-08-6.01742362E-12 6.87094743E+04 6.93517594E+01 4 A3* C 14H 9 G 300.00 3000.00 1000.00 1 4.71264594E+00 8.67230002E-02-5.26011632E-05 1.50459549E-08-1.64563976E-12 2 4.87918428E+04-2.69885701E+00-1.08881743E+01 1.41187077E-01-1.13531428E-04 3 3.59175357E-08-4.50212032E-13 5.20137323E+04 7.38127966E+01 4 A4- C 16H 9 G 300.00 3000.00 1000.00 1 5.85098139E+00 9.43231105E-02-5.74898152E-05 1.64858853E-08-1.80541509E-12 2 5.20668614E+04-1.02176394E+01-1.23671835E+01 1.57657515E-01-1.29243633E-04 3 4.28629673E-08-1.54491879E-12 5.58893936E+04 7.93140053E+01 4 A3R5- C 16H 9 G 300.00 3000.00 1000.00 1 6.47777347E+00 9.33337716E-02-5.68626896E-05 1.63046727E-08-1.78566643E-12 2 6.07775965E+04-1.19837274E+01-1.25419370E+01 1.60371016E-01-1.35029003E-04 3 4.76044093E-08-2.93662303E-12 6.47393799E+04 8.13001841E+01 4 A4 C 16H 10 G 300.00 3000.00 1000.00 1 4.54060055E+00 9.98115207E-02-6.06376301E-05 1.73575019E-08-1.89902318E-12 2 2.12755890E+04-6.19295231E+00-1.31524443E+01 1.60878843E-01-1.27719717E-04 3 3.90918898E-08 7.43991125E-14 2.49673872E+04 8.07618418E+01 4 A3R5 C 16H 10 G 300.00 3000.00 1000.00 1 5.07024731E+00 9.89917305E-02-6.01400259E-05 1.72204585E-08-1.88476151E-12 2 3.06528296E+04-6.72179815E+00-1.32241574E+01 1.62862647E-01-1.31967056E-04 3 4.24393865E-08-8.53171724E-13 3.44430693E+04 8.30298639E+01 4 FLTN C 16H 10 G 300.00 3000.00 1000.00 1 4.54792547E+00 9.99989740E-02-6.08701972E-05 1.74529022E-08-1.91199578E-12 2 2.54780117E+04-4.65042293E+00-1.29396091E+01 1.60319722E-01-1.26452254E-04 3 3.76049108E-08 6.84839205E-13 2.91084888E+04 8.12529218E+01 4 HCN C 1H 1N 1 G 200.00 6000.00 1000.00 1 3.80223920E+00 3.14642280E-03-1.06321850E-06 1.66197570E-10-9.79975700E-15 2 1.44072920E+04 1.57546010E+00 2.25898860E+00 1.00511700E-02-1.33517630E-05 3 1.00923490E-08-3.00890280E-12 1.47126330E+04 8.91644190E+00 4 HCNN C 1H 1N 2 G 300.00 5000.00 1000.00 1 5.89463620E+00 3.98959590E-03-1.59823800E-06 2.92493950E-10-2.00946860E-14 2 5.34529410E+04-5.10305020E+00 2.52431940E+00 1.59606190E-02-1.88163540E-05 3 1.21255400E-08-3.23573780E-12 5.42619840E+04 1.16758700E+01 4 H2CN C 1H 2N 1 G 300.00 4000.00 1000.00 1 5.20970300E+00 2.96929110E-03-2.85558910E-07-1.63555000E-10 3.04325890E-14 2 2.76771090E+04-4.44447800E+00 2.85166100E+00 5.69523310E-03 1.07114000E-06 3 -1.62261200E-09-2.35110810E-13 2.86378200E+04 8.99275110E+00 4 CN C 1N 1 G 200.00 6000.00 1000.00 1 3.74598050E+00 4.34507750E-05 2.97059840E-07-6.86518060E-11 4.41341730E-15 2 5.15361880E+04 2.78676010E+00 3.61293510E+00-9.55513270E-04 2.14429770E-06 3 -3.15163230E-10-4.64303560E-13 5.17083400E+04 3.98049950E+00 4 NCO C 1N 1O 1 G 200.00 6000.00 1000.00 1 5.15218450E+00 2.30517610E-03-8.80331530E-07 1.47890980E-10-9.09779960E-15 2 1.40041230E+04-2.54426600E+00 2.82693080E+00 8.80516880E-03-8.38661340E-06 3 4.80169640E-09-1.33135950E-12 1.46824770E+04 9.55046460E+00 4 NH H 1N 1 G 200.00 6000.00 1000.00 1 2.78369280E+00 1.32984300E-03-4.24780470E-07 7.83485010E-11-5.50444700E-15 2 4.21208480E+04 5.74077990E+00 3.49290850E+00 3.11791980E-04-1.48904840E-06 3 2.48164420E-09-1.03569670E-12 4.18806290E+04 1.84832780E+00 4 HNO H 1N 1O 1 G 200.00 6000.00 1000.00 1 2.97925090E+00 3.49440590E-03-7.85497780E-07 5.74795940E-11-1.93359160E-16 2 1.17505820E+04 8.60637280E+00 4.53349160E+00-5.66961710E-03 1.84732070E-05 3 -1.71370940E-08 5.54545730E-12 1.15482970E+04 1.74984170E+00 4 NNH H 1N 2 G 200.00 6000.00 1000.00 1 3.76675440E+00 2.89150820E-03-1.04166200E-06 1.68425940E-10-1.00918960E-14 2 2.86506970E+04 4.47050670E+00 4.34469270E+00-4.84970720E-03 2.00594590E-05 3 -2.17264640E-08 7.94695390E-12 2.87919730E+04 2.97794100E+00 4 NH2 H 2N 1 G 200.00 6000.00 1000.00 1 2.83474210E+00 3.20730820E-03-9.33908040E-07 1.37029530E-10-7.92061440E-15 2 2.21719570E+04 6.52041630E+00 4.20400290E+00-2.10613850E-03 7.10683480E-06 3 -5.61151970E-09 1.64407170E-12 2.18859100E+04-1.41842480E-01 4 NH3 H 3N 1 G 200.00 6000.00 1000.00 1 2.63445210E+00 5.66625600E-03-1.72786760E-06 2.38671610E-10-1.25787860E-14 2 -6.54469580E+03 6.56629280E+00 4.28602740E+00-4.66052300E-03 2.17185130E-05 3 -2.28088870E-08 8.26380460E-12-6.74172850E+03-6.25372770E-01 4 N N 1 G 200.00 6000.00 1000.00 1 2.41594290E+00 1.74890650E-04-1.19023690E-07 3.02262450E-11-2.03609820E-15 2 5.61337730E+04 4.64960960E+00 2.50000000E+00 0.00000000E+00 0.00000000E+00 3 0.00000000E+00 0.00000000E+00 5.61046370E+04 4.19390870E+00 4 NO N 1O 1 G 200.00 6000.00 1000.00 1 3.26060560E+00 1.19110430E-03-4.29170480E-07 6.94576690E-11-4.03360990E-15 2 9.92097460E+03 6.36930270E+00 4.21847630E+00-4.63897600E-03 1.10410220E-05 3 -9.33613540E-09 2.80357700E-12 9.84462300E+03 2.28084640E+00 4 NO2 N 1O 2 G 200.00 6000.00 1000.00 1 4.88475420E+00 2.17239560E-03-8.28069060E-07 1.57475100E-10-1.05108950E-14 2 2.31649830E+03-1.17416950E-01 3.94403120E+00-1.58542900E-03 1.66578120E-05 3 -2.04754260E-08 7.83505640E-12 2.89661790E+03 6.31199170E+00 4 N2O N 2O 1 G 200.00 6000.00 1000.00 1 4.82307290E+00 2.62702510E-03-9.58508740E-07 1.60007120E-10-9.77523030E-15 2 8.07340480E+03-2.20172070E+00 2.25715020E+00 1.13047280E-02-1.36713190E-05 3 9.68198060E-09-2.93071820E-12 8.74177440E+03 1.07579920E+01 4 HCCOH C 2H 2O 1 G 300.00 5000.00 1000.00 1 5.92382910E+00 6.79236000E-03-2.56585640E-06 4.49878410E-10-2.99401010E-14 2 7.26462600E+03-7.60177420E+00 1.24237330E+00 3.10722010E-02-5.08668640E-05 3 4.31371310E-08-1.40145940E-11 8.03161430E+03 1.38743190E+01 4 HOCN C 1H 1N 1O 1G 300.00 5000.00 1368.00 1 5.89784885E+00 3.16789393E-03-1.11801064E-06 1.77243144E-10-1.04339177E-14 2 -3.70653331E+03-6.18167825E+00 3.78604952E+00 6.88667922E-03-3.21487864E-06 3 5.17195767E-10 1.19360788E-14-2.82698400E+03 5.63292162E+00 4 HCNO C 1H 1N 1O 1G 300.00 5000.00 1382.00 1 6.59860456E+00 3.02778626E-03-1.07704346E-06 1.71666528E-10-1.01439391E-14 2 1.79661339E+04-1.03306599E+01 2.64727989E+00 1.27505342E-02-1.04794236E-05 3 4.41432836E-09-7.57521466E-13 1.92990252E+04 1.07332972E+01 4 HNCO C 1H 1N 1O 1G 300.00 5000.00 1478.00 1 6.22395134E+00 3.17864004E-03-1.09378755E-06 1.70735163E-10-9.95021955E-15 2 -1.66599344E+04-8.38224741E+00 3.63096317E+00 7.30282357E-03-2.28050003E-06 3 -6.61271298E-10 3.62235752E-13-1.55873636E+04 6.19457727E+00 4 HCO3 C 1H 1O 3 G 300.00 4000.00 1368.00 1 7.24073447E+00 4.63312951E-03-1.63693995E-06 2.59706693E-10-1.52964699E-14 2 -1.87027386E+04-6.49534993E+00 3.96059309E+00 1.06002279E-02-5.25713351E-06 3 1.01716726E-09-2.87487602E-14-1.73599383E+04 1.17807483E+01 4 C3H5OO C 3H 5O 2 G 300.00 4000.00 1375.00 1 1.20289627E+01 1.26220050E-02-4.43107280E-06 6.99998849E-10-4.11059161E-14 2 4.40592543E+03-3.46276747E+01 3.16765415E+00 3.00862111E-02-1.69786280E-05 3 4.62955698E-09-5.01220245E-13 7.89477349E+03 1.42601307E+01 4 IC3H5CHO C 4H 6O 1 G 300.00 4000.00 1396.00 1 1.36175682E+01 1.37917192E-02-4.73370118E-06 7.36655226E-10-4.20097974E-14 2 -1.99994281E+04-4.72987367E+01 6.27183793E-01 4.66780254E-02-3.74430631E-05 3 1.58330542E-08-2.73952155E-12-1.57203117E+04 2.16034294E+01 4 C5H7 C 5H 7 G 300.00 4000.00 1000.00 1 6.71323690E+00 2.74278890E-02-9.94311090E-06 1.19373240E-09 0.00000000E+00 2 2.35116384E+04-1.12735252E+01 7.59315300E-01 4.32678800E-02-2.37613290E-05 3 5.12588110E-09 0.00000000E+00 2.51686000E+04 1.96131100E+01 4 BZFUR C 8H 6O 1 G 300.00 4000.00 1000.00 1 1.61267559E+01 2.42942790E-02-8.82919089E-06 1.43722155E-09-8.65592465E-14 2 -5.74867958E+03-6.40564836E+01-7.85221476E-01 3.96432449E-02 5.69751746E-05 3 -1.14831806E-07 5.19411145E-11 2.15748538E+02 3.02655928E+01 4 IC16H33 C 16H 33 G 300.00 4000.00 1398.00 1 5.60389730E+01 6.68182464E-02-2.25681513E-05 3.47608102E-09-2.00620637E-13 2 -5.83645424E+04-2.70643351E+02-9.53227198E+00 2.24283987E-01-1.66371012E-04 3 6.27848165E-08-9.51119300E-12-3.62947496E+04 7.95385858E+01 4 IC16-OOQOOH C 16H 33O 4 G 300.00 4000.00 1395.00 1 6.57312368E+01 6.98159219E-02-2.41818212E-05 3.78635278E-09-2.20988765E-13 2 -8.91725518E+04-3.13140345E+02-7.09314164E+00 2.52307521E-01-2.02956898E-04 3 8.48048060E-08-1.44255682E-11-6.50715559E+04 7.36645741E+01 4 IC16H34 C 16H 34 G 300.00 4000.00 1400.00 1 5.65856523E+01 6.92869560E-02-2.34931111E-05 3.62720220E-09-2.09665225E-13 2 -8.20366778E+04-2.76851694E+02-1.07545408E+01 2.33995831E-01-1.78076331E-04 3 6.96956034E-08-1.10282035E-11-5.95981394E+04 8.18346760E+01 4 C3H5OH C 3H 6O 1 G 300.00 4000.00 1000.00 1 6.65875100E+00 1.79008100E-02-6.12801520E-06 9.83706560E-10-6.09475850E-14 2 -1.87194550E+04-4.46185680E+00 3.32545570E+00 2.51539630E-02-1.63055650E-05 3 1.21609030E-08-5.00807290E-12-1.74250940E+04 1.39104030E+01 4 SC4H7 C 4H 7 G 300.00 4000.00 1000.00 1 7.14879043E+00 2.19663880E-02-7.74471300E-06 9.07477370E-10 0.00000000E+00 2 1.24589843E+04-1.17547735E+01-4.42598200E-01 4.22160100E-02-2.54697900E-05 3 5.97432100E-09 0.00000000E+00 1.45672100E+04 2.76086500E+01 4 C2H4O C 2H 4O 1 G 300.00 4000.00 1000.00 1 3.85543260E+00 1.46081760E-02-5.26121540E-06 6.28115500E-10 0.00000000E+00 2 -8.51874300E+03 2.14156911E+00-1.30385500E+00 2.82461720E-02-1.70593430E-05 3 3.94753470E-09 0.00000000E+00-7.07559900E+03 2.89352600E+01 4 NC5H10 C 5H 10 G 300.00 4000.00 1389.00 1 1.41108203E+01 2.28348272E-02-7.78626835E-06 1.20627491E-09-6.98795983E-14 2 -1.14335029E+04-5.01593461E+01-5.41560551E-01 5.39629918E-02-3.23508738E-05 3 9.77416037E-09-1.18534668E-12-5.98606169E+03 2.97142748E+01 4 C4H8O C 4H 8O 1 G 300.00 4000.00 1371.00 1 1.54228514E+01 1.70211052E-02-6.06347951E-06 9.67354762E-10-5.71992419E-14 2 -2.20196123E+04-6.13882135E+01-2.53690104E+00 5.43995707E-02-3.43390305E-05 3 1.01079922E-08-1.10262736E-12-1.52980680E+04 3.67400719E+01 4 C4H7OH C 4H 8O 1 G 300.00 4000.00 1000.00 1 8.63167950E+00 2.41150480E-02-8.32957180E-06 1.34433130E-09-8.35340300E-14 2 -2.30779140E+04-1.63015210E+01 1.73864090E+00 3.69849060E-02-6.80297030E-06 3 -1.28647340E-08 6.62652570E-12-2.09184180E+04 2.07395880E+01 4 CH3CHCHOHCH3 C 4H 9O 1 G 300.00 4000.00 1387.00 1 1.42049192E+01 1.95897318E-02-6.71801693E-06 1.04483881E-09-6.06940644E-14 2 -1.90416934E+04-4.63876157E+01 9.33300006E-01 4.72805232E-02-2.78316313E-05 3 7.97039080E-09-8.70532264E-13-1.40666468E+04 2.61224696E+01 4 CH3CCH2OHCH3 C 4H 9O 1 G 300.00 4000.00 1682.00 1 1.25605997E+01 2.10637488E-02-7.15019648E-06 1.10439262E-09-6.38428695E-14 2 -1.83183621E+04-3.68996627E+01 3.29612707E+00 3.47649647E-02-1.02505618E-05 3 -2.04641931E-09 1.18879408E-12-1.42607619E+04 1.57499123E+01 4 IC4P-QOOH C 4H 9O 2 G 300.00 4000.00 1396.00 1 1.81457399E+01 1.88972595E-02-6.50258715E-06 1.01363925E-09-5.89752496E-14 2 -1.03249571E+04-6.54833345E+01-2.53900783E-01 6.58110437E-02-5.35280232E-05 3 2.28723790E-08-3.98637599E-12-4.29699727E+03 3.19918975E+01 4 IC4T-QOOH C 4H 9O 2 G 300.00 4000.00 1397.00 1 1.88631296E+01 1.83239932E-02-6.31233086E-06 9.84688082E-10-5.73186521E-14 2 -1.38981290E+04-7.08829284E+01-4.25033602E-01 6.98121411E-02-6.06175877E-05 3 2.74812344E-08-5.01908797E-12-7.79203954E+03 3.05104370E+01 4 IC4H9T-OO C 4H 9O 2 G 300.00 4000.00 1392.00 1 1.67547908E+01 2.05266172E-02-7.06765238E-06 1.10199004E-09-6.41203511E-14 2 -1.97490954E+04-6.25129056E+01 4.29458545E-01 6.19305024E-02-4.92178248E-05 3 2.13391061E-08-3.85156685E-12-1.42778206E+04 2.42205126E+01 4 NEOC5H11-OO C 5H 11O 2 G 300.00 4000.00 1396.00 1 2.02154849E+01 2.45786365E-02-8.41704919E-06 1.30775217E-09-7.59095109E-14 2 -2.24777899E+04-7.96085899E+01 7.30403748E-01 7.05036948E-02-5.02866599E-05 3 1.89083885E-08-2.94948183E-12-1.57211898E+04 2.49439750E+01 4 NEOC5-QOOH C 5H 11O 2 G 300.00 4000.00 1396.00 1 2.18550366E+01 2.28989820E-02-7.86956915E-06 1.22572909E-09-7.12760383E-14 2 -1.64801773E+04-8.57429310E+01 1.15441893E+00 7.24266160E-02-5.35668095E-05 3 2.05704339E-08-3.23425526E-12-9.41504872E+03 2.50054329E+01 4 NC5-QOOH C 5H 11O 2 G 300.00 4000.00 1396.00 1 2.20245928E+01 2.28314385E-02-7.86198359E-06 1.22609365E-09-7.13571493E-14 2 -1.79960313E+04-8.64387261E+01-6.07426660E-01 8.18016374E-02-6.85494236E-05 3 3.02071532E-08-5.40750321E-12-1.06868081E+04 3.30450153E+01 4 IC16-QOOH C 16H 33O 2 G 300.00 4000.00 1399.00 1 6.15798034E+01 6.83372119E-02-2.35040286E-05 3.66308625E-09-2.13104512E-13 2 -7.10887760E+04-2.94961987E+02-8.36284759E+00 2.43137667E-01-1.93204766E-04 3 7.94478202E-08-1.32585716E-11-4.80052296E+04 7.65156723E+01 4 IC16H33-OO C 16H 33O 2 G 300.00 4000.00 1397.00 1 6.00009189E+01 6.97612153E-02-2.40119992E-05 3.74399505E-09-2.17877031E-13 2 -7.71125672E+04-2.88496873E+02-8.07177622E+00 2.38256241E-01-1.86291159E-04 3 7.58296536E-08-1.25956694E-11-5.44214916E+04 7.37310481E+01 4 C10H10 C 10H 10 G 300.00 3500.00 1800.00 1 1.82592698E+01 4.15934216E-02-1.83631832E-05 3.88491136E-09-3.27420808E-13 2 4.39687821E+03-8.23923218E+01-1.14588964E+01 1.07633791E-01-7.33968243E-05 3 2.42677414E-08-3.15836942E-12 1.50954180E+04 7.84485932E+01 4 RTETRALIN C 10H 11 G 300.00 3500.00 1800.00 1 2.92428061E+01 2.67835937E-02-9.17249482E-06 1.42952536E-09-8.46466186E-14 2 3.95646504E+03-1.44540610E+02-1.09331575E+01 1.16063513E-01-8.35724273E-05 3 2.89850559E-08-3.91180364E-12 1.84198119E+04 7.29000859E+01 4 TETRALIN C 10H 12 G 300.00 3500.00 1650.00 1 2.40250678E+01 3.45031690E-02-1.26565536E-05 2.20632462E-09-1.51941206E-13 2 -9.85314330E+03-1.11161769E+02-1.00807336E+01 1.17183900E-01-8.78208542E-05 3 3.25757390E-08-4.75336763E-12 1.40177116E+03 7.04583499E+01 4 CH3C10H6OH C 11H 10O 1 G 300.00 3500.00 1800.00 1 2.91191869E+01 2.86451308E-02-9.80098219E-06 1.51374083E-09-8.72237944E-14 2 -2.13626711E+04-1.32660114E+02-1.76841814E+00 9.72842531E-02-6.70002508E-05 3 2.26986551E-08-3.02957300E-12-1.02431333E+04 3.45100483E+01 4 DIBZFUR C 12H 8O 1 G 300.00 3500.00 1410.00 1 2.49525256E+01 3.24730728E-02-1.15459374E-05 1.79679054E-09-9.97833662E-14 2 -5.30753651E+03-1.13355893E+02-1.16970901E+01 1.36443614E-01-1.22152896E-04 3 5.40932248E-08-9.37220078E-12 5.02765510E+03 7.60497478E+01 4 BIN1A C 20H 16 G 300.00 3500.00 1800.00 1 -3.24173600E+00 1.58222900E-01-9.46183500E-05 2.81843100E-08-3.56131000E-12 2 2.17869900E+04 3.00825300E+01-3.24173600E+00 1.58222900E-01-9.46183500E-05 3 2.81843100E-08-3.56131000E-12 2.17869900E+04 3.00825300E+01 4 C10H6CH3 C 11H 9 G 300.00 3500.00 1800.00 1 2.12659882E+01 3.44429430E-02-1.39605695E-05 2.72496148E-09-2.12674976E-13 2 3.28507521E+04-9.11529083E+01-1.92673037E+00 8.59823175E-02-5.69100482E-05 3 1.86321758E-08-2.42201030E-12 4.12001308E+04 3.43709226E+01 4 C5H3 C 5H 3 G 300.00 5000.00 1000.00 1 1.07876200E+01 9.53961900E-03-3.20674500E-06 4.73332300E-10-2.51213500E-14 2 6.39290400E+04-3.00544400E+01 4.32872000E+00 2.35248000E-02-5.85672300E-06 3 -1.21544900E-08 7.72647800E-12 6.58853100E+04 4.17325900E+00 4 C5H4 C 5H 4 G 200.00 6000.00 1000.00 1 9.31656215E+00 1.37165199E-02-4.87209640E-06 7.80513961E-10-4.64725769E-14 2 4.56259628E+04-2.31942358E+01 2.12483066E+00 3.62486885E-02-3.30843646E-05 3 1.74658596E-08-3.85998715E-12 4.75470659E+04 1.34500476E+01 4 A3C2H2 C 16H 11 G 300.00 3000.00 1000.00 1 4.75824280E+01-1.28227520E-03 2.56476920E-05-1.33788380E-08 2.00865450E-12 2 4.61912150E+04-2.26532580E+02-9.58935550E+00 1.50806310E-01-1.16173270E-04 3 3.68142280E-08-1.28029010E-12 6.27019060E+04 7.13093110E+01 4 CHRYSEN C 18H 12 G 300.00 5000.00 1396.00 1 4.02767814E+01 4.07664763E-02-1.41327835E-05 2.21487630E-09-1.29371528E-13 2 1.36797665E+04-1.98070319E+02-1.06837095E+01 1.69184362E-01-1.39372979E-04 3 5.81858481E-08-9.74318604E-12 3.03145297E+04 7.20877574E+01 4 c-C4H5 C 4H 5 G 300.00 3000.00 1000.00 1 6.74671550E+00 1.72830000E-02-6.51685790E-06 9.89175740E-10-3.46049080E-14 2 3.28083590E+04-1.29128800E+01-2.63975930E+00 4.15491570E-02-2.19209540E-05 3 -4.65590140E-09 6.13488900E-12 3.53738280E+04 3.57017970E+01 4 A1C2HC2H2 C 10H 7 G 300.00 3000.00 1000.00 1 1.26825450E+01 4.14273810E-02-2.11120500E-05 5.20040990E-09-5.03264040E-13 2 6.89116250E+04-3.80951000E+01-2.32513520E+00 8.94648210E-02-7.72519560E-05 3 3.34841560E-08-5.67685960E-12 7.25776410E+04 3.74722750E+01 4 A1C2HC2H2u C 10H 7 G 300.00 3000.00 1000.00 1 1.26825450E+01 4.14273810E-02-2.11120500E-05 5.20040990E-09-5.03264040E-13 2 6.89116250E+04-3.80951000E+01-2.32513520E+00 8.94648210E-02-7.72519560E-05 3 3.34841560E-08-5.67685960E-12 7.25776410E+04 3.74722750E+01 4 BIPHEN C 12H 8 G 300.00 5000.00 1401.00 1 2.75844041E+01 2.58939856E-02-8.95813505E-06 1.40202452E-09-8.18183535E-14 2 3.71546148E+04-1.29116717E+02-9.78321241E+00 1.25214234E-01-1.11372820E-04 3 4.96439934E-08-8.75662028E-12 4.88101806E+04 6.71068024E+01 4 A4-2 C 16H 9 G 300.00 5000.00 1401.00 1 3.63627635E+01 3.14148576E-02-1.09190450E-05 1.71432648E-09-1.00264960E-13 2 4.04978572E+04-1.78212405E+02-1.20714675E+01 1.60238508E-01-1.43696791E-04 3 6.41750590E-08-1.13112521E-11 5.55777705E+04 7.60615466E+01 4 A4-4 C 16H 9 G 300.00 5000.00 1402.00 1 3.63232136E+01 3.13940645E-02-1.09004163E-05 1.71027067E-09-9.99837591E-14 2 4.04517725E+04-1.77288275E+02-1.19738229E+01 1.59343863E-01-1.42091968E-04 3 6.30656072E-08-1.10480587E-11 5.55239715E+04 7.64192993E+01 4 A3C2H-2JS C 16H 9 G 300.00 5000.00 1398.00 1 3.67812640E+01 3.10152926E-02-1.07699767E-05 1.68976783E-09-9.87789667E-14 2 6.37587690E+04-1.73313834E+02-7.59050661E+00 1.48490072E-01-1.31806093E-04 3 5.88251124E-08-1.04170126E-11 7.76876714E+04 5.99259097E+01 4 A3C2H C 16H 10 G 300.00 3000.00 1000.00 1 5.21651460E+01-1.31973180E-02 3.43530560E-05-1.62838920E-08 2.36773620E-12 2 3.42350550E+04-2.54066510E+02-1.16026740E+01 1.68243940E-01-1.64320300E-04 3 8.63943800E-08-1.93105670E-11 5.21728360E+04 7.55153660E+01 4 A3C2H-2 C 16H 10 G 300.00 5000.00 1401.00 1 3.72598081E+01 3.29424978E-02-1.13861351E-05 1.78078654E-09-1.03866988E-13 2 3.32307992E+04-1.77354975E+02-9.00521419E+00 1.57177024E-01-1.41194806E-04 3 6.38147186E-08-1.14169607E-11 4.75751775E+04 6.52082588E+01 4 PYC2H-1 C 18H 10 G 300.00 5000.00 1380.00 1 4.00549856E+01 3.70780570E-02-1.31321889E-05 2.08714093E-09-1.23089687E-13 2 3.54491810E+04-1.95526559E+02-1.66684897E+00 1.29146981E-01-8.88321137E-05 3 2.96510612E-08-3.87600847E-12 5.04370421E+04 3.03979898E+01 4 PYC2H-2 C 18H 10 G 300.00 5000.00 1380.00 1 4.00549856E+01 3.70780570E-02-1.31321889E-05 2.08714093E-09-1.23089687E-13 2 3.54491810E+04-1.96221074E+02-1.66684897E+00 1.29146981E-01-8.88321137E-05 3 2.96510612E-08-3.87600847E-12 5.04370421E+04 2.97034755E+01 4 PYC2H-4 C 18H 10 G 300.00 5000.00 1380.00 1 4.00549856E+01 3.70780570E-02-1.31321889E-05 2.08714093E-09-1.23089687E-13 2 3.54491810E+04-1.95526559E+02-1.66684897E+00 1.29146981E-01-8.88321137E-05 3 2.96510612E-08-3.87600847E-12 5.04370421E+04 3.03979898E+01 4 PYC2H-2JS C 18H 9 G 300.00 5000.00 1376.00 1 3.95503456E+01 3.50980873E-02-1.24815028E-05 1.98905158E-09-1.17522532E-13 2 6.60214976E+04-1.91256136E+02-4.46464976E-01 1.21677939E-01-8.16502810E-05 3 2.61409743E-08-3.21316409E-12 8.05697723E+04 2.59457844E+01 4 PYC2H-1JP C 18H 9 G 300.00 5000.00 1376.00 1 3.95503456E+01 3.50980873E-02-1.24815028E-05 1.98905158E-09-1.17522532E-13 2 6.67764045E+04-1.91256136E+02-4.46464976E-01 1.21677939E-01-8.16502810E-05 3 2.61409743E-08-3.21316409E-12 8.13246792E+04 2.59457844E+01 4 PYC2H-4JS C 18H 9 G 300.00 5000.00 1376.00 1 3.95503456E+01 3.50980873E-02-1.24815028E-05 1.98905158E-09-1.17522532E-13 2 6.60214976E+04-1.91256136E+02-4.46464976E-01 1.21677939E-01-8.16502810E-05 3 2.61409743E-08-3.21316409E-12 8.05697723E+04 2.59457844E+01 4 CHRYSENJ4 C 18H 11 G 300.00 5000.00 1395.00 1 3.94271918E+01 3.92828136E-02-1.36947073E-05 2.15400475E-09-1.26125737E-13 2 4.43864722E+04-1.91848271E+02-9.12122835E+00 1.60307896E-01-1.30504730E-04 3 5.38950856E-08-8.95299337E-12 6.03944025E+04 6.60377334E+01 4 CHRYSENJ1 C 18H 11 G 300.00 5000.00 1395.00 1 3.94271918E+01 3.92828136E-02-1.36947073E-05 2.15400475E-09-1.26125737E-13 2 4.43864722E+04-1.91848271E+02-9.12122835E+00 1.60307896E-01-1.30504730E-04 3 5.38950856E-08-8.95299337E-12 6.03944025E+04 6.60377334E+01 4 CHRYSENJ5 C 18H 11 G 300.00 5000.00 1395.00 1 3.94271918E+01 3.92828136E-02-1.36947073E-05 2.15400475E-09-1.26125737E-13 2 4.43864722E+04-1.91848271E+02-9.12122835E+00 1.60307896E-01-1.30504730E-04 3 5.38950856E-08-8.95299337E-12 6.03944025E+04 6.60377334E+01 4 BEPYRENJS C 20H 11 G 300.00 5000.00 1395.00 1 4.30444483E+01 4.14575803E-02-1.44807291E-05 2.28062457E-09-1.33663512E-13 2 4.59293949E+04-2.12695279E+02-1.03628170E+01 1.74833756E-01-1.43288903E-04 3 5.92981045E-08-9.84410424E-12 6.34929070E+04 7.08784003E+01 4 BAPYRJS C 20H 11 G 300.00 5000.00 1395.00 1 4.30858151E+01 4.14473057E-02-1.44826260E-05 2.28148262E-09-1.33736061E-13 2 4.70234412E+04-2.12799296E+02-1.03965058E+01 1.75095903E-01-1.43680569E-04 3 5.95429679E-08-9.89931392E-12 6.46065317E+04 7.11484565E+01 4 BEPYREN C 20H 12 G 300.00 5000.00 1396.00 1 4.39081229E+01 4.29244912E-02-1.49120808E-05 2.34035690E-09-1.36839625E-13 2 1.52188378E+04-2.18993441E+02-1.19222172E+01 1.83746722E-01-1.52240338E-04 3 6.36497846E-08-1.06491711E-11 3.34111148E+04 7.69031762E+01 4 BAPYR C 20H 12 G 300.00 5000.00 1396.00 1 4.39390181E+01 4.29285563E-02-1.49199239E-05 2.34223140E-09-1.36974444E-13 2 1.63161947E+04-2.19040740E+02-1.19841377E+01 1.84106911E-01-1.52761044E-04 3 6.39685561E-08-1.07196243E-11 3.45298004E+04 7.73099666E+01 4 BGHIPEJS1 C 22H 11 G 300.00 5000.00 1365.00 1 4.74614538E+01 4.43401509E-02-1.58273797E-05 2.52846576E-09-1.49647050E-13 2 4.31001224E+04-2.39621324E+02 1.49345169E+00 1.35027390E-01-7.73690355E-05 3 1.81774534E-08-1.00072414E-12 6.07589096E+04 1.32343772E+01 4 ANTHANJS C 22H 11 G 300.00 5000.00 1365.00 1 4.74614538E+01 4.43401509E-02-1.58273797E-05 2.52846576E-09-1.49647050E-13 2 4.42073192E+04-2.39621324E+02 1.49345169E+00 1.35027390E-01-7.73690355E-05 3 1.81774534E-08-1.00072414E-12 6.18661063E+04 1.32343772E+01 4 ANTHAN C 22H 12 G 300.00 5000.00 1369.00 1 4.81256280E+01 4.63751387E-02-1.65412148E-05 2.64117181E-09-1.56262861E-13 2 1.34023793E+04-2.46573874E+02-1.36730450E+00 1.48143318E-01-9.16739936E-05 3 2.57814320E-08-2.54438862E-12 3.20267246E+04 2.42473189E+01 4 BGHIPER C 22H 12 G 300.00 5000.00 1369.00 1 4.81256280E+01 4.63751387E-02-1.65412148E-05 2.64117181E-09-1.56262861E-13 2 1.22951825E+04-2.45189878E+02-1.36730450E+00 1.48143318E-01-9.16739936E-05 3 2.57814320E-08-2.54438862E-12 3.09195278E+04 2.56313149E+01 4 END TRANSPORT ALL AR 0 136.500 3.330 0.000 0.000 0.000 N2 1 97.530 3.621 0.000 1.760 4.000 HE 0 10.200 2.576 0.000 0.000 0.000 H 0 145.000 2.050 0.000 0.000 0.000 O 0 80.000 2.750 0.000 0.000 0.000 OH 1 80.000 2.750 0.000 0.000 0.000 HO2 2 107.400 3.458 0.000 0.000 1.000 H2 1 38.000 2.920 0.000 0.790 280.000 H2O 2 572.400 2.605 1.844 0.000 4.000 H2O2 2 107.400 3.458 0.000 0.000 3.800 O2 1 107.400 3.458 0.000 1.600 3.800 CH2* 1 144.000 3.800 0.000 0.000 0.000 CH3 1 144.000 3.800 0.000 0.000 0.000 CH4 2 141.400 3.746 0.000 2.600 13.000 HCO 2 498.000 3.590 0.000 0.000 0.000 CH2O 2 498.000 3.590 0.000 0.000 2.000 CH3O 2 417.000 3.690 1.700 0.000 2.000 CO 1 98.100 3.650 0.000 1.950 1.800 CO2 1 244.000 3.763 0.000 2.650 2.100 C2H2 1 209.000 4.100 0.000 0.000 2.500 H2CC 2 209.000 4.100 0.000 0.000 2.500 C2H3 2 209.000 4.100 0.000 0.000 1.000 C2H4 2 280.800 3.971 0.000 0.000 1.500 C2H5 2 252.300 4.302 0.000 0.000 1.500 C2H6 2 252.300 4.302 0.000 0.000 1.500 HCCO 2 150.000 2.500 0.000 0.000 1.000 CH2CO 2 436.000 3.970 0.000 0.000 2.000 CH3CO 2 436.000 3.970 0.000 0.000 2.000 CH2CHO 2 436.000 3.970 0.000 0.000 2.000 C3H3 2 252.000 4.760 0.000 0.000 1.000 pC3H4 1 252.000 4.760 0.000 0.000 1.000 aC3H4 1 252.000 4.760 0.000 0.000 1.000 aC3H5 2 266.800 4.982 0.000 0.000 1.000 CH3CCH2 2 266.800 4.982 0.000 0.000 1.000 C3H6 2 266.800 4.982 0.000 0.000 1.000 nC3H7 2 266.800 4.982 0.000 0.000 1.000 C2H3CHO 2 357.000 5.176 0.000 0.000 1.000 CH3CHOCH2 2 357.000 5.180 0.000 0.000 1.000 CH3CH2CHO 1 252.000 4.760 0.000 0.000 1.000 C4H4 2 357.000 5.180 0.000 0.000 1.000 iC4H5 2 357.000 5.180 0.000 0.000 1.000 C4H6 2 357.000 5.180 0.000 0.000 1.000 C4H6-2 2 357.000 5.180 0.000 0.000 1.000 C4H7 2 357.000 5.176 0.000 0.000 1.000 C4H81 2 357.000 5.176 0.000 0.000 1.000 pC4H9 2 357.000 5.176 0.000 0.000 1.000 cC5H9 2 357.000 5.180 0.000 0.000 1.000 cC5H8 2 357.000 5.180 0.000 0.000 1.000 SXC12H25 2 789.980 7.047 0.000 0.000 1.000 C12H24 2 775.294 7.090 0.000 0.000 1.000 PXC12H23 2 775.294 7.090 0.000 0.000 1.000 C11H22 2 763.817 6.688 0.000 0.000 1.000 PXC11H21 2 763.817 6.688 0.000 0.000 1.000 NC10H22 2 704.917 6.675 0.000 0.000 1.000 PXC10H21 2 704.917 6.675 0.000 0.000 1.000 SXC10H21 2 704.917 6.675 0.000 0.000 1.000 C10H20 2 698.122 6.578 0.000 0.000 1.000 PXC10H19 2 698.122 6.578 0.000 0.000 1.000 NC9H20 2 660.032 6.467 0.000 0.000 1.000 PXC9H19 2 660.032 6.467 0.000 0.000 1.000 SXC9H19 2 660.032 6.467 0.000 0.000 1.000 C9H18 2 655.390 6.331 0.000 0.000 1.000 PXC9H17 2 655.390 6.331 0.000 0.000 1.000 NC8H18 2 613.127 6.250 0.000 0.000 1.000 PXC8H17 2 613.127 6.250 0.000 0.000 1.000 C8H16 2 608.488 6.100 0.000 0.000 1.000 PXC8H15 2 608.488 6.100 0.000 0.000 1.000 NC7H16 2 564.030 6.004 0.000 0.000 1.000 PXC7H15 2 564.030 6.004 0.000 0.000 1.000 C7H14 2 557.947 5.876 0.000 0.000 1.000 PXC7H13 2 557.947 5.876 0.000 0.000 1.000 PXC6H13 2 512.225 5.742 0.000 0.000 1.000 SXC6H13 2 512.225 5.742 0.000 0.000 1.000 C6H12 2 504.629 5.628 0.000 0.000 1.000 PXC6H11 2 504.629 5.628 0.000 0.000 1.000 SAXC6H11 2 504.629 5.628 0.000 0.000 1.000 cC6H11 2 464.800 5.290 0.000 0.000 1.000 cC6H10 2 464.800 5.290 0.000 0.000 1.000 PXC5H11 2 458.182 5.445 0.000 0.000 1.000 C5H10 2 448.508 5.342 0.000 0.000 1.000 PXC5H9 2 448.508 5.342 0.000 0.000 1.000 S4XC12H25 2 789.980 7.047 0.000 0.000 1.000 S5XC12H25 2 789.980 7.047 0.000 0.000 1.000 S2XC11H23 2 750.460 6.834 0.000 0.000 1.000 S4XC11H23 2 750.460 6.834 0.000 0.000 1.000 S5XC11H23 2 750.460 6.834 0.000 0.000 1.000 S2XC10H21 2 704.917 6.675 0.000 0.000 1.000 S3XC10H21 2 704.917 6.675 0.000 0.000 1.000 S4XC10H21 2 704.917 6.675 0.000 0.000 1.000 S2XC9H19 2 660.032 6.467 0.000 0.000 1.000 S3XC9H19 2 660.032 6.467 0.000 0.000 1.000 S4XC9H19 2 660.032 6.467 0.000 0.000 1.000 S2XC8H17 2 613.127 6.250 0.000 0.000 1.000 S3XC8H17 2 613.127 6.250 0.000 0.000 1.000 S2XC7H15 2 564.030 6.004 0.000 0.000 1.000 S3XC7H15 2 564.030 6.004 0.000 0.000 1.000 S2XC6H13 2 512.225 5.742 0.000 0.000 1.000 P12OOHX2 2 805.031 7.102 0.000 0.000 1.000 C4H9cC6H11 2 717.126 6.229 0.130 15.000 1.000 C10H20-5 2 698.122 6.578 0.000 0.000 1.000 C4H9-2-1C6H11 2 698.122 6.578 0.000 0.000 1.000 PXC4H8cC6H11 2 546.200 6.000 0.130 15.000 1.000 SXC4H8cC6H11 2 546.200 6.000 0.130 15.000 1.000 S2XC4H8cC6H11 2 546.200 6.000 0.130 15.000 1.000 S3XC4H8cC6H11 2 546.200 6.000 0.130 15.000 1.000 C4H9TXcC6H10 2 546.200 6.000 0.130 15.000 1.000 C4H9S2XcC6H10 2 546.200 6.000 0.130 15.000 1.000 C4H9S3XcC6H10 2 546.200 6.000 0.130 15.000 1.000 C4H9S4XcC6H10 2 546.200 6.000 0.130 15.000 1.000 PXC4H8-2-1C6H11 2 698.122 6.578 0.000 0.000 1.000 PX10-5C10H19 2 698.122 6.578 0.000 0.000 1.000 PXC3H6-3-1C7H13 2 698.122 6.578 0.000 0.000 1.000 S4XC10H19 2 698.122 6.578 0.000 0.000 1.000 SAX4-5C10H19 2 698.122 6.578 0.000 0.000 1.000 SAXC10H19 2 698.122 6.578 0.000 0.000 1.000 C3H7cC6H11 2 670.219 6.032 0.130 15.000 1.000 C9H18-4 2 655.390 6.331 0.000 0.000 1.000 C3H7-2-1C6H11 2 655.390 6.331 0.000 0.000 1.000 PXC3H6cC6H11 2 546.200 6.000 0.130 15.000 1.000 S2XC3H6cC6H11 2 546.200 6.000 0.130 15.000 1.000 C3H7S2XcC6H10 2 546.200 6.000 0.130 15.000 1.000 C3H7S3XcC6H10 2 546.200 6.000 0.130 15.000 1.000 C3H7TXcC6H10 2 546.200 6.000 0.130 15.000 1.000 C3H7S4XcC6H10 2 546.200 6.000 0.130 15.000 1.000 PX9-3C9H17 2 655.390 6.331 0.000 0.000 1.000 PX9-4C9H17 2 655.390 6.331 0.000 0.000 1.000 C3H7-2-PXC6H10 2 655.390 6.331 0.000 0.000 1.000 PXC3H6-3-1C6H11 2 655.390 6.331 0.000 0.000 1.000 SAX6-4C9H17 2 655.390 6.331 0.000 0.000 1.000 C2H5TXcC6H10 2 546.200 6.000 0.130 15.000 1.000 SAXC8H15 2 608.488 6.100 0.000 0.000 1.000 PX1-3C8H15 2 608.488 6.100 0.000 0.000 1.000 PXCH2-3-1C7H13 2 608.488 6.100 0.000 0.000 1.000 C2H3cC6H11 2 568.428 5.642 0.130 15.000 1.000 C8H14-13 2 608.488 6.100 0.000 0.000 1.000 CH3cC6H11 2 495.300 5.680 0.430 12.300 1.000 C7H14-2 2 557.947 5.876 0.000 0.000 1.000 CH3-2-1C6H11 2 557.947 5.876 0.000 0.000 1.000 PXCH2cC6H11 2 495.300 5.680 0.430 12.300 1.000 CH3TXcC6H10 2 495.300 5.680 0.430 12.300 1.000 CH3S2XcC6H10 2 495.300 5.680 0.430 12.300 1.000 CH3-2-PXC6H10 2 557.947 5.876 0.000 0.000 1.000 CH3S4XcC6H10 2 495.300 5.680 0.430 12.300 1.000 CH3-3-PXC6H10 2 557.947 5.876 0.000 0.000 1.000 SXC7H13 2 557.947 5.876 0.000 0.000 1.000 SAXC7H13 2 557.947 5.876 0.000 0.000 1.000 PXCH2-5-1C6H11 2 557.947 5.876 0.000 0.000 1.000 CH3-3-TAXC6H10 2 557.947 5.876 0.000 0.000 1.000 PAXCH2-2-1C6H11 2 557.947 5.876 0.000 0.000 1.000 PX1-3C7H13 2 557.947 5.876 0.000 0.000 1.000 PXCH2-3-1C6H11 2 557.947 5.876 0.000 0.000 1.000 CH2cC6H10 2 537.375 5.348 0.430 12.300 1.000 cC6H12 2 464.800 5.290 0.000 0.000 1.000 CH3-2-PXC4H6 2 448.508 5.342 0.000 0.000 1.000 CH3-2-C4H5-13 2 448.508 5.342 0.000 0.000 1.000 CH3cC6H10OO 2 495.300 5.680 0.430 12.300 1.000 CH3cC6H9OOH 2 495.300 5.680 0.430 12.300 1.000 C4H9cC6H10OO 2 717.126 6.229 0.130 15.000 1.000 C 0 71.400 3.298 0.000 0.000 0.000 CH3O2 2 481.800 3.626 0.000 0.000 1.000 CH3OH 2 481.800 3.626 0.000 0.000 1.000 C2H 1 209.000 4.100 0.000 0.000 2.500 CH3CHO 2 436.000 3.970 0.000 0.000 2.000 C2H5O 2 470.600 4.410 0.000 0.000 1.500 C3H2 2 209.000 4.100 0.000 0.000 1.000 C3H2O 2 252.000 4.760 0.000 0.000 1.000 C3H5O 2 411.000 4.820 0.000 0.000 1.000 C3H8 2 266.800 4.982 0.000 0.000 1.000 C4H 1 357.000 5.180 0.000 0.000 1.000 C4H2 1 357.000 5.180 0.000 0.000 1.000 C4H2O 2 357.000 5.180 0.000 0.000 1.000 C5H4O 2 357.000 5.180 0.000 0.000 1.000 C5H5 2 357.000 5.180 0.000 0.000 1.000 C5H5O 2 357.000 5.180 0.000 0.000 1.000 C5H6 2 357.000 5.180 0.000 0.000 1.000 C6H2 1 495.300 5.680 0.430 12.300 1.000 O-C6H4 2 464.800 5.290 0.000 10.320 1.000 OC6H4O 2 464.800 5.290 0.000 10.320 1.000 A1- 2 464.800 5.290 0.000 10.320 1.000 A1O 2 410.000 5.920 0.000 0.000 0.000 A1OH 2 410.000 5.920 0.000 0.000 0.000 C6H12O 2 537.481 5.643 0.000 0.000 1.000 OC6H11OOH 2 631.242 6.184 0.000 0.000 1.000 C6H13O 2 541.500 5.674 1.800 0.000 1.000 C6H13O4 2 677.156 6.436 0.000 0.000 1.000 N-C6H14 2 427.400 5.946 0.000 0.000 1.000 A1CHO 2 495.300 5.680 0.430 12.300 1.000 A1CH3 2 495.300 5.680 0.430 12.300 1.000 HOA1CH3 2 495.300 5.680 0.430 12.300 1.000 C7H14O 2 511.500 6.297 0.000 0.000 1.000 OC7H13OOH 2 581.300 6.506 2.000 0.000 1.000 C7H15O 2 561.000 6.317 1.700 0.000 1.000 C7H15O4 2 600.600 7.229 0.000 0.000 1.000 C8H2 1 495.300 5.680 0.430 12.300 1.000 A1C2H* 2 535.600 5.720 0.770 12.000 1.000 A1C2H 2 535.600 5.720 0.770 12.000 1.000 A1CHOCHO 2 546.200 6.000 0.130 15.000 1.000 A1CHOCH2 2 546.200 6.000 0.130 15.000 1.000 A1C2H3 2 546.200 6.000 0.130 15.000 1.000 A1CH3CHO 2 546.200 6.000 0.130 15.000 1.000 C8H16O 2 620.244 6.123 0.000 0.000 1.000 C8H16O3 2 705.804 6.590 0.000 0.000 1.000 D-C8H17O 2 622.445 6.225 2.000 0.000 1.000 C8H17O4 2 748.337 6.813 0.000 0.000 1.000 C9H6O 2 630.400 6.180 0.000 16.500 1.000 C9H7 2 630.400 6.180 0.000 16.500 1.000 C9H8 2 630.400 6.180 0.000 16.500 1.000 A2O 2 630.400 6.180 0.000 16.500 1.000 A2 2 630.400 6.180 0.000 16.500 1.000 A2OH 2 630.400 6.180 0.000 16.500 1.000 A2CHO 2 693.100 6.470 0.000 18.000 1.000 A2CH2 2 693.100 6.470 0.000 18.000 1.000 A2CH2O 2 693.100 6.470 0.000 18.000 1.000 A2CH3 2 693.100 6.470 0.000 18.000 1.000 P2 2 676.500 6.310 0.000 20.000 1.000 C12H24O 2 765.585 6.902 0.000 0.000 1.000 C12H24O3 2 840.071 7.276 0.000 0.000 1.000 C12H25O 2 768.011 6.914 0.000 0.000 1.000 C12H25O4 2 877.768 7.460 0.000 0.000 1.000 NC12H26 2 731.341 6.724 0.000 0.000 1.000 A2R5C2H* 2 772.800 6.940 0.000 18.000 1.000 A2R5C2H 2 772.800 6.940 0.000 18.000 1.000 A3 2 772.000 6.960 0.000 38.800 1.000 A4R5 2 834.900 7.240 0.000 45.000 1.000 S-C3H5 2 266.800 4.982 0.000 0.000 1.000 S-C4H6 2 357.000 5.180 0.000 0.000 1.000 Y-C7H14 2 530.725 5.681 0.000 0.000 1.000 C7H15 2 459.600 6.253 0.000 0.000 1.000 Y-C7H15 2 533.860 5.700 0.000 0.000 1.000 C-C8H17 2 576.427 5.956 0.000 0.000 1.000 T-CH2 1 144.000 3.800 0.000 0.000 0.000 CH2OH 2 417.000 3.690 1.700 0.000 2.000 I-C3H7 2 266.800 4.982 0.000 0.000 1.000 N-C4H5 2 357.000 5.180 0.000 0.000 1.000 S-C4H5 2 357.000 5.180 0.000 0.000 1.000 T-C4H7 2 379.638 4.687 0.000 0.000 1.000 T-C4H8 2 383.626 4.715 0.500 0.000 1.000 T-C4H9 2 387.584 4.743 0.000 0.000 1.000 C12H25O2 2 805.796 7.106 0.000 0.000 1.000 S-OH 1 80.000 2.750 0.000 0.000 0.000 S-CH 1 80.000 2.750 0.000 0.000 0.000 CH 1 80.000 2.750 0.000 0.000 0.000 I-C4H3 2 357.000 5.180 0.000 0.000 1.000 N-C4H3 2 357.000 5.180 0.000 0.000 1.000 C6H6 2 464.800 5.290 0.000 10.320 1.000 C5H4CH2 2 464.800 5.290 0.000 10.320 1.000 C6H12OOH 2 588.665 5.943 0.000 0.000 1.000 C6H13O2 2 588.665 5.943 0.000 0.000 1.000 A1CH2 2 495.300 5.680 0.430 12.300 1.000 A1CH3* 2 495.300 5.680 0.430 12.300 1.000 A1CH2O 2 495.300 5.680 0.430 12.300 1.000 OA1CH3 2 495.300 5.680 0.430 12.300 1.000 C7H14OOH 2 600.600 7.229 1.800 0.000 1.000 C7H15O2 2 561.000 6.317 1.700 0.000 1.000 A1C2H3* 2 546.200 6.000 0.130 15.000 1.000 A1C2H2 2 546.200 6.000 0.130 15.000 1.000 A1CH3CH2 2 546.200 6.000 0.130 15.000 1.000 A1C2H4 2 546.200 6.000 0.130 15.000 1.000 A1CH3CH3 2 546.200 6.000 0.130 15.000 1.000 A1C2H5 2 546.200 6.000 0.130 15.000 1.000 C8H16OOH 2 666.710 6.379 0.000 0.000 1.000 C8H17O2 2 666.710 6.379 0.000 0.000 1.000 A2* 2 630.400 6.180 0.000 16.500 1.000 A2- 2 630.400 6.180 0.000 16.500 1.000 A2C2HB* 2 693.100 6.470 0.000 18.000 1.000 A2C2HA* 2 693.100 6.470 0.000 18.000 1.000 A2R5- 2 693.100 6.470 0.000 18.000 1.000 A2C2HA 2 693.100 6.470 0.000 18.000 1.000 A2R5 2 693.100 6.470 0.000 18.000 1.000 A2C2HB 2 693.100 6.470 0.000 18.000 1.000 A2C2H2B 2 693.100 6.470 0.000 18.000 1.000 A2C2H2A 2 693.100 6.470 0.000 18.000 1.000 P2- 2 676.500 6.310 0.000 20.000 1.000 A3- 2 772.000 6.960 0.000 38.800 1.000 A2R5C2H2 2 772.000 6.960 0.000 38.800 1.000 A3* 2 772.000 6.960 0.000 38.800 1.000 A4- 2 834.900 7.240 0.000 45.000 1.000 A3R5- 2 837.500 7.280 0.000 0.000 0.000 A4 2 834.900 7.240 0.000 45.000 1.000 A3R5 2 837.500 7.280 0.000 0.000 0.000 FLTN 2 834.900 7.240 0.000 45.000 1.000 HCN 2 569.000 3.630 0.000 0.000 1.000 HCNN 2 150.000 2.500 0.000 0.000 1.000 H2CN 2 569.000 3.630 0.000 0.000 1.000 CN 1 75.000 3.856 0.000 0.000 1.000 NCO 2 232.400 3.828 0.000 0.000 1.000 NH 1 80.000 2.650 0.000 0.000 4.000 HNO 2 116.700 3.492 0.000 0.000 1.000 NNH 2 71.400 3.798 0.000 0.000 1.000 NH2 2 80.000 2.650 0.000 2.260 4.000 NH3 2 481.000 2.920 1.470 0.000 10.000 N 0 71.400 3.298 0.000 0.000 0.000 NO 1 97.530 3.621 0.000 1.760 4.000 NO2 2 200.000 3.500 0.000 0.000 1.000 N2O 2 232.400 3.828 0.000 0.000 1.000 HCCOH 2 436.000 3.970 0.000 0.000 2.000 HOCN 2 232.400 3.828 0.000 0.000 1.000 HCNO 2 232.400 3.828 0.000 0.000 1.000 HNCO 2 232.400 3.828 0.000 0.000 1.000 HCO3 2 498.000 3.590 0.000 0.000 0.000 C3H5OO 2 407.800 4.140 0.000 0.000 1.000 IC3H5CHO 2 357.000 5.180 0.000 0.000 1.000 C5H7 2 408.000 5.200 0.000 0.000 1.000 BZFUR 2 630.400 6.180 0.000 16.500 1.000 IC16H33 2 650.000 8.350 0.000 0.000 1.000 IC16-OOQOOH 2 750.000 8.350 0.000 0.000 1.000 IC16H34 2 650.000 8.350 0.000 0.000 1.000 C3H5OH 2 411.000 4.820 0.000 0.000 1.000 SC4H7 2 355.000 4.650 0.000 0.000 1.000 C2H4O 2 362.600 4.530 0.000 0.000 1.500 NC5H10 2 408.000 5.200 0.000 0.000 1.000 C4H8O 2 496.000 5.200 0.000 0.000 1.000 C4H7OH 2 503.072 5.33994 1.670 8.880 1.000 CH3CHCHOHCH3 2 503.072 5.33994 1.670 8.880 1.000 CH3CCH2OHCH3 2 503.072 5.33994 1.670 8.880 1.000 IC4P-QOOH 2 496.000 5.200 0.000 0.000 1.000 IC4T-QOOH 2 496.000 5.200 0.000 0.000 1.000 IC4H9T-OO 2 496.000 5.200 0.000 0.000 1.000 NEOC5H11-OO 2 492.000 5.640 0.000 0.000 1.000 NEOC5-QOOH 2 492.000 5.640 0.000 0.000 1.000 NC5-QOOH 2 492.000 5.640 0.000 0.000 1.000 IC16-QOOH 2 750.000 8.350 0.000 0.000 1.000 IC16H33-OO 2 750.000 8.350 0.000 0.000 1.000 C10H10 2 630.400 6.180 0.000 16.500 1.000 RTETRALIN 2 630.400 6.180 0.000 16.500 1.000 TETRALIN 2 630.400 6.180 0.000 16.500 1.000 CH3C10H6OH 2 663.450 6.362 0.000 0.000 1.000 DIBZFUR 2 676.500 6.310 0.000 0.000 1.000 BIN1A 2 951.685 8.471 0.000 0.000 1.000 C10H6CH3 2 660.000 6.350 0.000 0.000 1.000 C5H3 1 357.000 5.180 0.000 0.000 1.000 C5H4 1 357.000 5.180 0.000 0.000 1.000 A3C2H2 2 834.900 7.240 0.000 45.000 1.000 CHRYSEN 2 776.200 7.407 0.000 0.000 1.000 c-C4H5 2 329.000 5.100 0.000 0.000 1.000 A1C2HC2H2 2 630.400 6.180 0.000 16.500 1.000 A1C2HC2H2u 2 630.400 6.180 0.000 16.500 1.000 BIPHEN 2 693.100 6.470 0.000 18.000 1.000 A4-2 2 776.200 7.407 0.000 0.000 1.000 A4-4 2 776.200 7.407 0.000 0.000 1.000 A3C2H-2JS 2 523.400 6.568 0.000 0.000 1.000 A3C2H 2 834.900 7.240 0.000 45.000 1.000 A3C2H-2 2 523.400 6.568 0.000 0.000 1.000 PYC2H-1 2 776.200 7.407 0.000 0.000 1.000 PYC2H-2 2 776.200 7.407 0.000 0.000 1.000 PYC2H-4 2 776.200 7.407 0.000 0.000 1.000 PYC2H-2JS 2 776.200 7.407 0.000 0.000 1.000 PYC2H-1JP 2 776.200 7.407 0.000 0.000 1.000 PYC2H-4JS 2 776.200 7.407 0.000 0.000 1.000 CHRYSENJ4 2 776.200 7.407 0.000 0.000 1.000 CHRYSENJ1 2 776.200 7.407 0.000 0.000 1.000 CHRYSENJ5 2 776.200 7.407 0.000 0.000 1.000 BEPYRENJS 2 833.062 8.087 0.000 0.000 1.000 BAPYRJS 2 833.062 8.087 0.000 0.000 1.000 BEPYREN 2 833.062 8.087 0.000 0.000 1.000 BAPYR 2 833.062 8.087 0.000 0.000 1.000 BGHIPEJS1 2 990.963 8.358 0.000 0.000 1.000 ANTHANJS 2 990.963 8.358 0.000 0.000 1.000 ANTHAN 2 990.963 8.358 0.000 0.000 1.000 BGHIPER 2 990.963 8.358 0.000 0.000 1.000 END REACTIONS H + O2 <=> O + OH 2.644E+16 -0.6707 17041.00 O + H2 <=> H + OH 45890.000 2.700 6260.00 OH + H2 <=> H + H2O 1.734E+08 1.510 3430.00 2OH <=> O + H2O 39730.000 2.400 -2110.00 2H + M <=> H2 + M 1.780E+18 -1.000 0.00 AR/0.63/ H2/0.0/ H2O/0.0/ CO2/0.0/ 2H + H2 <=> H2 + H2 9.000E+16 -0.600 0.00 2H + H2O <=> H2 + H2O 5.624E+19 -1.250 0.00 2H + CO2 <=> H2 + CO2 5.500E+20 -2.000 0.00 H + OH + M <=> H2O + M 4.400E+22 -2.000 0.00 AR/0.38/ H2/2.0/ H2O/6.3/ CO/1.75/ CO2/3.6/ O + H + M <=> OH + M 9.428E+18 -1.000 0.00 AR/0.7/ H2/2.0/ H2O/12.0/ CO/1.75/ CO2/3.6/ 2O + M <=> O2 + M 1.200E+17 -1.000 0.00 AR/0.83/ H2/2.4/ H2O/15.4/ CO/1.75/ CO2/3.6/ H + O2 (+ M) <=> HO2 (+ M) 5.116E+12 0.440 0.00 AR/0.4/ H2O/11.89/ O2/0.85/ CO/1.09/ CO2/2.18/ LOW/6.328E+19 -1.400 0.00/ TROE/0.5 1.0E-30 1.0E+30/ H2 + O2 <=> HO2 + H 591600.000 2.433 53502.00 2OH (+ M) <=> H2O2 (+ M) 1.110E+14 -0.370 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CO/1.75/ CO2/3.6/ LOW/2.010E+17 -0.584 -2293.00/ TROE/0.7346 94.0 1756.0 5182.0/ HO2 + H <=> O + H2O 3.970E+12 0.000 671.00 HO2 + H <=> 2OH 7.485E+13 0.000 295.00 HO2 + O <=> OH + O2 4.000E+13 0.000 0.00 2HO2 <=> O2 + H2O2 1.300E+11 0.000 -1630.00 DUPLICATE 2HO2 <=> O2 + H2O2 3.658E+14 0.000 12000.00 DUPLICATE HO2 + OH <=> H2O + O2 2.890E+13 0.000 -500.00 H2O2 + H <=> HO2 + H2 6.050E+06 2.000 5200.00 H2O2 + H <=> OH + H2O 2.410E+13 0.000 3970.00 H2O2 + O <=> OH + HO2 9.630E+06 2.000 3970.00 H2O2 + OH <=> HO2 + H2O 2.000E+12 0.000 427.00 DUPLICATE H2O2 + OH <=> HO2 + H2O 2.670E+41 -7.000 37600.00 DUPLICATE CO + O (+ M) <=> CO2 (+ M) 1.362E+10 0.000 2384.00 AR/0.7/ H2/2.0/ H2O/12.0/ CO/1.75/ CO2/3.6/ LOW/1.173E+24 -2.790 4191.00/ CO + OH <=> CO2 + H 70460.000 2.053 -355.67 DUPLICATE CO + OH <=> CO2 + H 5.757E+12 -0.664 331.83 DUPLICATE CO + O2 <=> CO2 + O 1.119E+12 0.000 47700.00 CO + HO2 <=> CO2 + OH 157000.000 2.180 17942.60 HCO + H <=> CO + H2 1.200E+14 0.000 0.00 HCO + O <=> CO + OH 3.000E+13 0.000 0.00 HCO + O <=> CO2 + H 3.000E+13 0.000 0.00 HCO + OH <=> CO + H2O 3.020E+13 0.000 0.00 HCO + M <=> CO + H + M 1.870E+17 -1.000 17000.00 H2/2.0/ H2O/0.0/ CO/1.75/ CO2/3.6/ HCO + H2O <=> CO + H + H2O 2.244E+18 -1.000 17000.00 HCO + O2 <=> CO + HO2 1.204E+10 0.807 -727.00 CO + H2 (+ M) <=> CH2O (+ M) 4.300E+07 1.500 79600.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.070E+27 -3.420 84350.00/ TROE/0.932 197.0 1540.0 10300.0/ HCO + H (+ M) <=> CH2O (+ M) 1.090E+12 0.480 -260.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.350E+24 -2.570 1425.00/ TROE/0.7824 271.0 2755.0 6570.0/ CH2* + O <=> CO + H2 1.500E+13 0.000 0.00 DUPLICATE CH2* + O <=> HCO + H 1.500E+13 0.000 0.00 DUPLICATE CH2* + OH <=> CH2O + H 3.000E+13 0.000 0.00 DUPLICATE CH2* + H2 <=> CH3 + H 7.000E+13 0.000 0.00 DUPLICATE CH2* + O2 <=> H + OH + CO 2.800E+13 0.000 0.00 DUPLICATE CH2* + O2 <=> CO + H2O 1.200E+13 0.000 0.00 DUPLICATE CH2* + CO2 <=> CH2O + CO 1.400E+13 0.000 0.00 DUPLICATE CH2O + H (+ M) <=> CH3O (+ M) 5.400E+11 0.454 2600.00 H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/2.200E+30 -4.800 5560.00/ TROE/0.758 94.0 1555.0 4200.0/ CH2O + H <=> HCO + H2 2.300E+10 1.050 3275.00 CH2O + O <=> HCO + OH 3.900E+13 0.000 3540.00 CH2O + OH <=> HCO + H2O 3.430E+09 1.180 -447.00 CH2O + O2 <=> HCO + HO2 1.000E+14 0.000 40000.00 CH2O + HO2 <=> HCO + H2O2 1.000E+12 0.000 8000.00 CH3 + H (+ M) <=> CH4 (+ M) 1.270E+16 -0.630 383.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/2.477E+33 -4.760 2440.00/ TROE/0.783 74.0 2941.0 6964.0/ CH3 + O <=> CH2O + H 8.430E+13 0.000 0.00 CH3 + OH <=> CH2* + H2O 2.501E+13 0.000 0.00 DUPLICATE CH3 + O2 <=> O + CH3O 3.083E+13 0.000 28800.00 CH3 + O2 <=> OH + CH2O 3.600E+10 0.000 8940.00 CH3 + HO2 <=> CH4 + O2 1.000E+12 0.000 0.00 CH3 + HO2 <=> CH3O + OH 1.340E+13 0.000 0.00 CH3 + H2O2 <=> CH4 + HO2 24500.000 2.470 5180.00 CH3 + HCO <=> CH4 + CO 8.480E+12 0.000 0.00 CH3 + CH2O <=> CH4 + HCO 3320.000 2.810 5860.00 CH3 + CH2* <=> C2H4 + H 1.200E+13 0.000 -570.00 DUPLICATE 2CH3 (+ M) <=> C2H6 (+ M) 2.120E+16 -0.970 620.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.770E+50 -9.670 6220.00/ TROE/0.5325 151.0 1038.0 4970.0/ 2CH3 <=> H + C2H5 4.990E+12 0.100 10600.00 CH3 + HCCO <=> C2H4 + CO 5.000E+13 0.000 0.00 CH3O + H <=> CH2O + H2 2.000E+13 0.000 0.00 CH3O + H <=> CH3 + OH 3.200E+13 0.000 0.00 CH3O + H <=> CH2* + H2O 1.600E+13 0.000 0.00 CH3O + O <=> CH2O + OH 1.000E+13 0.000 0.00 CH3O + OH <=> CH2O + H2O 5.000E+12 0.000 0.00 CH3O + O2 <=> CH2O + HO2 4.280E-13 7.600 -3530.00 CH4 + H <=> CH3 + H2 6.600E+08 1.620 10840.00 CH4 + O <=> CH3 + OH 1.020E+09 1.500 8600.00 CH4 + OH <=> CH3 + H2O 1.000E+08 1.600 3120.00 CH4 + CH2* <=> 2CH3 1.600E+13 0.000 -570.00 DUPLICATE HCCO + H <=> CH2* + CO 1.000E+14 0.000 0.00 DUPLICATE HCCO + O <=> H + 2CO 1.000E+14 0.000 0.00 HCCO + O2 <=> OH + 2CO 1.600E+12 0.000 854.00 2HCCO <=> C2H2 + 2CO 1.000E+13 0.000 0.00 C2H2 (+ M) <=> H2CC (+ M) 8.000E+14 -0.520 50750.00 H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H2/2.5/ C2H4/2.5/ C2H6/3.0/ LOW/2.450E+15 -0.640 49700.00/ DUPLICATE C2H3 (+ M) <=> C2H2 + H (+ M) 3.860E+08 1.620 37048.20 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H2/3.0/ C2H4/3.0/ C2H6/3.0/ LOW/2.565E+27 -3.400 35798.70/ TROE/1.9816 5383.7 4.2932 -0.0795/ C2H2 + O <=> HCCO + H 1.632E+07 2.000 1900.00 C2H2 + OH <=> CH2CO + H 0.000218 4.500 -1000.00 C2H2 + OH <=> CH3 + CO 0.000483 4.000 -2000.00 C2H2 + HCO <=> C2H3 + CO 1.000E+07 2.000 6000.00 C2H2 + CH2* <=> C3H3 + H 2.000E+13 0.000 0.00 DUPLICATE C2H2 + HCCO <=> C3H3 + CO 1.000E+11 0.000 3000.00 C2H2 + CH3 <=> pC3H4 + H 2.560E+09 1.100 13644.00 DUPLICATE C2H2 + CH3 <=> aC3H4 + H 5.140E+09 0.860 22153.00 DUPLICATE C2H2 + CH3 <=> CH3CCH2 4.990E+22 -4.390 18850.00 C2H2 + CH3 <=> aC3H5 2.680E+53 -12.820 35730.00 H2CC + H <=> C2H2 + H 1.000E+14 0.000 0.00 H2CC + OH <=> CH2CO + H 2.000E+13 0.000 0.00 H2CC + O2 <=> 2HCO 1.000E+13 0.000 0.00 DUPLICATE H2CC + C2H2 (+ M) <=> C4H4 (+ M) 350000.000 2.055 -2400.00 H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H2/3.0/ C2H4/3.0/ C2H6/3.0/ LOW/1.400E+60 -12.599 7417.00/ TROE/0.98 56.0 580.0 4164.0/ H2CC + C2H4 <=> C4H6 1.000E+12 0.000 0.00 CH2CO + H (+ M) <=> CH2CHO (+ M) 3.300E+14 -0.060 8500.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H2/3.0/ C2H4/3.0/ C2H6/3.0/ LOW/3.800E+41 -7.640 11900.00/ TROE/0.337 1707.0 3200.0 4131.0/ CH2CO + H <=> HCCO + H2 5.000E+13 0.000 8000.00 CH2CO + H <=> CH3 + CO 1.500E+09 1.430 2690.00 CH2CO + O <=> HCCO + OH 1.000E+13 0.000 8000.00 CH2CO + OH <=> HCCO + H2O 7.500E+12 0.000 2000.00 C2H3 + H (+ M) <=> C2H4 (+ M) 6.080E+12 0.270 280.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H2/3.0/ C2H4/3.0/ C2H6/3.0/ LOW/1.400E+30 -3.860 3320.00/ TROE/0.782 207.5 2663.0 6095.0/ C2H3 + H <=> C2H2 + H2 9.000E+13 0.000 0.00 C2H3 + H <=> H2CC + H2 6.000E+13 0.000 0.00 C2H3 + O <=> CH2CO + H 4.800E+13 0.000 0.00 C2H3 + O <=> CH3 + CO 4.800E+13 0.000 0.00 C2H3 + OH <=> C2H2 + H2O 3.011E+13 0.000 0.00 C2H3 + O2 <=> C2H2 + HO2 1.340E+06 1.610 -383.40 C2H3 + O2 <=> CH2CHO + O 3.000E+11 0.290 11.00 C2H3 + O2 <=> HCO + CH2O 4.600E+16 -1.390 1010.00 C2H3 + HO2 <=> CH2CHO + OH 1.000E+13 0.000 0.00 C2H3 + H2O2 <=> C2H4 + HO2 1.210E+10 0.000 -596.00 C2H3 + HCO <=> C2H4 + CO 9.033E+13 0.000 0.00 C2H3 + HCO <=> C2H3CHO 1.800E+13 0.000 0.00 C2H3 + CH3 <=> C2H2 + CH4 3.920E+11 0.000 0.00 C2H3 + CH3 (+ M) <=> C3H6 (+ M) 2.500E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H2/3.0/ C2H4/3.0/ C2H6/3.0/ LOW/4.270E+58 -11.940 9769.80/ TROE/0.175 1340.6 60000.0 10139.8/ C2H3 + CH3 <=> aC3H5 + H 1.500E+24 -2.830 18618.00 DUPLICATE C2H3 + C2H2 <=> C4H4 + H 2.000E+18 -1.680 10600.00 C2H3 + C2H2 <=> iC4H5 1.600E+46 -10.980 18600.00 DUPLICATE 2C2H3 <=> C4H6 1.500E+42 -8.840 12483.00 2C2H3 <=> iC4H5 + H 1.200E+22 -2.440 13654.00 DUPLICATE 2C2H3 <=> C2H2 + C2H4 9.600E+11 0.000 0.00 CH2CHO <=> CH3 + CO 7.800E+41 -9.147 46900.00 CH2CHO + H <=> CH3CO + H 5.000E+12 0.000 0.00 CH2CHO + H <=> CH3 + HCO 9.000E+13 0.000 0.00 CH2CHO + H <=> CH2CO + H2 2.000E+13 0.000 4000.00 CH2CHO + O <=> CH2CO + OH 2.000E+13 0.000 4000.00 CH2CHO + OH <=> CH2CO + H2O 1.000E+13 0.000 2000.00 CH2CHO + O2 <=> CH2CO + HO2 1.400E+11 0.000 0.00 CH2CHO + O2 <=> CH2O + CO + OH 1.800E+10 0.000 0.00 CH3 + CO (+ M) <=> CH3CO (+ M) 4.850E+07 1.650 6150.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H2/3.0/ C2H4/3.0/ C2H6/3.0/ LOW/7.800E+30 -5.395 8600.00/ TROE/0.258 598.0 21002.0 1773.0/ CH3CO + H <=> CH3 + HCO 9.600E+13 0.000 0.00 CH3CO + O <=> CH2CO + OH 3.900E+13 0.000 0.00 CH3CO + O <=> CH3 + CO2 1.500E+14 0.000 0.00 CH3CO + OH <=> CH2CO + H2O 1.200E+13 0.000 0.00 CH3CO + OH <=> CH3 + CO + OH 3.000E+13 0.000 0.00 CH3CO + HO2 <=> CH3 + CO2 + OH 3.000E+13 0.000 0.00 C2H4 + M <=> H2 + H2CC + M 7.860E+14 0.000 54245.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE C2H4 + H (+ M) <=> C2H5 (+ M) 1.367E+09 1.463 1355.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/2.027E+39 -6.642 5769.00/ TROE/-0.569 299.0 9147.0 -152.4/ C2H4 + H <=> C2H3 + H2 5.070E+07 1.900 12950.00 C2H4 + O <=> C2H3 + OH 1.510E+07 1.900 3740.00 C2H4 + O <=> CH3 + HCO 1.920E+07 1.830 220.00 C2H4 + OH <=> C2H3 + H2O 3.600E+06 2.000 2500.00 C2H4 + HCO <=> C2H5 + CO 1.000E+07 2.000 8000.00 C2H4 + CH2* <=> H2CC + CH4 5.000E+13 0.000 0.00 C2H4 + CH2* <=> aC3H5 + H 5.000E+13 0.000 0.00 C2H4 + CH3 <=> C2H3 + CH4 227000.000 2.000 9200.00 C2H4 + CH3 <=> nC3H7 3.300E+11 0.000 7700.00 C2H4 + O2 <=> C2H3 + HO2 4.220E+13 0.000 60800.00 C2H4 + C2H3 <=> C4H7 7.930E+38 -8.470 14220.00 C2H5 + H (+ M) <=> C2H6 (+ M) 5.210E+17 -0.990 1580.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.990E+41 -7.080 6685.00/ TROE/0.8422 125.0 2219.0 6882.0/ C2H5 + H <=> C2H4 + H2 2.000E+12 0.000 0.00 C2H5 + O <=> CH3 + CH2O 1.604E+13 0.000 0.00 C2H5 + O2 <=> C2H4 + HO2 2.000E+10 0.000 0.00 C2H5 + HO2 <=> C2H6 + O2 3.000E+11 0.000 0.00 C2H5 + HO2 <=> C2H4 + H2O2 3.000E+11 0.000 0.00 C2H5 + HO2 <=> CH3 + CH2O + OH 2.400E+13 0.000 0.00 C2H5 + H2O2 <=> C2H6 + HO2 8.700E+09 0.000 974.00 C2H5 + C2H3 (+ M) <=> C4H81 (+ M) 1.500E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.550E+56 -11.790 8984.50/ TROE/0.198 2277.9 60000.0 5723.2/ C2H5 + C2H3 <=> aC3H5 + CH3 3.900E+32 -5.220 19747.00 C2H6 + H <=> C2H5 + H2 1.150E+08 1.900 7530.00 C2H6 + O <=> C2H5 + OH 8.980E+07 1.920 5690.00 C2H6 + OH <=> C2H5 + H2O 3.540E+06 2.120 870.00 C2H6 + CH2* <=> C2H5 + CH3 4.000E+13 0.000 -550.00 DUPLICATE C2H6 + CH3 <=> C2H5 + CH4 6.140E+06 1.740 10450.00 C3H3 + H <=> pC3H4 1.500E+13 0.000 0.00 C3H3 + H <=> aC3H4 2.500E+12 0.000 0.00 C3H3 + O2 <=> CH2CO + HCO 3.000E+10 0.000 2868.00 C3H3 + HO2 <=> OH + CO + C2H3 8.000E+11 0.000 0.00 C3H3 + HO2 <=> aC3H4 + O2 3.000E+11 0.000 0.00 DUPLICATE C3H3 + HO2 <=> pC3H4 + O2 2.500E+12 0.000 0.00 DUPLICATE C3H3 + HCO <=> aC3H4 + CO 2.500E+13 0.000 0.00 DUPLICATE C3H3 + HCO <=> pC3H4 + CO 2.500E+13 0.000 0.00 DUPLICATE C3H3 + HCCO <=> C4H4 + CO 2.500E+13 0.000 0.00 aC3H4 + H <=> C3H3 + H2 1.300E+06 2.000 5500.00 DUPLICATE aC3H4 + H <=> CH3CCH2 9.460E+42 -9.430 11190.00 DUPLICATE aC3H4 + H <=> aC3H5 1.520E+59 -13.540 26949.00 DUPLICATE aC3H4 + O <=> C2H4 + CO 2.000E+07 1.800 1000.00 DUPLICATE aC3H4 + OH <=> C3H3 + H2O 5.300E+06 2.000 2000.00 DUPLICATE aC3H4 + CH3 <=> C3H3 + CH4 1.300E+12 0.000 7700.00 DUPLICATE pC3H4 <=> aC3H4 5.150E+60 -13.930 91117.00 DUPLICATE pC3H4 + H <=> aC3H4 + H 6.270E+17 -0.910 10079.00 DUPLICATE pC3H4 + H <=> CH3CCH2 1.660E+47 -10.580 13690.00 DUPLICATE pC3H4 + H <=> aC3H5 4.910E+60 -14.370 31644.00 pC3H4 + H <=> C3H3 + H2 1.300E+06 2.000 5500.00 DUPLICATE pC3H4 + C3H3 <=> aC3H4 + C3H3 6.140E+06 1.740 10450.00 pC3H4 + O <=> HCCO + CH3 7.300E+12 0.000 2250.00 DUPLICATE pC3H4 + O <=> C2H4 + CO 1.000E+13 0.000 2250.00 DUPLICATE pC3H4 + OH <=> C3H3 + H2O 1.000E+06 2.000 100.00 DUPLICATE pC3H4 + CH3 <=> C3H3 + CH4 1.800E+12 0.000 7700.00 DUPLICATE aC3H5 + H (+ M) <=> C3H6 (+ M) 2.000E+14 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.330E+60 -12.000 5967.80/ TROE/0.02 1096.6 1096.6 6859.5/ aC3H5 + H <=> aC3H4 + H2 1.800E+13 0.000 0.00 DUPLICATE aC3H5 + O <=> C2H3CHO + H 6.000E+13 0.000 0.00 DUPLICATE aC3H5 + OH <=> C2H3CHO + 2H 4.200E+32 -5.160 30126.00 aC3H5 + OH <=> aC3H4 + H2O 6.000E+12 0.000 0.00 DUPLICATE aC3H5 + O2 <=> aC3H4 + HO2 4.990E+15 -1.400 22428.00 DUPLICATE aC3H5 + O2 <=> CH3CO + CH2O 1.190E+15 -1.010 20128.00 aC3H5 + O2 <=> C2H3CHO + OH 1.820E+13 -0.410 22859.00 DUPLICATE aC3H5 + HO2 <=> C3H6 + O2 2.660E+12 0.000 0.00 aC3H5 + HO2 <=> OH + C2H3 + CH2O 6.600E+12 0.000 0.00 aC3H5 + HCO <=> C3H6 + CO 6.000E+13 0.000 0.00 aC3H5 + CH3 (+ M) <=> C4H81 (+ M) 1.000E+14 -0.320 -262.30 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.910E+60 -12.810 6250.00/ TROE/0.104 1606.0 60000.0 6118.4/ aC3H5 + CH3 <=> aC3H4 + CH4 3.000E+12 -0.320 -131.00 DUPLICATE aC3H5 <=> CH3CCH2 7.060E+56 -14.080 75868.00 CH3CCH2 + H <=> pC3H4 + H2 3.340E+12 0.000 0.00 DUPLICATE CH3CCH2 + O <=> CH3 + CH2CO 6.000E+13 0.000 0.00 CH3CCH2 + OH <=> CH3 + CH2CO + H 5.000E+12 0.000 0.00 CH3CCH2 + O2 <=> CH3CO + CH2O 1.000E+11 0.000 0.00 CH3CCH2 + HO2 <=> CH3 + CH2CO + OH 2.000E+13 0.000 0.00 CH3CCH2 + HCO <=> C3H6 + CO 9.000E+13 0.000 0.00 CH3CCH2 + CH3 <=> pC3H4 + CH4 1.000E+11 0.000 0.00 DUPLICATE C3H6 + H (+ M) <=> nC3H7 (+ M) 1.330E+13 0.000 3260.70 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/6.260E+38 -6.660 7000.00/ TROE/1.0 1000.0 1310.0 48097.0/ C3H6 + H <=> C2H4 + CH3 8.000E+21 -2.390 11180.00 C3H6 + H <=> aC3H5 + H2 173000.000 2.500 2490.00 DUPLICATE C3H6 + H <=> CH3CCH2 + H2 400000.000 2.500 9790.00 C3H6 + O <=> CH2CO + CH3 + H 8.000E+07 1.650 327.00 C3H6 + O <=> C2H3CHO + 2H 4.000E+07 1.650 327.00 C3H6 + O <=> C2H5 + HCO 3.500E+07 1.650 -972.00 C3H6 + O <=> aC3H5 + OH 1.800E+11 0.700 5880.00 DUPLICATE C3H6 + O <=> CH3CCH2 + OH 6.000E+10 0.700 7630.00 C3H6 + OH <=> aC3H5 + H2O 3.100E+06 2.000 -298.00 DUPLICATE C3H6 + OH <=> CH3CCH2 + H2O 1.100E+06 2.000 1450.00 C3H6 + HO2 <=> aC3H5 + H2O2 7130.000 2.770 14913.00 DUPLICATE C3H6 + CH3 <=> aC3H5 + CH4 2.200 3.500 5675.00 DUPLICATE C3H6 + CH3 <=> CH3CCH2 + CH4 0.840 3.500 11660.00 C3H6 + C2H3 <=> C4H6 + CH3 7.230E+11 0.000 5000.00 C3H6 + HO2 <=> CH3CHOCH2 + OH 1.090E+12 0.000 14200.00 C2H3CHO + H <=> C2H4 + HCO 1.080E+11 0.454 5820.00 C2H3CHO + O <=> C2H3 + OH + CO 3.000E+13 0.000 3540.00 C2H3CHO + O <=> CH2O + CH2CO 1.900E+07 1.800 220.00 C2H3CHO + OH <=> C2H3 + H2O + CO 3.430E+09 1.180 -447.00 C2H3CHO + C2H3 <=> C4H6 + HCO 2.800E+21 -2.440 14720.00 CH3CHOCH2 <=> CH3CH2CHO 1.840E+14 0.000 58500.00 CH3CHOCH2 <=> C2H5 + HCO 2.450E+13 0.000 58500.00 CH3CHOCH2 <=> CH3 + CH2CHO 2.450E+13 0.000 58800.00 CH3CHOCH2 <=> CH3 + CH3CO 4.540E+13 0.000 59900.00 nC3H7 + H <=> C2H5 + CH3 3.700E+24 -2.920 12505.00 DUPLICATE nC3H7 + H <=> C3H6 + H2 1.800E+12 0.000 0.00 DUPLICATE nC3H7 + O <=> C2H5 + CH2O 9.600E+13 0.000 0.00 DUPLICATE nC3H7 + OH <=> C3H6 + H2O 2.400E+13 0.000 0.00 DUPLICATE nC3H7 + O2 <=> C3H6 + HO2 9.000E+10 0.000 0.00 DUPLICATE nC3H7 + HO2 <=> C2H5 + OH + CH2O 2.400E+13 0.000 0.00 nC3H7 + CH3 <=> CH4 + C3H6 1.100E+13 0.000 0.00 DUPLICATE C4H4 + H <=> iC4H5 4.900E+51 -11.920 17700.00 DUPLICATE C4H4 + O <=> C3H3 + HCO 6.000E+08 1.450 -860.00 iC4H5 + H <=> C4H4 + H2 3.000E+13 0.000 0.00 DUPLICATE iC4H5 + H <=> C3H3 + CH3 2.000E+13 0.000 2000.00 DUPLICATE iC4H5 + OH <=> C4H4 + H2O 4.000E+12 0.000 0.00 DUPLICATE iC4H5 + HCO <=> C4H6 + CO 5.000E+12 0.000 0.00 iC4H5 + HO2 <=> C4H6 + O2 6.000E+11 0.000 0.00 DUPLICATE iC4H5 + HO2 <=> C2H3 + CH2CO + OH 6.600E+12 0.000 0.00 DUPLICATE iC4H5 + H2O2 <=> C4H6 + HO2 1.210E+10 0.000 -596.00 DUPLICATE iC4H5 + O2 <=> CH2CO + CH2CHO 2.160E+10 0.000 2500.00 DUPLICATE C4H6 <=> iC4H5 + H 5.700E+36 -6.270 112353.0 DUPLICATE C4H6 <=> C4H4 + H2 2.500E+15 0.000 94700.00 C4H6 + H <=> iC4H5 + H2 665000.000 2.530 9240.00 DUPLICATE C4H6 + H <=> C2H4 + C2H3 1.460E+30 -4.340 21647.00 C4H6 + H <=> pC3H4 + CH3 2.000E+12 0.000 7000.00 C4H6 + H <=> aC3H4 + CH3 2.000E+12 0.000 7000.00 C4H6 + O <=> iC4H5 + OH 7.500E+06 1.900 3740.00 DUPLICATE C4H6 + OH <=> iC4H5 + H2O 3.100E+06 2.000 430.00 DUPLICATE C4H6 + CH3 <=> iC4H5 + CH4 1.000E+14 0.000 19800.00 DUPLICATE C4H6 + C2H3 <=> iC4H5 + C2H4 2.500E+13 0.000 19800.00 C4H6 + C3H3 <=> iC4H5 + aC3H4 5.000E+12 0.000 19500.00 C4H6 + aC3H5 <=> iC4H5 + C3H6 5.000E+12 0.000 19500.00 C4H6-2 <=> C4H6 3.000E+13 0.000 65000.00 DUPLICATE C4H6-2 + H <=> CH3 + pC3H4 260000.000 2.500 1000.00 DUPLICATE C4H7 <=> C4H6 + H 2.480E+53 -12.300 52000.00 C4H7 + H (+ M) <=> C4H81 (+ M) 3.600E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.010E+48 -9.320 5833.60/ TROE/0.498 1314.0 1314.0 50000.0/ C4H7 + H <=> CH3 + aC3H5 2.000E+21 -2.000 11000.00 C4H7 + H <=> C4H6 + H2 1.800E+12 0.000 0.00 C4H7 + O2 <=> C4H6 + HO2 1.000E+11 0.000 0.00 C4H7 + HO2 <=> CH2O + OH + aC3H5 2.400E+13 0.000 0.00 DUPLICATE C4H7 + HCO <=> C4H81 + CO 6.000E+13 0.000 0.00 C4H7 + CH3 <=> C4H6 + CH4 1.100E+13 0.000 0.00 C4H81 + H (+ M) <=> pC4H9 (+ M) 1.330E+13 0.000 3260.70 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/6.260E+38 -6.660 7000.00/ TROE/1.0 1000.0 1310.0 48097.0/ C4H81 + H <=> C2H4 + C2H5 1.600E+22 -2.390 11180.00 DUPLICATE C4H81 + H <=> C3H6 + CH3 3.200E+22 -2.390 11180.00 DUPLICATE C4H81 + H <=> C4H7 + H2 650000.000 2.540 6756.00 DUPLICATE C4H81 + O <=> nC3H7 + HCO 3.300E+08 1.450 -402.00 C4H81 + O <=> C4H7 + OH 1.500E+13 0.000 5760.00 DUPLICATE C4H81 + O <=> C4H7 + OH 2.600E+13 0.000 4470.00 DUPLICATE C4H81 + OH <=> C4H7 + H2O 700.000 2.660 527.00 DUPLICATE C4H81 + O2 <=> C4H7 + HO2 2.000E+13 0.000 50930.00 C4H81 + HO2 <=> C4H7 + H2O2 1.000E+12 0.000 14340.00 C4H81 + CH3 <=> C4H7 + CH4 0.450 3.650 7153.00 C2H4 + C2H5 <=> pC4H9 1.500E+11 0.000 7300.00 DUPLICATE pC4H9 + H <=> 2C2H5 3.700E+24 -2.920 12505.00 pC4H9 + H <=> C4H81 + H2 1.800E+12 0.000 0.00 pC4H9 + O <=> nC3H7 + CH2O 9.600E+13 0.000 0.00 pC4H9 + OH <=> C4H81 + H2O 2.400E+13 0.000 0.00 pC4H9 + O2 <=> C4H81 + HO2 2.700E+11 0.000 0.00 pC4H9 + HO2 <=> nC3H7 + OH + CH2O 2.400E+13 0.000 0.00 pC4H9 + CH3 <=> C4H81 + CH4 1.100E+13 0.000 0.00 PXC5H9 + H (+ M) <=> C5H10 (+ M) 3.600E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.010E+48 -9.320 5833.60/ TROE/0.498 1314.0 1314.0 50000.0/ PXC5H9 + H <=> CH3 + C4H7 2.000E+21 -2.000 11000.00 PXC5H9 + HO2 <=> CH2O + OH + C4H7 2.400E+13 0.000 0.00 PXC5H9 + HCO <=> C5H10 + CO 6.000E+13 0.000 0.00 PXC5H9 <=> C2H4 + aC3H5 1.040E+12 -0.370 25124.00 DUPLICATE cC5H9 <=> PXC5H9 2.150E+12 -0.300 33721.00 cC5H9 <=> cC5H8 + H 6.530E+11 -0.550 33140.00 C5H10 <=> C2H5 + aC3H5 7.240E+22 -1.940 75470.00 DUPLICATE C5H10 <=> C3H6 + C2H4 1.620E+06 1.810 53454.00 C5H10 + H <=> C2H4 + nC3H7 8.000E+21 -2.390 11180.00 C5H10 + H <=> C3H6 + C2H5 1.600E+22 -2.390 11180.00 C5H10 + H <=> PXC5H9 + H2 0.0323 4.700 3679.00 DUPLICATE C5H10 + O <=> pC4H9 + HCO 3.300E+08 1.450 -402.00 C5H10 + O <=> PXC5H9 + OH 0.745 4.170 2766.00 C5H10 + OH <=> PXC5H9 + H2O 700.000 2.660 527.00 DUPLICATE C5H10 + O2 <=> PXC5H9 + HO2 2.000E+13 0.000 50930.00 C5H10 + HO2 <=> PXC5H9 + H2O2 1.000E+12 0.000 14340.00 C5H10 + CH3 <=> PXC5H9 + CH4 2.580E-08 6.080 6223.00 PXC5H11 (+ M) <=> C2H4 + nC3H7 (+ M) 1.000E+13 0.000 28366.40 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/7.100E-35 15.411 -600.00/ TROE/-5.91 333.0 28.0 50000.0/ PXC5H11 + H <=> nC3H7 + C2H5 3.700E+24 -2.920 12505.00 PXC5H11 + H <=> C5H10 + H2 1.800E+12 0.000 0.00 PXC5H11 + O <=> pC4H9 + CH2O 9.600E+13 0.000 0.00 PXC5H11 + OH <=> C5H10 + H2O 2.400E+13 0.000 0.00 PXC5H11 + O2 <=> C5H10 + HO2 9.000E+10 0.000 0.00 PXC5H11 + CH3 <=> C5H10 + CH4 1.100E+13 0.000 0.00 PXC6H11 + H (+ M) <=> C6H12 (+ M) 3.600E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.010E+48 -9.320 5833.60/ TROE/0.498 1314.0 1314.0 50000.0/ PXC6H11 + H <=> CH3 + PXC5H9 2.000E+21 -2.000 11000.00 PXC6H11 + HO2 <=> CH2O + OH + PXC5H9 2.400E+13 0.000 0.00 PXC6H11 + HCO <=> C6H12 + CO 6.000E+13 0.000 0.00 C6H12 <=> aC3H5 + nC3H7 1.070E+23 -2.030 74958.00 DUPLICATE C6H12 <=> 2C3H6 7.080E+06 1.650 53752.00 C6H12 + H <=> C2H4 + pC4H9 8.000E+21 -2.390 11180.00 C6H12 + H <=> C3H6 + nC3H7 1.600E+22 -2.390 11180.00 C6H12 + H <=> PXC6H11 + H2 0.0323 4.700 3679.00 DUPLICATE C6H12 + H <=> SAXC6H11 + H2 54000.000 2.500 -1900.00 C6H12 + O <=> PXC5H11 + HCO 3.300E+08 1.450 -402.00 C6H12 + O <=> PXC6H11 + OH 0.745 4.170 2766.00 C6H12 + OH <=> PXC6H11 + H2O 700.000 2.660 527.00 DUPLICATE C6H12 + O2 <=> PXC6H11 + HO2 2.000E+13 0.000 50930.00 C6H12 + HO2 <=> PXC6H11 + H2O2 1.000E+12 0.000 14340.00 C6H12 + CH3 <=> PXC6H11 + CH4 2.580E-08 6.080 6223.00 PXC6H13 (+ M) <=> C2H4 + pC4H9 (+ M) 1.020E+12 0.300 27273.60 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/7.100E-35 15.411 -600.00/ TROE/-5.91 333.0 28.0 50000.0/ SXC6H13 (+ M) <=> C3H6 + nC3H7 (+ M) 4.470E+11 0.570 28044.50 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.700E-33 14.910 -600.00/ TROE/-6.53 333.0 28.0 50000.0/ S2XC6H13 (+ M) <=> C2H5 + C4H81 (+ M) 3.550E+12 0.290 28296.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/4.500E-26 13.090 -600.50/ TROE/-0.74 308.0 28.0 50000.0/ S2XC6H13 (+ M) <=> C5H10 + CH3 (+ M) 8.130E+10 0.780 29648.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/4.000E-39 16.782 -600.40/ TROE/-7.03 314.0 28.0 50000.0/ PXC6H13 + H <=> pC4H9 + C2H5 3.700E+24 -2.920 12505.00 PXC6H13 + H <=> C6H12 + H2 1.800E+12 0.000 0.00 PXC6H13 + O <=> PXC5H11 + CH2O 9.600E+13 0.000 0.00 PXC6H13 + OH <=> C6H12 + H2O 2.400E+13 0.000 0.00 PXC6H13 + O2 <=> C6H12 + HO2 9.000E+10 0.000 0.00 PXC6H13 + HO2 <=> PXC5H11 + OH + CH2O 2.400E+13 0.000 0.00 PXC6H13 + CH3 <=> C6H12 + CH4 1.100E+13 0.000 0.00 SXC6H13 + H <=> pC4H9 + C2H5 1.400E+28 -3.940 15916.00 SXC6H13 + H <=> C6H12 + H2 3.200E+12 0.000 0.00 SXC6H13 + OH <=> C6H12 + H2O 2.400E+13 0.000 0.00 SXC6H13 + O2 <=> C6H12 + HO2 1.300E+11 0.000 0.00 SXC6H13 + CH3 <=> CH4 + C6H12 2.200E+14 -0.680 0.00 S2XC6H13 + O2 <=> C6H12 + HO2 1.300E+11 0.000 0.00 PXC7H13 + H (+ M) <=> C7H14 (+ M) 3.600E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.010E+48 -9.320 5833.60/ TROE/0.498 1314.0 1314.0 50000.0/ PXC7H13 + H <=> CH3 + PXC6H11 2.000E+21 -2.000 11000.00 PXC7H13 + HO2 <=> CH2O + OH + PXC6H11 2.400E+13 0.000 0.00 PXC7H13 + HCO <=> C7H14 + CO 6.000E+13 0.000 0.00 C2H4 + PXC5H9 <=> PXC7H13 3.000E+11 0.000 7300.00 DUPLICATE C7H14 <=> pC4H9 + aC3H5 1.070E+23 -2.030 74958.00 DUPLICATE C7H14 <=> C4H81 + C3H6 7.080E+06 1.650 53752.00 C7H14 + H <=> C2H4 + PXC5H11 8.000E+21 -2.390 11180.00 C7H14 + H <=> C3H6 + pC4H9 1.600E+22 -2.390 11180.00 C7H14 + H <=> PXC7H13 + H2 0.0323 4.700 3679.00 DUPLICATE C7H14 + O <=> PXC6H13 + HCO 3.300E+08 1.450 -402.00 C7H14 + O <=> PXC7H13 + OH 0.745 4.170 2766.00 C7H14 + OH <=> PXC7H13 + H2O 700.000 2.660 527.00 DUPLICATE C7H14 + O2 <=> PXC7H13 + HO2 2.000E+13 0.000 50930.00 C7H14 + HO2 <=> PXC7H13 + H2O2 1.000E+12 0.000 14340.00 C7H14 + CH3 <=> PXC7H13 + CH4 2.580E-08 6.080 6223.00 PXC7H15 (+ M) <=> C2H4 + PXC5H11 (+ M) 7.940E+11 0.330 27210.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/2.800E-44 18.729 -602.50/ TROE/-14.66 219.0 28.0 50000.0/ S2XC7H15 (+ M) <=> nC3H7 + C4H81 (+ M) 2.950E+12 0.310 28257.10 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/2.000E-38 16.814 -602.40/ TROE/-20.96 221.0 28.0 50000.0/ S2XC7H15 (+ M) <=> C6H12 + CH3 (+ M) 1.100E+11 0.750 29401.60 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.060E-42 18.004 -602.40/ TROE/-20.94 217.0 28.0 50000.0/ S3XC7H15 (+ M) <=> C2H5 + C5H10 (+ M) 5.890E+12 0.310 28257.10 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/2.100E-38 16.897 -602.50/ TROE/-27.54 224.0 28.0 50000.0/ PXC7H15 + H (+ M) <=> NC7H16 (+ M) 3.600E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.010E+48 -9.320 5833.60/ TROE/0.498 1314.0 1314.0 50000.0/ PXC7H15 + H <=> PXC5H11 + C2H5 3.700E+24 -2.920 12505.00 PXC7H15 + H <=> C7H14 + H2 1.800E+12 0.000 0.00 PXC7H15 + O <=> PXC6H13 + CH2O 9.600E+13 0.000 0.00 PXC7H15 + OH <=> C7H14 + H2O 2.400E+13 0.000 0.00 PXC7H15 + O2 <=> C7H14 + HO2 9.000E+10 0.000 0.00 PXC7H15 + HO2 <=> PXC6H13 + OH + CH2O 2.400E+13 0.000 0.00 PXC7H15 + HCO <=> NC7H16 + CO 9.000E+13 0.000 0.00 PXC7H15 + CH3 <=> C7H14 + CH4 1.100E+13 0.000 0.00 S2XC7H15 + O2 <=> C7H14 + HO2 1.300E+11 0.000 0.00 S3XC7H15 + O2 <=> C7H14 + HO2 1.300E+11 0.000 0.00 PXC6H13 + CH3 <=> NC7H16 1.930E+14 -0.320 0.00 PXC5H11 + C2H5 <=> NC7H16 1.880E+14 -0.500 0.00 pC4H9 + nC3H7 <=> NC7H16 1.880E+14 -0.500 0.00 DUPLICATE NC7H16 + OH <=> PXC7H15 + H2O 2.730E+07 1.810 868.30 NC7H16 + OH <=> S2XC7H15 + H2O 1.140E+07 1.810 -1015.40 NC7H16 + OH <=> S3XC7H15 + H2O 5.620E+11 0.320 846.50 NC7H16 + O2 <=> PXC7H15 + HO2 4.000E+13 0.000 50930.00 NC7H16 + O2 <=> S2XC7H15 + HO2 8.000E+13 0.000 47590.00 NC7H16 + O2 <=> S3XC7H15 + HO2 4.000E+13 0.000 47590.00 NC7H16 + HO2 <=> PXC7H15 + H2O2 61100.000 2.650 17496.00 NC7H16 + HO2 <=> S2XC7H15 + H2O2 14200.000 2.770 14913.00 NC7H16 + HO2 <=> S3XC7H15 + H2O2 7130.000 2.770 14913.00 NC7H16 + H <=> PXC7H15 + H2 0.0645 4.700 3679.00 NC7H16 + H <=> S2XC7H15 + H2 0.0634 4.650 1340.00 NC7H16 + H <=> S3XC7H15 + H2 0.0317 4.650 1340.00 NC7H16 + O <=> PXC7H15 + OH 1.490 4.170 2766.00 NC7H16 + O <=> S2XC7H15 + OH 36.500 3.750 825.00 NC7H16 + O <=> S3XC7H15 + OH 18.200 3.750 825.00 NC7H16 + CH3 <=> PXC7H15 + CH4 5.160E-08 6.080 6223.00 NC7H16 + CH3 <=> S2XC7H15 + CH4 2.820E-07 5.890 4768.00 NC7H16 + CH3 <=> S3XC7H15 + CH4 1.410E-07 5.890 4768.00 PXC8H15 + H (+ M) <=> C8H16 (+ M) 3.600E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.010E+48 -9.320 5833.60/ TROE/0.498 1314.0 1314.0 50000.0/ PXC8H15 + H <=> CH3 + PXC7H13 2.000E+21 -2.000 11000.00 PXC8H15 + HO2 <=> CH2O + OH + PXC7H13 2.400E+13 0.000 0.00 PXC8H15 + HCO <=> C8H16 + CO 6.000E+13 0.000 0.00 C2H4 + PXC6H11 <=> PXC8H15 3.000E+11 0.000 7300.00 DUPLICATE C8H16 <=> PXC5H11 + aC3H5 1.070E+23 -2.030 74958.00 DUPLICATE C8H16 <=> C5H10 + C3H6 7.080E+06 1.650 53752.00 C8H16 + H <=> C2H4 + PXC6H13 8.000E+21 -2.390 11180.00 C8H16 + H <=> C3H6 + PXC5H11 1.600E+22 -2.390 11180.00 C8H16 + H <=> PXC8H15 + H2 0.0323 4.700 3679.00 DUPLICATE C8H16 + O <=> PXC7H15 + HCO 3.300E+08 1.450 -402.00 C8H16 + O <=> PXC8H15 + OH 0.745 4.170 2766.00 C8H16 + OH <=> PXC8H15 + H2O 700.000 2.660 527.00 DUPLICATE C8H16 + O2 <=> PXC8H15 + HO2 2.000E+13 0.000 50930.00 C8H16 + HO2 <=> PXC8H15 + H2O2 1.000E+12 0.000 14340.00 C8H16 + CH3 <=> PXC8H15 + CH4 2.580E-08 6.080 6223.00 PXC8H17 (+ M) <=> C2H4 + PXC6H13 (+ M) 9.120E+11 0.310 27237.80 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.800E-57 23.463 -602.40/ TROE/-2.46 206.0 28.0 50000.0/ S2XC8H17 (+ M) <=> pC4H9 + C4H81 (+ M) 2.040E+13 0.040 28493.60 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.000E-43 18.430 -602.80/ TROE/-34.47 208.0 28.0 50000.0/ S2XC8H17 (+ M) <=> C7H14 + CH3 (+ M) 9.550E+09 1.080 29387.70 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.300E-46 19.133 -602.70/ TROE/-34.36 210.0 28.0 50000.0/ S3XC8H17 (+ M) <=> nC3H7 + C5H10 (+ M) 5.500E+11 0.550 28084.30 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.100E-43 18.418 -602.90/ TROE/-32.13 207.0 28.0 50000.0/ S3XC8H17 (+ M) <=> C6H12 + C2H5 (+ M) 6.760E+09 1.110 27023.20 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/8.200E-43 18.276 -602.90/ TROE/-30.04 210.0 28.0 50000.0/ PXC8H17 + H (+ M) <=> NC8H18 (+ M) 3.600E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.010E+48 -9.320 5833.60/ TROE/0.498 1314.0 1314.0 50000.0/ PXC8H17 + H <=> PXC6H13 + C2H5 3.700E+24 -2.920 12505.00 PXC8H17 + H <=> C8H16 + H2 1.800E+12 0.000 0.00 PXC8H17 + O <=> PXC7H15 + CH2O 9.600E+13 0.000 0.00 PXC8H17 + OH <=> C8H16 + H2O 2.400E+13 0.000 0.00 PXC8H17 + O2 <=> C8H16 + HO2 9.000E+10 0.000 0.00 PXC8H17 + HO2 <=> PXC7H15 + OH + CH2O 2.400E+13 0.000 0.00 PXC8H17 + HCO <=> NC8H18 + CO 9.000E+13 0.000 0.00 PXC8H17 + CH3 <=> C8H16 + CH4 1.100E+13 0.000 0.00 S2XC8H17 + O2 <=> C8H16 + HO2 1.300E+11 0.000 0.00 S3XC8H17 + O2 <=> C8H16 + HO2 1.300E+11 0.000 0.00 PXC7H15 + CH3 <=> NC8H18 1.930E+14 -0.320 0.00 PXC6H13 + C2H5 <=> NC8H18 1.880E+14 -0.500 0.00 PXC5H11 + nC3H7 <=> NC8H18 1.880E+14 -0.500 0.00 2pC4H9 <=> NC8H18 1.880E+14 -0.500 0.00 NC8H18 + OH <=> PXC8H17 + H2O 2.730E+07 1.810 868.30 NC8H18 + OH <=> S2XC8H17 + H2O 1.140E+07 1.810 -1015.40 NC8H18 + OH <=> S3XC8H17 + H2O 1.120E+12 0.320 846.50 NC8H18 + O2 <=> PXC8H17 + HO2 4.000E+13 0.000 50930.00 NC8H18 + O2 <=> S2XC8H17 + HO2 8.000E+13 0.000 47590.00 NC8H18 + O2 <=> S3XC8H17 + HO2 8.000E+13 0.000 47590.00 NC8H18 + HO2 <=> PXC8H17 + H2O2 61100.000 2.650 17496.00 NC8H18 + HO2 <=> S2XC8H17 + H2O2 14200.000 2.770 14913.00 NC8H18 + HO2 <=> S3XC8H17 + H2O2 14200.000 2.770 14913.00 NC8H18 + H <=> PXC8H17 + H2 0.0645 4.700 3679.00 NC8H18 + H <=> S2XC8H17 + H2 0.0634 4.650 1340.00 NC8H18 + H <=> S3XC8H17 + H2 0.0634 4.650 1340.00 NC8H18 + O <=> PXC8H17 + OH 1.490 4.170 2766.00 NC8H18 + O <=> S2XC8H17 + OH 36.500 3.750 825.00 NC8H18 + O <=> S3XC8H17 + OH 36.500 3.750 825.00 NC8H18 + CH3 <=> PXC8H17 + CH4 5.160E-08 6.080 6223.00 NC8H18 + CH3 <=> S2XC8H17 + CH4 2.820E-07 5.890 4768.00 NC8H18 + CH3 <=> S3XC8H17 + CH4 2.820E-07 5.890 4768.00 PXC9H17 + H (+ M) <=> C9H18 (+ M) 3.600E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.010E+48 -9.320 5833.60/ TROE/0.498 1314.0 1314.0 50000.0/ PXC9H17 + H <=> CH3 + PXC8H15 2.000E+21 -2.000 11000.00 PXC9H17 + HO2 <=> CH2O + OH + PXC8H15 2.400E+13 0.000 0.00 PXC9H17 + HCO <=> C9H18 + CO 6.000E+13 0.000 0.00 C2H4 + PXC7H13 <=> PXC9H17 3.000E+11 0.000 7300.00 C9H18 <=> PXC6H13 + aC3H5 1.070E+23 -2.030 74958.00 C9H18 <=> C6H12 + C3H6 7.080E+06 1.650 53752.00 C9H18 + H <=> C2H4 + PXC7H15 8.000E+21 -2.390 11180.00 C9H18 + H <=> C3H6 + PXC6H13 1.600E+22 -2.390 11180.00 C9H18 + H <=> PXC9H17 + H2 0.0323 4.700 3679.00 C9H18 + O <=> PXC8H17 + HCO 3.300E+08 1.450 -402.00 C9H18 + O <=> PXC9H17 + OH 0.745 4.170 2766.00 C9H18 + OH <=> PXC9H17 + H2O 700.000 2.660 527.00 C9H18 + O2 <=> PXC9H17 + HO2 2.000E+13 0.000 50930.00 C9H18 + HO2 <=> PXC9H17 + H2O2 1.000E+12 0.000 14340.00 C9H18 + CH3 <=> PXC9H17 + CH4 2.580E-08 6.080 6223.00 PXC9H19 (+ M) <=> C2H4 + PXC7H15 (+ M) 9.120E+11 0.310 27237.80 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.800E-57 23.463 -602.40/ TROE/-2.46 206.0 28.0 50000.0/ SXC9H19 (+ M) <=> C3H6 + PXC6H13 (+ M) 6.030E+10 0.840 27820.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.000E-43 18.591 -602.50/ TROE/-43.32 200.0 28.0 50000.0/ S2XC9H19 (+ M) <=> PXC5H11 + C4H81 (+ M) 2.040E+13 0.040 28493.60 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.000E-43 18.430 -602.80/ TROE/-34.47 208.0 28.0 50000.0/ S2XC9H19 (+ M) <=> C8H16 + CH3 (+ M) 9.550E+09 1.080 29387.70 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.300E-46 19.133 -602.70/ TROE/-34.36 210.0 28.0 50000.0/ S3XC9H19 (+ M) <=> pC4H9 + C5H10 (+ M) 5.500E+11 0.550 28084.30 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.100E-43 18.418 -602.90/ TROE/-32.13 207.0 28.0 50000.0/ S3XC9H19 (+ M) <=> C7H14 + C2H5 (+ M) 6.760E+09 1.110 27023.20 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/8.200E-43 18.276 -602.90/ TROE/-30.04 210.0 28.0 50000.0/ S4XC9H19 (+ M) <=> nC3H7 + C6H12 (+ M) 1.100E+12 0.550 28084.30 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/6.200E-43 18.418 -602.90/ TROE/-32.13 207.0 28.0 50000.0/ PXC9H19 + H (+ M) <=> NC9H20 (+ M) 3.600E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.010E+48 -9.320 5833.60/ TROE/0.498 1314.0 1314.0 50000.0/ PXC9H19 + H <=> PXC7H15 + C2H5 3.700E+24 -2.920 12505.00 PXC9H19 + H <=> C9H18 + H2 1.800E+12 0.000 0.00 PXC9H19 + O <=> PXC8H17 + CH2O 9.600E+13 0.000 0.00 PXC9H19 + OH <=> C9H18 + H2O 2.400E+13 0.000 0.00 PXC9H19 + O2 <=> C9H18 + HO2 9.000E+10 0.000 0.00 PXC9H19 + HO2 <=> PXC8H17 + OH + CH2O 2.400E+13 0.000 0.00 PXC9H19 + HCO <=> NC9H20 + CO 9.000E+13 0.000 0.00 PXC9H19 + CH3 <=> C9H18 + CH4 1.100E+13 0.000 0.00 SXC9H19 + H (+ M) <=> NC9H20 (+ M) 2.400E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.700E+58 -12.080 11263.70/ TROE/0.649 1213.1 1213.1 13369.7/ SXC9H19 + H <=> PXC7H15 + C2H5 1.400E+28 -3.940 15916.00 SXC9H19 + H <=> C9H18 + H2 3.200E+12 0.000 0.00 SXC9H19 + OH <=> C9H18 + H2O 2.400E+13 0.000 0.00 SXC9H19 + O2 <=> C9H18 + HO2 1.300E+11 0.000 0.00 SXC9H19 + HCO <=> NC9H20 + CO 1.200E+14 0.000 0.00 SXC9H19 + CH3 <=> CH4 + C9H18 2.200E+14 -0.680 0.00 S2XC9H19 + O2 <=> C9H18 + HO2 1.300E+11 0.000 0.00 S3XC9H19 + O2 <=> C9H18 + HO2 1.300E+11 0.000 0.00 S4XC9H19 + O2 <=> C9H18 + HO2 1.300E+11 0.000 0.00 PXC8H17 + CH3 <=> NC9H20 1.930E+14 -0.320 0.00 PXC7H15 + C2H5 <=> NC9H20 1.880E+14 -0.500 0.00 PXC6H13 + nC3H7 <=> NC9H20 1.880E+14 -0.500 0.00 PXC5H11 + pC4H9 <=> NC9H20 1.880E+14 -0.500 0.00 NC9H20 + OH <=> PXC9H19 + H2O 2.730E+07 1.810 868.30 NC9H20 + OH <=> SXC9H19 + H2O 1.410E+10 0.940 504.70 NC9H20 + OH <=> S2XC9H19 + H2O 1.140E+07 1.810 -1015.40 NC9H20 + OH <=> S3XC9H19 + H2O 1.120E+12 0.320 846.50 NC9H20 + OH <=> S4XC9H19 + H2O 5.620E+11 0.320 846.50 NC9H20 + O2 <=> PXC9H19 + HO2 4.000E+13 0.000 50930.00 NC9H20 + O2 <=> SXC9H19 + HO2 8.000E+13 0.000 47590.00 NC9H20 + O2 <=> S2XC9H19 + HO2 8.000E+13 0.000 47590.00 NC9H20 + O2 <=> S3XC9H19 + HO2 8.000E+13 0.000 47590.00 NC9H20 + O2 <=> S4XC9H19 + HO2 4.000E+13 0.000 47590.00 NC9H20 + HO2 <=> PXC9H19 + H2O2 61100.000 2.650 17496.00 NC9H20 + HO2 <=> SXC9H19 + H2O2 14200.000 2.770 14913.00 NC9H20 + HO2 <=> S2XC9H19 + H2O2 14200.000 2.770 14913.00 NC9H20 + HO2 <=> S3XC9H19 + H2O2 14200.000 2.770 14913.00 NC9H20 + HO2 <=> S4XC9H19 + H2O2 7130.000 2.770 14913.00 NC9H20 + H <=> PXC9H19 + H2 0.0645 4.700 3679.00 NC9H20 + H <=> SXC9H19 + H2 0.0634 4.650 1340.00 NC9H20 + H <=> S2XC9H19 + H2 0.0634 4.650 1340.00 NC9H20 + H <=> S3XC9H19 + H2 0.0634 4.650 1340.00 NC9H20 + H <=> S4XC9H19 + H2 0.0317 4.650 1340.00 NC9H20 + O <=> PXC9H19 + OH 1.490 4.170 2766.00 NC9H20 + O <=> SXC9H19 + OH 36.500 3.750 825.00 NC9H20 + O <=> S2XC9H19 + OH 36.500 3.750 825.00 NC9H20 + O <=> S3XC9H19 + OH 36.500 3.750 825.00 NC9H20 + O <=> S4XC9H19 + OH 18.200 3.750 825.00 NC9H20 + CH3 <=> PXC9H19 + CH4 5.160E-08 6.080 6223.00 NC9H20 + CH3 <=> SXC9H19 + CH4 2.820E-07 5.890 4768.00 NC9H20 + CH3 <=> S2XC9H19 + CH4 2.820E-07 5.890 4768.00 NC9H20 + CH3 <=> S3XC9H19 + CH4 2.820E-07 5.890 4768.00 NC9H20 + CH3 <=> S4XC9H19 + CH4 1.410E-07 5.890 4768.00 PXC10H19 + H (+ M) <=> C10H20 (+ M) 3.600E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.010E+48 -9.320 5833.60/ TROE/0.498 1314.0 1314.0 50000.0/ PXC10H19 + H <=> CH3 + PXC9H17 2.000E+21 -2.000 11000.00 PXC10H19 + HO2 <=> CH2O + OH + PXC9H17 2.400E+13 0.000 0.00 PXC10H19 + HCO <=> C10H20 + CO 6.000E+13 0.000 0.00 C2H4 + PXC8H15 <=> PXC10H19 3.000E+11 0.000 7300.00 DUPLICATE C10H20 <=> PXC7H15 + aC3H5 1.070E+23 -2.030 74958.00 DUPLICATE C10H20 <=> C7H14 + C3H6 7.080E+06 1.650 53752.00 C10H20 + H <=> C2H4 + PXC8H17 8.000E+21 -2.390 11180.00 C10H20 + H <=> C3H6 + PXC7H15 1.600E+22 -2.390 11180.00 C10H20 + H <=> PXC10H19 + H2 0.0323 4.700 3679.00 DUPLICATE C10H20 + O <=> PXC9H19 + HCO 3.300E+08 1.450 -402.00 C10H20 + O <=> PXC10H19 + OH 0.745 4.170 2766.00 C10H20 + OH <=> PXC10H19 + H2O 700.000 2.660 527.00 DUPLICATE C10H20 + O2 <=> PXC10H19 + HO2 2.000E+13 0.000 50930.00 C10H20 + HO2 <=> PXC10H19 + H2O2 1.000E+12 0.000 14340.00 C10H20 + CH3 <=> PXC10H19 + CH4 2.580E-08 6.080 6223.00 PXC10H21 (+ M) <=> C2H4 + PXC8H17 (+ M) 9.120E+11 0.310 27237.80 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.800E-57 23.463 -602.40/ TROE/-2.46 206.0 28.0 50000.0/ SXC10H21 (+ M) <=> C3H6 + PXC7H15 (+ M) 6.030E+10 0.840 27820.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.000E-43 18.591 -602.50/ TROE/-43.32 200.0 28.0 50000.0/ S2XC10H21 (+ M) <=> PXC6H13 + C4H81 (+ M) 2.040E+13 0.040 28493.60 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.000E-43 18.430 -602.80/ TROE/-34.47 208.0 28.0 50000.0/ S2XC10H21 (+ M) <=> C9H18 + CH3 (+ M) 9.550E+09 1.080 29387.70 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.300E-46 19.133 -602.70/ TROE/-34.36 210.0 28.0 50000.0/ S3XC10H21 (+ M) <=> PXC5H11 + C5H10 (+ M) 5.500E+11 0.550 28084.30 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.100E-43 18.418 -602.90/ TROE/-32.13 207.0 28.0 50000.0/ S3XC10H21 (+ M) <=> C8H16 + C2H5 (+ M) 6.760E+09 1.110 27023.20 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/8.200E-43 18.276 -602.90/ TROE/-30.04 210.0 28.0 50000.0/ S4XC10H21 (+ M) <=> pC4H9 + C6H12 (+ M) 5.500E+11 0.550 28084.30 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.100E-43 18.418 -602.90/ TROE/-32.13 207.0 28.0 50000.0/ S4XC10H21 (+ M) <=> C7H14 + nC3H7 (+ M) 5.500E+11 0.550 28084.30 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.100E-43 18.418 -602.90/ TROE/-32.13 207.0 28.0 50000.0/ PXC10H21 + H (+ M) <=> NC10H22 (+ M) 3.600E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.010E+48 -9.320 5833.60/ TROE/0.498 1314.0 1314.0 50000.0/ PXC10H21 + H <=> PXC8H17 + C2H5 3.700E+24 -2.920 12505.00 PXC10H21 + H <=> C10H20 + H2 1.800E+12 0.000 0.00 PXC10H21 + O <=> PXC9H19 + CH2O 9.600E+13 0.000 0.00 PXC10H21 + OH <=> C10H20 + H2O 2.400E+13 0.000 0.00 PXC10H21 + O2 <=> C10H20 + HO2 9.000E+10 0.000 0.00 PXC10H21 + HO2 <=> PXC9H19 + OH + CH2O 2.400E+13 0.000 0.00 PXC10H21 + HCO <=> NC10H22 + CO 9.000E+13 0.000 0.00 PXC10H21 + CH3 <=> C10H20 + CH4 1.100E+13 0.000 0.00 SXC10H21 + H (+ M) <=> NC10H22 (+ M) 2.400E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.700E+58 -12.080 11263.70/ TROE/0.649 1213.1 1213.1 13369.7/ SXC10H21 + H <=> PXC8H17 + C2H5 1.400E+28 -3.940 15916.00 SXC10H21 + H <=> C10H20 + H2 3.200E+12 0.000 0.00 SXC10H21 + OH <=> C10H20 + H2O 2.400E+13 0.000 0.00 SXC10H21 + O2 <=> C10H20 + HO2 1.300E+11 0.000 0.00 SXC10H21 + HCO <=> NC10H22 + CO 1.200E+14 0.000 0.00 SXC10H21 + CH3 <=> CH4 + C10H20 2.200E+14 -0.680 0.00 S2XC10H21 + O2 <=> C10H20 + HO2 1.300E+11 0.000 0.00 S3XC10H21 + O2 <=> C10H20 + HO2 1.300E+11 0.000 0.00 S4XC10H21 + O2 <=> C10H20 + HO2 1.300E+11 0.000 0.00 PXC9H19 + CH3 <=> NC10H22 1.930E+14 -0.320 0.00 PXC8H17 + C2H5 <=> NC10H22 1.880E+14 -0.500 0.00 PXC7H15 + nC3H7 <=> NC10H22 1.880E+14 -0.500 0.00 PXC6H13 + pC4H9 <=> NC10H22 1.880E+14 -0.500 0.00 2PXC5H11 <=> NC10H22 1.880E+14 -0.500 0.00 NC10H22 + OH <=> PXC10H21 + H2O 2.730E+07 1.810 868.30 NC10H22 + OH <=> SXC10H21 + H2O 1.410E+10 0.940 504.70 NC10H22 + OH <=> S2XC10H21 + H2O 1.140E+07 1.810 -1015.40 NC10H22 + OH <=> S3XC10H21 + H2O 1.120E+12 0.320 846.50 NC10H22 + OH <=> S4XC10H21 + H2O 1.120E+12 0.320 846.50 NC10H22 + O2 <=> PXC10H21 + HO2 4.000E+13 0.000 50930.00 NC10H22 + O2 <=> SXC10H21 + HO2 8.000E+13 0.000 47590.00 NC10H22 + O2 <=> S2XC10H21 + HO2 8.000E+13 0.000 47590.00 NC10H22 + O2 <=> S3XC10H21 + HO2 8.000E+13 0.000 47590.00 NC10H22 + O2 <=> S4XC10H21 + HO2 8.000E+13 0.000 47590.00 NC10H22 + HO2 <=> PXC10H21 + H2O2 61100.000 2.650 17496.00 NC10H22 + HO2 <=> SXC10H21 + H2O2 14200.000 2.770 14913.00 NC10H22 + HO2 <=> S2XC10H21 + H2O2 14200.000 2.770 14913.00 NC10H22 + HO2 <=> S3XC10H21 + H2O2 14200.000 2.770 14913.00 NC10H22 + HO2 <=> S4XC10H21 + H2O2 14200.000 2.770 14913.00 NC10H22 + H <=> PXC10H21 + H2 0.0645 4.700 3679.00 NC10H22 + H <=> SXC10H21 + H2 0.0634 4.650 1340.00 NC10H22 + H <=> S2XC10H21 + H2 0.0634 4.650 1340.00 NC10H22 + H <=> S3XC10H21 + H2 0.0634 4.650 1340.00 NC10H22 + H <=> S4XC10H21 + H2 0.0634 4.650 1340.00 NC10H22 + O <=> PXC10H21 + OH 1.490 4.170 2766.00 NC10H22 + O <=> SXC10H21 + OH 36.500 3.750 825.00 NC10H22 + O <=> S2XC10H21 + OH 36.500 3.750 825.00 NC10H22 + O <=> S3XC10H21 + OH 36.500 3.750 825.00 NC10H22 + O <=> S4XC10H21 + OH 36.500 3.750 825.00 NC10H22 + CH3 <=> PXC10H21 + CH4 5.160E-08 6.080 6223.00 NC10H22 + CH3 <=> SXC10H21 + CH4 2.820E-07 5.890 4768.00 NC10H22 + CH3 <=> S2XC10H21 + CH4 2.820E-07 5.890 4768.00 NC10H22 + CH3 <=> S3XC10H21 + CH4 2.820E-07 5.890 4768.00 NC10H22 + CH3 <=> S4XC10H21 + CH4 2.820E-07 5.890 4768.00 PXC11H21 + H (+ M) <=> C11H22 (+ M) 3.600E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.010E+48 -9.320 5833.60/ TROE/0.498 1314.0 1314.0 50000.0/ PXC11H21 + H <=> CH3 + PXC10H19 2.000E+21 -2.000 11000.00 PXC11H21 + HO2 <=> CH2O + OH + PXC10H19 2.400E+13 0.000 0.00 PXC11H21 + HCO <=> C11H22 + CO 6.000E+13 0.000 0.00 C2H4 + PXC9H17 <=> PXC11H21 3.000E+11 0.000 7300.00 C11H22 <=> PXC8H17 + aC3H5 1.070E+23 -2.030 74958.00 C11H22 <=> C8H16 + C3H6 7.080E+06 1.650 53752.00 C11H22 + H <=> C2H4 + PXC9H19 8.000E+21 -2.390 11180.00 C11H22 + H <=> C3H6 + PXC8H17 1.600E+22 -2.390 11180.00 C11H22 + H <=> PXC11H21 + H2 0.0323 4.700 3679.00 C11H22 + O <=> PXC10H21 + HCO 3.300E+08 1.450 -402.00 C11H22 + O <=> PXC11H21 + OH 0.745 4.170 2766.00 C11H22 + OH <=> PXC11H21 + H2O 700.000 2.660 527.00 C11H22 + O2 <=> PXC11H21 + HO2 2.000E+13 0.000 50930.00 C11H22 + HO2 <=> PXC11H21 + H2O2 1.000E+12 0.000 14340.00 C11H22 + CH3 <=> PXC11H21 + CH4 2.580E-08 6.080 6223.00 S2XC11H23 (+ M) <=> PXC7H15 + C4H81 (+ M) 2.040E+13 0.040 28493.60 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.000E-43 18.430 -602.80/ TROE/-34.47 208.0 28.0 50000.0/ S2XC11H23 (+ M) <=> C10H20 + CH3 (+ M) 9.550E+09 1.080 29387.70 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.300E-46 19.133 -602.70/ TROE/-34.36 210.0 28.0 50000.0/ S4XC11H23 (+ M) <=> PXC5H11 + C6H12 (+ M) 5.500E+11 0.550 28084.30 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.100E-43 18.418 -602.90/ TROE/-32.13 207.0 28.0 50000.0/ S4XC11H23 (+ M) <=> C8H16 + nC3H7 (+ M) 5.500E+11 0.550 28084.30 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.100E-43 18.418 -602.90/ TROE/-32.13 207.0 28.0 50000.0/ S5XC11H23 (+ M) <=> pC4H9 + C7H14 (+ M) 1.100E+12 0.550 28084.30 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/6.200E-43 18.418 -602.90/ TROE/-32.13 207.0 28.0 50000.0/ S2XC11H23 + O2 <=> C11H22 + HO2 1.300E+11 0.000 0.00 S4XC11H23 + O2 <=> C11H22 + HO2 1.300E+11 0.000 0.00 S5XC11H23 + O2 <=> C11H22 + HO2 1.300E+11 0.000 0.00 PXC12H23 + H (+ M) <=> C12H24 (+ M) 3.600E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.010E+48 -9.320 5833.60/ TROE/0.498 1314.0 1314.0 50000.0/ PXC12H23 + H <=> CH3 + PXC11H21 2.000E+21 -2.000 11000.00 PXC12H23 + HO2 <=> CH2O + OH + PXC11H21 2.400E+13 0.000 0.00 PXC12H23 + HCO <=> C12H24 + CO 6.000E+13 0.000 0.00 C2H4 + PXC10H19 <=> PXC12H23 3.000E+11 0.000 7300.00 DUPLICATE C12H24 <=> PXC9H19 + aC3H5 1.070E+23 -2.030 74958.00 DUPLICATE C12H24 <=> C9H18 + C3H6 7.080E+06 1.650 53752.00 C12H24 + H <=> C2H4 + PXC10H21 8.000E+21 -2.390 11180.00 C12H24 + H <=> C3H6 + PXC9H19 1.600E+22 -2.390 11180.00 C12H24 + H <=> PXC12H23 + H2 0.0323 4.700 3679.00 C12H24 + O <=> PXC12H23 + OH 0.745 4.170 2766.00 C12H24 + OH <=> PXC12H23 + H2O 700.000 2.660 527.00 C12H24 + O2 <=> PXC12H23 + HO2 2.000E+13 0.000 50930.00 C12H24 + HO2 <=> PXC12H23 + H2O2 1.000E+12 0.000 14340.00 C12H24 + CH3 <=> PXC12H23 + CH4 2.580E-08 6.080 6223.00 SXC12H25 (+ M) <=> C3H6 + PXC9H19 (+ M) 6.030E+10 0.840 27820.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.000E-43 18.591 -602.50/ TROE/-43.32 200.0 28.0 50000.0/ S4XC12H25 (+ M) <=> C6H12 + PXC6H13 (+ M) 5.500E+11 0.550 28084.30 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.100E-43 18.418 -602.90/ TROE/-32.13 207.0 28.0 50000.0/ S4XC12H25 (+ M) <=> C9H18 + nC3H7 (+ M) 5.500E+11 0.550 28084.30 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.100E-43 18.418 -602.90/ TROE/-32.13 207.0 28.0 50000.0/ S5XC12H25 (+ M) <=> C7H14 + PXC5H11 (+ M) 5.500E+11 0.550 28084.30 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.100E-43 18.418 -602.90/ TROE/-32.13 207.0 28.0 50000.0/ S5XC12H25 (+ M) <=> C8H16 + pC4H9 (+ M) 5.500E+11 0.550 28084.30 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.100E-43 18.418 -602.90/ TROE/-32.13 207.0 28.0 50000.0/ SXC12H25 + H <=> PXC10H21 + C2H5 1.400E+28 -3.940 15916.00 SXC12H25 + H <=> C12H24 + H2 3.200E+12 0.000 0.00 SXC12H25 + OH <=> C12H24 + H2O 2.400E+13 0.000 0.00 SXC12H25 + O2 <=> C12H24 + HO2 1.300E+11 0.000 0.00 SXC12H25 + CH3 <=> CH4 + C12H24 2.200E+14 -0.680 0.00 S4XC12H25 + O2 <=> C12H24 + HO2 1.300E+11 0.000 0.00 S5XC12H25 + O2 <=> C12H24 + HO2 1.300E+11 0.000 0.00 PXC10H21 (+ M) <=> S3XC10H21 (+ M) 5.130 3.230 16847.80 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.100E-44 18.749 -602.90/ TROE/-20.15 205.0 28.0 5.0E+06/ PXC9H19 (+ M) <=> S3XC9H19 (+ M) 5.130 3.230 16847.80 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/5.100E-44 18.749 -602.90/ TROE/-20.15 205.0 28.0 5.0E+06/ PXC8H17 (+ M) <=> S3XC8H17 (+ M) 5.130 3.230 16847.80 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/5.100E-44 18.749 -602.90/ TROE/-20.15 205.0 28.0 5.0E+06/ PXC7H15 (+ M) <=> S3XC7H15 (+ M) 117.000 2.850 17247.20 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.900E-31 14.521 -599.00/ TROE/-8.1 259.0 28.0 5.0E+06/ PXC6H13 (+ M) <=> S2XC6H13 (+ M) 6.980 3.200 16557.70 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/2.000E-26 12.833 -600.70/ TROE/-10.14 307.0 28.0 5.0E+06/ PXC10H21 (+ M) <=> S4XC10H21 (+ M) 22.900 2.820 10755.60 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/9.900E-38 17.215 -603.00/ TROE/-16.33 200.0 28.0 5.0E+06/ PXC9H19 (+ M) <=> S4XC9H19 (+ M) 22.900 2.820 10755.60 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/9.900E-38 17.215 -603.00/ TROE/-16.33 200.0 28.0 5.0E+06/ PXC8H17 (+ M) <=> S3XC8H17 (+ M) 22.900 2.820 10755.60 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/9.900E-38 17.215 -603.00/ TROE/-16.33 200.0 28.0 5.0E+06/ PXC7H15 (+ M) <=> S2XC7H15 (+ M) 676.000 2.390 10405.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.400E-26 13.202 -602.60/ TROE/-25.39 215.0 28.0 5.0E+06/ PXC6H13 (+ M) <=> SXC6H13 (+ M) 183.000 2.550 10960.30 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.400E-26 13.087 -602.60/ TROE/-25.38 215.0 28.0 5.0E+06/ PXC10H21 (+ M) <=> S4XC10H21 (+ M) 2.950 3.080 11015.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/3.900E-34 15.855 -606.20/ TROE/-15.24 216.0 28.0 5.0E+06/ PXC9H19 (+ M) <=> S3XC9H19 (+ M) 2.950 3.080 11015.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/3.900E-34 15.855 -606.20/ TROE/-15.24 216.0 28.0 5.0E+06/ PXC8H17 (+ M) <=> S2XC8H17 (+ M) 2.950 3.080 11015.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.900E-34 15.855 -606.20/ TROE/-15.24 216.0 28.0 5.0E+06/ SXC12H25 (+ M) <=> S4XC12H25 (+ M) 1.410 3.320 16144.40 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.200E-30 14.079 -606.40/ TROE/-21.93 219.0 28.0 5.0E+06/ S2XC11H23 (+ M) <=> S5XC11H23 (+ M) 1.410 3.320 16144.40 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.200E-30 14.079 -606.40/ TROE/-21.93 219.0 28.0 5.0E+06/ S4XC10H21 (+ M) <=> S2XC10H21 (+ M) 1.410 3.320 16144.40 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.200E-30 14.079 -606.40/ TROE/-21.93 219.0 28.0 5.0E+06/ S4XC10H21 (+ M) <=> SXC10H21 (+ M) 1.410 3.320 16144.40 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/5.200E-30 14.079 -606.40/ TROE/-21.93 219.0 28.0 5.0E+06/ SXC9H19 (+ M) <=> S4XC9H19 (+ M) 1.410 3.320 16144.40 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.200E-30 14.079 -606.40/ TROE/-21.93 219.0 28.0 5.0E+06/ S3XC9H19 (+ M) <=> S2XC9H19 (+ M) 1.410 3.320 16144.40 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.200E-30 14.079 -606.40/ TROE/-21.93 219.0 28.0 5.0E+06/ SXC12H25 (+ M) <=> S5XC12H25 (+ M) 1.860 3.270 13197.70 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/3.000E-27 13.481 -606.50/ TROE/-19.7 215.0 28.0 5.0E+06/ S2XC11H23 (+ M) <=> S4XC11H23 (+ M) 1.860 3.270 13197.70 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.000E-27 13.481 -606.50/ TROE/-19.7 215.0 28.0 5.0E+06/ S2XC10H21 (+ M) <=> S3XC10H21 (+ M) 1.860 3.270 13197.70 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.000E-27 13.481 -606.50/ TROE/-19.7 215.0 28.0 5.0E+06/ SXC10H21 (+ M) <=> S4XC10H21 (+ M) 1.860 3.270 13197.70 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/3.000E-27 13.481 -606.50/ TROE/-19.7 215.0 28.0 5.0E+06/ SXC9H19 (+ M) <=> S2XC9H19 (+ M) 1.860 3.270 13197.70 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/3.000E-27 13.481 -606.50/ TROE/-19.7 215.0 28.0 5.0E+06/ SXC12H25 (+ M) <=> S5XC12H25 (+ M) 2.950 3.080 12865.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/3.900E-34 15.855 1243.80/ TROE/-15.24 216.0 28.0 5.0E+06/ SXC10H21 (+ M) <=> S3XC10H21 (+ M) 2.950 3.080 12865.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.900E-34 15.855 1243.80/ TROE/-15.24 216.0 28.0 5.0E+06/ SXC9H19 (+ M) <=> S2XC9H19 (+ M) 2.950 3.080 12865.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/3.900E-34 15.855 1243.80/ TROE/-15.24 216.0 28.0 5.0E+06/ P12OOHX2 <=> C12H24 + HO2 8.500E+12 0.000 25573.60 DUPLICATE PXC3H6cC6H11 + CH3 <=> C4H9cC6H11 1.930E+14 -0.320 0.00 PXCH2cC6H11 + nC3H7 <=> C4H9cC6H11 1.880E+14 -0.500 0.00 cC6H11 + pC4H9 <=> C4H9cC6H11 1.290E+14 -0.350 0.00 C4H9cC6H11 <=> C10H20-5 4.170E+15 0.000 74000.00 C4H9cC6H11 <=> C4H9-2-1C6H11 4.170E+15 0.000 74000.00 C10H20-5 <=> SAXC7H13 + nC3H7 2.140E+23 -2.030 74958.00 C10H20-5 <=> C7H14 + C3H6 1.420E+07 1.650 53752.00 C10H20-5 + H <=> nC3H7 + C7H14 8.000E+21 -2.390 11180.00 C10H20-5 + H <=> pC4H9 + C6H12 8.000E+21 -2.390 11180.00 C4H9-2-1C6H11 <=> PAXCH2-2-1C6H11 + nC3H7 2.140E+23 -2.030 74958.00 C4H9-2-1C6H11 <=> CH3-2-1C6H11 + C3H6 1.420E+07 1.650 53752.00 C4H9-2-1C6H11 + H <=> nC3H7 + CH3-2-1C6H11 1.600E+22 -2.390 11180.00 C4H9-2-1C6H11 + H <=> C6H12 + pC4H9 8.000E+21 -2.390 11180.00 C4H9cC6H11 + H <=> S3XC4H8cC6H11 + H2 310000.000 2.510 4286.00 C4H9cC6H11 + H <=> S2XC4H8cC6H11 + H2 235000.000 2.530 4218.00 C4H9cC6H11 + H <=> SXC4H8cC6H11 + H2 380000.000 2.500 4467.00 C4H9cC6H11 + H <=> PXC4H8cC6H11 + H2 306000.000 2.590 6603.00 C4H9cC6H11 + H <=> C4H9TXcC6H10 + H2 383000.000 2.410 2653.00 C4H9cC6H11 + H <=> C4H9S2XcC6H10 + H2 456000.000 2.540 5324.00 C4H9cC6H11 + H <=> C4H9S3XcC6H10 + H2 276000.000 2.600 4078.00 C4H9cC6H11 + H <=> C4H9S4XcC6H10 + H2 285000.000 2.520 4463.00 C4H9cC6H11 + O <=> PXC4H8cC6H11 + OH 2.200E+06 2.400 5504.00 C4H9cC6H11 + O <=> SXC4H8cC6H11 + OH 310000.000 2.500 2225.00 C4H9cC6H11 + O <=> S2XC4H8cC6H11 + OH 310000.000 2.500 2225.00 C4H9cC6H11 + O <=> S3XC4H8cC6H11 + OH 310000.000 2.500 2225.00 C4H9cC6H11 + O <=> C4H9TXcC6H10 + OH 157000.000 2.500 1110.00 C4H9cC6H11 + O <=> C4H9S2XcC6H10 + OH 95200.000 2.710 2106.00 C4H9cC6H11 + O <=> C4H9S3XcC6H10 + OH 95200.000 2.710 2106.00 C4H9cC6H11 + O <=> C4H9S4XcC6H10 + OH 47600.000 2.710 2106.00 C4H9cC6H11 + OH <=> S3XC4H8cC6H11 + H2O 4640.000 2.830 -1746.00 C4H9cC6H11 + OH <=> S2XC4H8cC6H11 + H2O 3490.000 2.820 -1428.00 C4H9cC6H11 + OH <=> SXC4H8cC6H11 + H2O 3670.000 2.870 -1026.00 C4H9cC6H11 + OH <=> PXC4H8cC6H11 + H2O 7530.000 2.900 605.00 C4H9cC6H11 + OH <=> C4H9TXcC6H10 + H2O 1430.000 2.920 -2653.00 C4H9cC6H11 + OH <=> C4H9S2XcC6H10 + H2O 13000.000 2.860 -1846.00 C4H9cC6H11 + OH <=> C4H9S3XcC6H10 + H2O 10300.000 2.860 -1197.00 C4H9cC6H11 + OH <=> C4H9S4XcC6H10 + H2O 8040.000 2.880 -1226.00 C4H9cC6H11 + O2 <=> PXC4H8cC6H11 + HO2 2.000E+13 0.000 50930.00 C4H9cC6H11 + O2 <=> SXC4H8cC6H11 + HO2 4.000E+13 0.000 47590.00 C4H9cC6H11 + O2 <=> S2XC4H8cC6H11 + HO2 4.000E+13 0.000 47590.00 C4H9cC6H11 + O2 <=> S3XC4H8cC6H11 + HO2 4.000E+13 0.000 47590.00 C4H9cC6H11 + O2 <=> C4H9TXcC6H10 + HO2 4.000E+13 0.000 44000.00 C4H9cC6H11 + O2 <=> C4H9S2XcC6H10 + HO2 8.000E+13 0.000 47590.00 C4H9cC6H11 + O2 <=> C4H9S3XcC6H10 + HO2 8.000E+13 0.000 47590.00 C4H9cC6H11 + O2 <=> C4H9S4XcC6H10 + HO2 4.000E+13 0.000 47590.00 C4H9cC6H11 + HO2 <=> PXC4H8cC6H11 + H2O2 30500.000 2.650 17496.00 C4H9cC6H11 + HO2 <=> SXC4H8cC6H11 + H2O2 7130.000 2.770 14913.00 C4H9cC6H11 + HO2 <=> S2XC4H8cC6H11 + H2O2 7130.000 2.770 14913.00 C4H9cC6H11 + HO2 <=> S3XC4H8cC6H11 + H2O2 7130.000 2.770 14913.00 C4H9cC6H11 + HO2 <=> C4H9TXcC6H10 + H2O2 1240.000 2.770 10500.00 C4H9cC6H11 + HO2 <=> C4H9S2XcC6H10 + H2O2 281.000 3.250 14998.00 C4H9cC6H11 + HO2 <=> C4H9S3XcC6H10 + H2O2 281.000 3.250 14998.00 C4H9cC6H11 + HO2 <=> C4H9S4XcC6H10 + H2O2 140.000 3.250 14998.00 C4H9cC6H11 + CH3 <=> S3XC4H8cC6H11 + CH4 99.100 3.260 13774.00 C4H9cC6H11 + CH3 <=> S2XC4H8cC6H11 + CH4 32.300 3.290 11053.00 C4H9cC6H11 + CH3 <=> SXC4H8cC6H11 + CH4 178.000 3.140 11394.00 C4H9cC6H11 + CH3 <=> PXC4H8cC6H11 + CH4 27.500 3.260 10901.00 C4H9cC6H11 + CH3 <=> C4H9TXcC6H10 + CH4 9.990 3.290 8715.00 C4H9cC6H11 + CH3 <=> C4H9S2XcC6H10 + CH4 228.000 3.200 11161.00 C4H9cC6H11 + CH3 <=> C4H9S3XcC6H10 + CH4 215.000 3.170 11468.00 C4H9cC6H11 + CH3 <=> C4H9S4XcC6H10 + CH4 143.000 3.240 11347.00 SXC4H8cC6H11 (+ M) <=> PXCH2cC6H11 + C3H6 (+ M) 6.030E+10 0.840 27820.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.000E-43 18.591 -602.50/ TROE/-43.32 200.0 28.0 50000.0/ S2XC4H8cC6H11 (+ M) <=> cC6H11 + C4H81 (+ M) 5.810E+10 0.850 23824.10 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/8.900E-37 16.685 -661.70/ TROE/-64.15 179.0 28.0 50000.0/ S3XC4H8cC6H11 (+ M) <=> C2H3cC6H11 + C2H5 (+ M) 6.760E+09 1.110 27023.20 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/8.200E-43 18.276 -602.90/ TROE/-30.04 210.0 28.0 50000.0/ C4H9TXcC6H10 (+ M) <=> CH2cC6H10 + nC3H7 (+ M) 3.630E+11 0.680 24579.20 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.100E-39 17.570 -603.10/ TROE/-31.51 219.0 28.0 50000.0/ C4H9TXcC6H10 (+ M) <=> PXC4H8-2-1C6H11 (+ M) 6.030E+12 0.070 27982.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.100E-33 15.290 -602.60/ TROE/-25.11 225.0 28.0 50000.0/ C4H9S2XcC6H10 (+ M) <=> cC6H10 + pC4H9 (+ M) 5.470E+11 0.500 27798.10 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/8.500E-37 16.210 -603.10/ TROE/-26.7 216.0 28.0 50000.0/ C4H9S2XcC6H10 (+ M) <=> PX10-5C10H19 (+ M) 3.010E+12 0.070 26982.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.100E-33 15.290 -602.60/ TROE/-25.11 225.0 28.0 50000.0/ C4H9S2XcC6H10 (+ M) <=> PXC3H6-3-1C7H13 (+ M) 3.010E+12 0.070 27982.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.100E-33 15.290 -602.60/ TROE/-25.11 225.0 28.0 50000.0/ C4H9S3XcC6H10 (+ M) <=> S4XC10H19 (+ M) 3.010E+12 0.070 26982.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.100E-33 15.290 -602.60/ TROE/-25.11 225.0 28.0 50000.0/ PXC4H8cC6H11 + H (+ M) <=> C4H9cC6H11 (+ M) 3.600E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.500E+48 -9.320 5833.60/ TROE/0.498 1314.0 1314.0 50000.0/ PXC4H8cC6H11 + H <=> cC6H11 + pC4H9 1.850E+24 -2.920 12505.00 PXC4H8cC6H11 + O <=> PXC3H6cC6H11 + CH2O 9.600E+13 0.000 0.00 SXC4H8cC6H11 + H (+ M) <=> C4H9cC6H11 (+ M) 2.400E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.700E+58 -12.080 11263.70/ TROE/0.649 1213.1 1213.1 13369.7/ SXC4H8cC6H11 + H <=> cC6H11 + pC4H9 1.400E+28 -3.940 15916.00 S2XC4H8cC6H11 + H (+ M) <=> C4H9cC6H11 (+ M) 2.400E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.700E+58 -12.080 11263.70/ TROE/0.649 1213.1 1213.1 13369.7/ S2XC4H8cC6H11 + H <=> cC6H11 + pC4H9 1.400E+28 -3.940 15916.00 S3XC4H8cC6H11 + H (+ M) <=> C4H9cC6H11 (+ M) 2.400E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.700E+58 -12.080 11263.70/ TROE/0.649 1213.1 1213.1 13369.7/ S3XC4H8cC6H11 + H <=> cC6H11 + pC4H9 1.400E+28 -3.940 15916.00 C4H9TXcC6H10 + H (+ M) <=> C4H9cC6H11 (+ M) 2.400E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.470E+61 -12.940 8000.00/ TROE/0.0 1456.4 1000.0 10000.5/ C4H9TXcC6H10 + H <=> cC6H11 + pC4H9 2.600E+36 -6.120 25640.00 C4H9S2XcC6H10 + H (+ M) <=> C4H9cC6H11 (+ M) 4.800E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.700E+58 -12.080 11263.70/ TROE/0.649 1213.1 1213.1 13369.7/ C4H9S2XcC6H10 + H <=> cC6H11 + pC4H9 2.800E+28 -3.940 15916.00 C4H9S3XcC6H10 + H (+ M) <=> C4H9cC6H11 (+ M) 4.800E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.700E+58 -12.080 11263.70/ TROE/0.649 1213.1 1213.1 13369.7/ C4H9S3XcC6H10 + H <=> cC6H11 + pC4H9 2.800E+28 -3.940 15916.00 C4H9S4XcC6H10 + H (+ M) <=> C4H9cC6H11 (+ M) 2.400E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.700E+58 -12.080 11263.70/ TROE/0.649 1213.1 1213.1 13369.7/ C4H9S4XcC6H10 + H <=> cC6H11 + pC4H9 1.400E+28 -3.940 15916.00 PXC4H8cC6H11 <=> S3XC4H8cC6H11 7.140E+08 0.930 17627.00 PXC4H8cC6H11 <=> C4H9TXcC6H10 5.100E+08 0.730 9950.00 PXC4H8cC6H11 <=> C4H9S2XcC6H10 1.200E+09 0.740 11027.00 PXC4H8cC6H11 <=> C4H9S3XcC6H10 9.760E+07 0.800 18020.00 PXC4H8cC6H11 <=> C4H9S4XcC6H10 3.330E+07 0.840 26554.00 SXC4H8cC6H11 <=> C4H9TXcC6H10 3.570E+08 0.930 17967.00 SXC4H8cC6H11 <=> C4H9S2XcC6H10 1.050E+09 0.820 15027.00 SXC4H8cC6H11 <=> C4H9S3XcC6H10 3.950E+08 0.790 18372.00 SXC4H8cC6H11 <=> C4H9S4XcC6H10 1.750E+08 0.780 24300.00 S2XC4H8cC6H11 <=> C4H9S2XcC6H10 4.580E+08 0.900 22900.00 S2XC4H8cC6H11 <=> C4H9S3XcC6H10 4.940E+08 0.780 18644.00 S2XC4H8cC6H11 <=> C4H9S4XcC6H10 7.970E+08 0.780 22740.00 S3XC4H8cC6H11 <=> C4H9S3XcC6H10 4.650E+08 1.020 28687.00 S3XC4H8cC6H11 <=> C4H9S4XcC6H10 1.190E+09 0.920 22700.00 PX10-5C10H19 (+ M) <=> SAX4-5C10H19 (+ M) 155.000 2.830 15566.20 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.500E-30 14.560 -602.40/ TROE/-13.59 214.0 28.0 50000.0/ PX10-5C10H19 (+ M) <=> PX1-3C8H15 + C2H4 (+ M) 9.120E+11 0.310 27237.80 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.800E-57 23.463 -602.40/ TROE/-2.46 206.0 28.0 50000.0/ PXC3H6-3-1C7H13 (+ M) <=> PXCH2-3-1C7H13 + C2H4 (+ M) 9.120E+11 0.310 27237.80 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.800E-57 23.463 -602.40/ TROE/-2.46 206.0 28.0 50000.0/ S4XC10H19 (+ M) <=> SAXC10H19 (+ M) 155.000 2.830 15566.20 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.500E-30 14.560 -602.40/ TROE/-13.59 214.0 28.0 50000.0/ S4XC10H19 (+ M) <=> C6H12 + C4H7 (+ M) 5.500E+11 0.550 28084.30 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.100E-43 18.418 -602.90/ TROE/-32.13 207.0 28.0 50000.0/ SAX4-5C10H19 (+ M) <=> C2H5 + C8H14-13 (+ M) 3.390E+11 0.660 32262.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/4.000E-42 18.045 -602.60/ TROE/-18.5 246.0 28.0 50000.0/ SAXC10H19 (+ M) <=> C4H6 + PXC6H13 (+ M) 3.390E+11 0.660 32262.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/4.000E-42 18.045 -602.60/ TROE/-18.5 246.0 28.0 50000.0/ PXCH2cC6H11 + C2H5 <=> C3H7cC6H11 1.880E+14 -0.500 0.00 cC6H11 + nC3H7 <=> C3H7cC6H11 1.290E+14 -0.350 0.00 C3H7cC6H11 <=> C9H18-4 4.170E+15 0.000 74000.00 C3H7cC6H11 <=> C3H7-2-1C6H11 4.170E+15 0.000 74000.00 C9H18-4 <=> SAXC7H13 + C2H5 1.070E+23 -2.030 74958.00 C9H18-4 <=> SAXC6H11 + nC3H7 1.070E+23 -2.030 74958.00 C9H18-4 <=> C6H12 + C3H6 1.420E+07 1.650 53752.00 C9H18-4 + H <=> pC4H9 + C5H10 8.000E+21 -2.390 11180.00 C9H18-4 + H <=> C6H12 + nC3H7 8.000E+21 -2.390 11180.00 C3H7-2-1C6H11 <=> PAXCH2-2-1C6H11 + C2H5 1.070E+23 -2.030 74958.00 C3H7-2-1C6H11 + H <=> C6H12 + nC3H7 8.000E+21 -2.390 11180.00 C3H7cC6H11 + H <=> S2XC3H6cC6H11 + H2 380000.000 2.440 4688.00 C3H7cC6H11 + H <=> PXC3H6cC6H11 + H2 261000.000 2.570 6628.00 C3H7cC6H11 + H <=> C3H7TXcC6H10 + H2 413000.000 2.360 2835.00 C3H7cC6H11 + H <=> C3H7S2XcC6H10 + H2 392000.000 2.530 4353.00 C3H7cC6H11 + H <=> C3H7S3XcC6H10 + H2 303000.000 2.580 4116.00 C3H7cC6H11 + H <=> C3H7S4XcC6H10 + H2 252000.000 2.530 4406.00 C3H7cC6H11 + O <=> PXC3H6cC6H11 + OH 2.200E+06 2.400 5504.00 C3H7cC6H11 + O <=> S2XC3H6cC6H11 + OH 310000.000 2.500 2225.00 C3H7cC6H11 + O <=> C3H7TXcC6H10 + OH 157000.000 2.500 1110.00 C3H7cC6H11 + O <=> C3H7S2XcC6H10 + OH 95200.000 2.710 2106.00 C3H7cC6H11 + O <=> C3H7S3XcC6H10 + OH 95200.000 2.710 2106.00 C3H7cC6H11 + O <=> C3H7S4XcC6H10 + OH 47600.000 2.710 2106.00 C3H7cC6H11 + OH <=> S2XC3H6cC6H11 + H2O 3630.000 2.810 -1585.00 C3H7cC6H11 + OH <=> PXC3H6cC6H11 + H2O 6280.000 2.900 426.00 C3H7cC6H11 + OH <=> C3H7TXcC6H10 + H2O 1430.000 2.920 -2601.00 C3H7cC6H11 + OH <=> C3H7S2XcC6H10 + H2O 7790.000 2.850 -1764.00 C3H7cC6H11 + OH <=> C3H7S3XcC6H10 + H2O 9940.000 2.860 -1139.00 C3H7cC6H11 + OH <=> C3H7S4XcC6H10 + H2O 6700.000 2.860 -1149.00 C3H7cC6H11 + O2 <=> PXC3H6cC6H11 + HO2 2.000E+13 0.000 50930.00 C3H7cC6H11 + O2 <=> S2XC3H6cC6H11 + HO2 4.000E+13 0.000 47590.00 C3H7cC6H11 + O2 <=> C3H7TXcC6H10 + HO2 4.000E+13 0.000 44000.00 C3H7cC6H11 + O2 <=> C3H7S2XcC6H10 + HO2 8.000E+13 0.000 47590.00 C3H7cC6H11 + O2 <=> C3H7S3XcC6H10 + HO2 8.000E+13 0.000 47590.00 C3H7cC6H11 + O2 <=> C3H7S4XcC6H10 + HO2 4.000E+13 0.000 47590.00 C3H7cC6H11 + HO2 <=> PXC3H6cC6H11 + H2O2 30500.000 2.650 17496.00 C3H7cC6H11 + HO2 <=> S2XC3H6cC6H11 + H2O2 7130.000 2.770 14913.00 C3H7cC6H11 + HO2 <=> C3H7TXcC6H10 + H2O2 1240.000 2.770 10500.00 C3H7cC6H11 + HO2 <=> C3H7S2XcC6H10 + H2O2 281.000 3.250 14998.00 C3H7cC6H11 + HO2 <=> C3H7S3XcC6H10 + H2O2 281.000 3.250 14998.00 C3H7cC6H11 + HO2 <=> C3H7S4XcC6H10 + H2O2 140.000 3.250 14998.00 C3H7cC6H11 + CH3 <=> S2XC3H6cC6H11 + CH4 73.800 3.300 13603.00 C3H7cC6H11 + CH3 <=> PXC3H6cC6H11 + CH4 53.200 3.100 11666.00 C3H7cC6H11 + CH3 <=> C3H7TXcC6H10 + CH4 6.340 3.270 8906.00 C3H7cC6H11 + CH3 <=> C3H7S2XcC6H10 + CH4 33.700 3.360 10569.00 C3H7cC6H11 + CH3 <=> C3H7S3XcC6H10 + CH4 144.000 3.210 11387.00 C3H7cC6H11 + CH3 <=> C3H7S4XcC6H10 + CH4 30.000 3.280 11233.00 PXC3H6cC6H11 (+ M) <=> PXCH2cC6H11 + C2H4 (+ M) 9.120E+11 0.310 27237.80 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.800E-57 23.463 -602.40/ TROE/-2.46 206.0 28.0 50000.0/ S2XC3H6cC6H11 (+ M) <=> PX9-3C9H17 (+ M) 6.030E+12 0.070 26982.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.100E-33 15.290 -602.60/ TROE/-25.11 225.0 28.0 50000.0/ S2XC3H6cC6H11 (+ M) <=> C2H3cC6H11 + CH3 (+ M) 9.550E+09 1.080 29387.70 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.300E-46 19.133 -602.70/ TROE/-34.36 210.0 28.0 50000.0/ C3H7S2XcC6H10 (+ M) <=> cC6H10 + nC3H7 (+ M) 5.470E+11 0.500 27798.10 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/8.500E-37 16.210 -603.10/ TROE/-26.7 216.0 28.0 50000.0/ C3H7S2XcC6H10 (+ M) <=> PX9-4C9H17 (+ M) 3.010E+12 0.070 26982.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.100E-33 15.290 -602.60/ TROE/-25.11 225.0 28.0 50000.0/ C3H7S2XcC6H10 (+ M) <=> PXC3H6-3-1C6H11 (+ M) 3.010E+12 0.070 27982.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.100E-33 15.290 -602.60/ TROE/-25.11 225.0 28.0 50000.0/ C3H7TXcC6H10 (+ M) <=> CH2cC6H10 + C2H5 (+ M) 3.630E+11 0.680 24579.20 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.100E-39 17.570 -603.10/ TROE/-31.51 219.0 28.0 50000.0/ C3H7TXcC6H10 (+ M) <=> C3H7-2-PXC6H10 (+ M) 6.030E+12 0.070 27982.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.100E-33 15.290 -602.60/ TROE/-25.11 225.0 28.0 50000.0/ PXC3H6cC6H11 <=> C3H7S2XcC6H10 1.050E+09 0.820 15027.00 PXC3H6cC6H11 <=> C3H7TXcC6H10 3.570E+08 0.930 17967.00 PXC3H6cC6H11 <=> C3H7S3XcC6H10 3.950E+08 0.790 18372.00 PXC3H6cC6H11 <=> C3H7S4XcC6H10 1.750E+08 0.780 24300.00 S2XC3H6cC6H11 <=> C3H7S3XcC6H10 4.650E+08 1.020 28687.00 S2XC3H6cC6H11 <=> C3H7S4XcC6H10 1.190E+09 0.920 22700.00 PXC3H6cC6H11 + H (+ M) <=> C3H7cC6H11 (+ M) 3.600E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.500E+48 -9.320 5833.60/ TROE/0.498 1314.0 1314.0 50000.0/ PXC3H6cC6H11 + H <=> cC6H11 + nC3H7 1.850E+24 -2.920 12505.00 S2XC3H6cC6H11 + H (+ M) <=> C3H7cC6H11 (+ M) 4.800E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.700E+58 -12.080 11263.70/ TROE/0.649 1213.1 1213.1 13369.7/ S2XC3H6cC6H11 + H <=> cC6H11 + nC3H7 2.800E+28 -3.940 15916.00 C3H7S2XcC6H10 + H (+ M) <=> C3H7cC6H11 (+ M) 4.800E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.700E+58 -12.080 11263.70/ TROE/0.649 1213.1 1213.1 13369.7/ C3H7S2XcC6H10 + H <=> cC6H11 + nC3H7 2.800E+28 -3.940 15916.00 C3H7TXcC6H10 + H (+ M) <=> C3H7cC6H11 (+ M) 2.400E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.470E+61 -12.940 8000.00/ TROE/0.0 1456.4 1000.0 10000.5/ C3H7TXcC6H10 + H <=> cC6H11 + nC3H7 2.600E+36 -6.120 25640.00 C3H7S3XcC6H10 + H (+ M) <=> C3H7cC6H11 (+ M) 4.800E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.700E+58 -12.080 11263.70/ TROE/0.649 1213.1 1213.1 13369.7/ C3H7S3XcC6H10 + H <=> cC6H11 + nC3H7 2.800E+28 -3.940 15916.00 C3H7S4XcC6H10 + H (+ M) <=> C3H7cC6H11 (+ M) 4.800E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.700E+58 -12.080 11263.70/ TROE/0.649 1213.1 1213.1 13369.7/ C3H7S4XcC6H10 + H <=> cC6H11 + nC3H7 2.800E+28 -3.940 15916.00 PX9-3C9H17 (+ M) <=> PX1-3C7H13 + C2H4 (+ M) 9.120E+11 0.310 27237.80 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.800E-57 23.463 -602.40/ TROE/-2.46 206.0 28.0 50000.0/ PX9-4C9H17 (+ M) <=> PX1-3C7H13 + C2H4 (+ M) 9.120E+11 0.310 27237.80 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.800E-57 23.463 -602.40/ TROE/-2.46 206.0 28.0 50000.0/ PX9-4C9H17 (+ M) <=> SAX6-4C9H17 (+ M) 155.000 2.830 15566.20 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.500E-30 14.560 -602.40/ TROE/-13.59 214.0 28.0 50000.0/ PXC3H6-3-1C6H11 (+ M) <=> PXCH2-3-1C6H11 + C2H4 (+ M) 9.120E+11 0.310 27237.80 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.800E-57 23.463 -602.40/ TROE/-2.46 206.0 28.0 50000.0/ C2H5TXcC6H10 (+ M) <=> CH2cC6H10 + CH3 (+ M) 3.630E+11 0.680 24579.20 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.100E-39 17.570 -603.10/ TROE/-31.51 219.0 28.0 50000.0/ C2H5TXcC6H10 + H <=> cC6H11 + C2H5 2.600E+36 -6.120 25640.00 SAXC8H15 (+ M) <=> C4H6 + pC4H9 (+ M) 3.390E+11 0.660 32262.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/4.000E-42 18.045 -602.60/ TROE/-18.5 246.0 28.0 50000.0/ PX1-3C8H15 (+ M) <=> C8H14-13 + H (+ M) 3.050E+08 -1.350 32487.50 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/2.200E-38 13.170 -603.10/ TROE/-58.42 256.0 28.0 50000.0/ PXCH2-3-1C7H13 (+ M) <=> C4H6 + pC4H9 (+ M) 4.600E+11 -0.410 31253.70 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.800E-28 12.340 -603.20/ TROE/-19.24 231.0 28.0 50000.0/ C2H3cC6H11 + H <=> C2H4 + cC6H11 8.000E+21 -2.390 11180.00 C2H3cC6H11 + O <=> PXCH2cC6H11 + HCO 3.300E+08 1.450 -402.00 cC6H11 + C2H3 <=> C2H3cC6H11 8.250E+14 -0.700 0.00 C8H14-13 + H <=> C6H12 + C2H3 1.460E+30 -4.340 21647.00 cC6H11 + CH3 <=> CH3cC6H11 1.400E+15 -0.680 0.00 CH3cC6H11 <=> C7H14-2 4.170E+15 0.000 71000.00 CH3cC6H11 <=> C7H14 4.170E+15 0.000 71000.00 C7H14-2 <=> C4H81 + C3H6 1.420E+07 1.650 53752.00 C7H14-2 + H <=> C3H6 + pC4H9 8.000E+21 -2.390 11180.00 C7H14-2 + H <=> C4H81 + nC3H7 8.000E+21 -2.390 11180.00 C7H14-2 + O <=> C2H3CHO + pC4H9 + H 1.200E+08 1.650 327.00 C7H14-2 + OH <=> aC3H4 + H2O + pC4H9 3.100E+06 2.000 -298.00 CH3cC6H11 + H <=> PXCH2cC6H11 + H2 168000.000 2.610 6535.00 CH3cC6H11 + H <=> CH3TXcC6H10 + H2 543000.000 2.360 2887.00 CH3cC6H11 + H <=> CH3S2XcC6H10 + H2 311000.000 2.570 4359.00 CH3cC6H11 + H <=> CH3S4XcC6H10 + H2 266000.000 2.520 4452.00 CH3cC6H11 + O <=> PXCH2cC6H11 + OH 2.200E+06 2.400 5504.00 CH3cC6H11 + O <=> CH3TXcC6H10 + OH 157000.000 2.500 1110.00 CH3cC6H11 + O <=> CH3S2XcC6H10 + OH 95200.000 2.710 2106.00 CH3cC6H11 + O <=> CH3S4XcC6H10 + OH 47600.000 2.710 2106.00 CH3cC6H11 + OH <=> PXCH2cC6H11 + H2O 5330.000 2.900 504.00 CH3cC6H11 + OH <=> CH3TXcC6H10 + H2O 6690.000 2.820 2966.00 CH3cC6H11 + OH <=> CH3S2XcC6H10 + H2O 8130.000 2.840 -1479.00 CH3cC6H11 + OH <=> CH3S4XcC6H10 + H2O 5820.000 2.850 -1011.00 CH3cC6H11 + O2 <=> PXCH2cC6H11 + HO2 2.000E+13 0.000 50930.00 CH3cC6H11 + O2 <=> CH3TXcC6H10 + HO2 4.000E+13 0.000 44000.00 CH3cC6H11 + O2 <=> CH3S2XcC6H10 + HO2 8.000E+13 0.000 47590.00 CH3cC6H11 + O2 <=> CH3S4XcC6H10 + HO2 4.000E+13 0.000 47590.00 CH3cC6H11 + HO2 <=> PXCH2cC6H11 + H2O2 30500.000 2.650 17496.00 CH3cC6H11 + HO2 <=> CH3TXcC6H10 + H2O2 1240.000 2.770 10500.00 CH3cC6H11 + HO2 <=> CH3S2XcC6H10 + H2O2 281.000 3.250 14998.00 CH3cC6H11 + HO2 <=> CH3S4XcC6H10 + H2O2 140.000 3.250 14998.00 CH3cC6H11 + CH3 <=> PXCH2cC6H11 + CH4 37.500 3.270 13516.00 CH3cC6H11 + CH3 <=> CH3TXcC6H10 + CH4 19.100 3.270 9022.00 CH3cC6H11 + CH3 <=> CH3S2XcC6H10 + CH4 66.800 3.210 11418.00 CH3cC6H11 + CH3 <=> CH3S4XcC6H10 + CH4 18.200 3.360 10931.00 PXCH2cC6H11 (+ M) <=> PXC7H13 (+ M) 5.470E+11 0.500 27798.10 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/8.500E-37 16.210 -603.10/ TROE/-26.7 216.0 28.0 50000.0/ CH3TXcC6H10 (+ M) <=> CH3-2-PXC6H10 (+ M) 6.030E+12 0.070 27982.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.100E-33 15.290 -602.60/ TROE/-25.11 225.0 28.0 50000.0/ CH3S2XcC6H10 (+ M) <=> cC6H10 + CH3 (+ M) 1.760E+11 0.570 28791.60 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/4.700E-39 16.770 -603.10/ TROE/-27.89 216.0 28.0 50000.0/ CH3S2XcC6H10 (+ M) <=> CH3-3-PXC6H10 (+ M) 3.010E+12 0.070 27982.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.100E-33 15.290 -602.60/ TROE/-25.11 225.0 28.0 50000.0/ CH3S4XcC6H10 (+ M) <=> PXCH2-5-1C6H11 (+ M) 6.030E+12 0.070 27982.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.100E-33 15.290 -602.60/ TROE/-25.11 225.0 28.0 50000.0/ PXCH2cC6H11 <=> CH3S4XcC6H10 1.190E+09 0.920 22700.00 PXCH2cC6H11 + H (+ M) <=> CH3cC6H11 (+ M) 3.600E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.500E+48 -9.320 5833.60/ TROE/0.498 1314.0 1314.0 50000.0/ PXCH2cC6H11 + H <=> cC6H11 + CH3 1.850E+24 -2.920 12505.00 PXCH2cC6H11 + O <=> cC6H11 + CH2O 9.600E+13 0.000 0.00 CH3TXcC6H10 + H (+ M) <=> CH3cC6H11 (+ M) 2.400E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.470E+61 -12.940 8000.00/ TROE/0.0 1456.4 1000.0 10000.5/ CH3TXcC6H10 + H <=> cC6H11 + CH3 2.600E+36 -6.120 25640.00 CH3S2XcC6H10 + H (+ M) <=> CH3cC6H11 (+ M) 4.800E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.700E+58 -12.080 11263.70/ TROE/0.649 1213.1 1213.1 13369.7/ CH3S2XcC6H10 + H <=> cC6H11 + CH3 2.800E+28 -3.940 15916.00 CH3S4XcC6H10 + H (+ M) <=> CH3cC6H11 (+ M) 4.800E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.700E+58 -12.080 11263.70/ TROE/0.649 1213.1 1213.1 13369.7/ CH3S4XcC6H10 + H <=> cC6H11 + CH3 2.800E+28 -3.940 15916.00 SXC7H13 (+ M) <=> SAXC7H13 (+ M) 155.000 2.830 15566.20 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.500E-30 14.560 -602.40/ TROE/-13.59 214.0 28.0 50000.0/ SXC7H13 (+ M) <=> C4H7 + C3H6 (+ M) 5.500E+11 0.550 28084.30 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.100E-43 18.418 -602.90/ TROE/-32.13 207.0 28.0 50000.0/ PXCH2-5-1C6H11 (+ M) <=> C4H7 + C3H6 (+ M) 1.760E+11 0.570 28791.60 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/4.700E-39 16.770 -603.10/ TROE/-27.89 216.0 28.0 50000.0/ CH3-2-PXC6H10 (+ M) <=> CH3-2-PXC4H6 + C2H4 (+ M) 3.980E+12 0.120 27571.60 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.300E-43 18.350 -602.50/ TROE/-13.87 227.0 28.0 50000.0/ CH3-2-PXC6H10 + H (+ M) <=> CH3-2-1C6H11 (+ M) 3.600E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.010E+48 -9.320 5833.60/ TROE/0.498 1314.0 1314.0 50000.0/ CH3-3-PXC6H10 (+ M) <=> CH3-3-TAXC6H10 (+ M) 86.000 2.620 8722.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/8.100E-33 15.214 -677.40/ TROE/-30.39 206.0 28.0 50000.0/ CH3-3-TAXC6H10 (+ M) <=> CH3-2-C4H5-13 + C2H5 (+ M) 4.600E+11 -0.410 31253.70 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.800E-28 12.340 -603.20/ TROE/-19.24 231.0 28.0 50000.0/ SAXC7H13 (+ M) <=> C4H6 + nC3H7 (+ M) 3.390E+11 0.660 32262.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/4.000E-42 18.045 -602.60/ TROE/-18.5 246.0 28.0 50000.0/ PAXCH2-2-1C6H11 <=> aC3H4 + pC4H9 2.000E+13 0.000 50078.00 PXCH2-3-1C6H11 (+ M) <=> nC3H7 + C4H6 (+ M) 4.600E+11 -0.410 31253.70 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.800E-28 12.340 -603.20/ TROE/-19.24 231.0 28.0 50000.0/ CH2cC6H10 + H <=> PXC7H13 8.000E+21 -2.390 11180.00 cC6H12 <=> C6H12 5.010E+16 0.000 88232.00 cC6H12 + H <=> cC6H11 + H2 394000.000 2.690 3837.00 cC6H12 + O <=> cC6H11 + OH 143000.000 2.710 2106.00 cC6H12 + OH <=> cC6H11 + H2O 283000.000 2.880 -1015.00 cC6H12 + O2 <=> cC6H11 + HO2 2.400E+14 0.000 47590.00 cC6H12 + HO2 <=> cC6H11 + H2O2 844.000 3.250 14998.00 cC6H12 + CH3 <=> cC6H11 + CH4 382.000 3.210 11633.60 cC6H11 (+ M) <=> PXC6H11 (+ M) 6.030E+12 0.070 27982.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.100E-33 15.290 -602.60/ TROE/-25.11 225.0 28.0 50000.0/ cC6H11 (+ M) <=> cC6H10 + H (+ M) 3.340E+11 0.690 33947.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.000E-40 17.330 -602.70/ TROE/-19.22 230.0 28.0 50000.0/ cC6H11 + H (+ M) <=> cC6H12 (+ M) 4.800E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.700E+58 -12.080 11263.70/ TROE/0.649 1213.1 1213.1 13369.7/ cC6H11 + O2 <=> OH + CO + C5H10 7.190E+13 0.000 18056.00 PXC6H11 (+ M) <=> C4H7 + C2H4 (+ M) 3.980E+12 0.120 27571.60 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.300E-43 18.350 -602.50/ TROE/-13.87 227.0 28.0 50000.0/ PXC6H11 (+ M) <=> SAXC6H11 (+ M) 155.000 2.830 15566.20 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.500E-30 14.560 -602.40/ TROE/-13.59 214.0 28.0 50000.0/ SAXC6H11 + H (+ M) <=> C6H12 (+ M) 2.000E+14 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.330E+60 -12.000 5967.80/ TROE/0.02 1096.6 1096.6 6859.5/ SAXC6H11 (+ M) <=> C4H6 + C2H5 (+ M) 3.390E+11 0.660 32262.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/4.000E-42 18.050 -602.60/ TROE/-18.5 246.0 28.0 50000.0/ cC6H10 <=> C4H6 + C2H4 5.500E+12 0.760 62450.00 CH3-2-PXC4H6 (+ M) <=> CH3-2-C4H5-13 + H (+ M) 4.270E+09 -0.960 31962.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.000E-45 13.550 -603.10/ TROE/-35.89 249.0 28.0 50000.0/ C2H4 + CH3CCH2 <=> CH3-2-PXC4H6 7.930E+38 -8.470 14220.00 CH3-2-C4H5-13 + H <=> C3H6 + C2H3 1.460E+30 -4.340 21647.00 CH3-2-C4H5-13 + H <=> C4H6 + CH3 8.000E+21 -2.390 11180.00 CH3 + iC4H5 <=> CH3-2-C4H5-13 2.000E+13 0.000 0.00 PXCH2cC6H11 + HO2 => OH + CH2O + cC6H11 2.400E+13 0.000 0.00 CH3S2XcC6H10 + HO2 => OH + CH3CH2CHO + C4H7 2.400E+13 0.000 0.00 CH3S4XcC6H10 + HO2 => OH + CH3CH2CHO + C4H7 2.400E+13 0.000 0.00 PXCH2cC6H11 + O2 => HCO + C3H6 + aC3H5 + OH 7.190E+13 0.000 18056.00 CH3TXcC6H10 + O2 => HCO + C3H6 + aC3H5 + OH 7.190E+13 0.000 18056.00 CH3S2XcC6H10 + O2 => HCO + C3H6 + aC3H5 + OH 7.190E+13 0.000 18056.00 CH3S4XcC6H10 + O2 => HCO + C3H6 + aC3H5 + OH 7.190E+13 0.000 18056.00 PXCH2cC6H11 + O2 <=> CH3cC6H10OO 1.170E+12 0.000 -1494.00 CH3TXcC6H10 + O2 <=> CH3cC6H10OO 1.170E+12 0.000 -1494.00 CH3S2XcC6H10 + O2 <=> CH3cC6H10OO 1.170E+12 0.000 -1494.00 CH3S4XcC6H10 + O2 <=> CH3cC6H10OO 1.170E+12 0.000 -1494.00 PXCH2cC6H11 + O2 <=> CH3cC6H9OOH 6.950E+13 0.000 12080.00 CH3TXcC6H10 + O2 <=> CH3cC6H9OOH 6.950E+13 0.000 12080.00 CH3S2XcC6H10 + O2 <=> CH3cC6H9OOH 6.950E+13 0.000 12080.00 CH3S4XcC6H10 + O2 <=> CH3cC6H9OOH 6.950E+13 0.000 12080.00 CH3cC6H10OO <=> CH3cC6H9OOH 2.110E+09 0.000 20567.00 CH3cC6H10OO <=> CH2cC6H10 + HO2 5.000E+12 0.000 33000.00 CH3cC6H9OOH <=> CH2cC6H10 + HO2 3.000E+11 0.000 13000.00 CH3cC6H9OOH => HCO + C3H6 + aC3H5 + OH 2.450E+12 0.000 18060.00 C2H5TXcC6H10 + HO2 => OH + CH3CH2CHO + cC5H9 2.400E+13 0.000 0.00 C2H5TXcC6H10 + O2 => HCO + C4H81 + aC3H5 + OH 7.190E+13 0.000 18056.00 PXC3H6cC6H11 + HO2 => OH + CH3CH2CHO + cC6H11 2.400E+13 0.000 0.00 S2XC3H6cC6H11 + HO2 => OH + CH3CH2CHO + cC6H11 2.400E+13 0.000 0.00 C3H7TXcC6H10 + HO2 => OH + CH3CH2CHO + cC6H11 2.400E+13 0.000 0.00 C3H7S2XcC6H10 + HO2 => OH + CH3CH2CHO + cC6H11 2.400E+13 0.000 0.00 C3H7S3XcC6H10 + HO2 => OH + CH3CH2CHO + cC6H11 2.400E+13 0.000 0.00 C3H7S4XcC6H10 + HO2 => OH + CH3CH2CHO + cC6H11 2.400E+13 0.000 0.00 PXC3H6cC6H11 + O2 => HCO + C5H10 + aC3H5 + OH 7.190E+13 0.000 18056.00 S2XC3H6cC6H11 + O2 => HCO + C5H10 + aC3H5 + OH 7.190E+13 0.000 18056.00 C3H7TXcC6H10 + O2 => HCO + C5H10 + aC3H5 + OH 7.190E+13 0.000 18056.00 C3H7S2XcC6H10 + O2 => HCO + C5H10 + aC3H5 + OH 7.190E+13 0.000 18056.00 C3H7S3XcC6H10 + O2 => HCO + C5H10 + aC3H5 + OH 7.190E+13 0.000 18056.00 C3H7S4XcC6H10 + O2 => HCO + C5H10 + aC3H5 + OH 7.190E+13 0.000 18056.00 PXC4H8cC6H11 + O2 => HCO + C6H12 + aC3H5 + OH 7.190E+13 0.000 18056.00 SXC4H8cC6H11 + O2 => HCO + C6H12 + aC3H5 + OH 7.190E+13 0.000 18056.00 S2XC4H8cC6H11 + O2 => HCO + C6H12 + aC3H5 + OH 7.190E+13 0.000 18056.00 C4H9TXcC6H10 + O2 => HCO + C6H12 + aC3H5 + OH 7.190E+13 0.000 18056.00 C4H9S2XcC6H10 + O2 => HCO + C6H12 + aC3H5 + OH 7.190E+13 0.000 18056.00 C4H9S3XcC6H10 + O2 => HCO + C6H12 + aC3H5 + OH 7.190E+13 0.000 18056.00 C4H9S4XcC6H10 + O2 => HCO + C6H12 + aC3H5 + OH 7.190E+13 0.000 18056.00 PXC4H8cC6H11 + O2 <=> C4H9cC6H10OO 1.170E+12 0.000 -1494.00 SXC4H8cC6H11 + O2 <=> C4H9cC6H10OO 1.170E+12 0.000 -1494.00 S2XC4H8cC6H11 + O2 <=> C4H9cC6H10OO 1.170E+12 0.000 -1494.00 C4H9TXcC6H10 + O2 <=> C4H9cC6H10OO 1.170E+12 0.000 -1494.00 C4H9S2XcC6H10 + O2 <=> C4H9cC6H10OO 1.170E+12 0.000 -1494.00 C4H9S3XcC6H10 + O2 <=> C4H9cC6H10OO 1.170E+12 0.000 -1494.00 C4H9S4XcC6H10 + O2 <=> C4H9cC6H10OO 1.170E+12 0.000 -1494.00 C4H9cC6H10OO => C2H3cC6H11 + HO2 + C2H4 5.000E+12 0.000 33000.00 CH3cC6H11 + O2 <=> CH2CHO + CH2O + pC4H9 1.300E+22 -1.160 72000.00 C3H7cC6H11 + O2 <=> CH2CHO + CH2O + 2C2H4 + C2H5 1.500E+24 -1.770 76000.00 C4H9cC6H11 + O2 <=> CH2CHO + CH2O + 3C2H4 + CH3 1.500E+24 -1.770 76000.00 CH + O2 <=> S-OH + CO 8.000E+10 0.000 0.00 S-OH + CO <=> OH + CO 2.280E+12 0.500 -788.72 S-CH + O2 <=> CH + O2 2.480E+06 2.140 -1720.84 CH + O2 <=> HCO + O 6.710E+13 0.000 0.00 S-OH + CO2 <=> OH + CO2 1.610E+12 0.500 -970.36 CH + OH <=> HCO + H 3.000E+13 0.000 0.00 T-CH2 + O <=> HCO + H 8.000E+13 0.000 0.00 DUPLICATE CH2* + O <=> CO + H2 1.500E+13 0.000 0.00 DUPLICATE CH2* + O <=> HCO + H 1.500E+13 0.000 0.00 DUPLICATE T-CH2 + O2 <=> HCO + OH 9.570E+12 0.000 1737.57 DUPLICATE T-CH2 + O2 <=> CH2O + O 3.300E+12 0.000 1737.57 DUPLICATE T-CH2 + O2 <=> CO2 + H2 3.630E+12 0.000 1737.57 CH2* + O2 <=> CO + H2O 1.200E+13 0.000 0.00 DUPLICATE CH2* + O2 => CO + OH + H 2.800E+13 0.000 0.00 DUPLICATE CH2OH (+ M) <=> CH2O + H (+ M) 7.370E+10 0.810 39581.70 AR/0.85/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ LOW/3.500E+21 -1.990 23998.60/ TROE/0.844 900.0 1.0 3315.0/ S-CH + H2O <=> CH + H2O 5.300E+13 0.000 0.00 CH + H2O <=> CH2O + H 5.710E+12 0.000 -755.26 T-CH2 + OH <=> CH2O + H 2.000E+13 0.000 0.00 DUPLICATE T-CH2 + OH <=> CH + H2O 1.130E+07 2.000 2999.52 DUPLICATE CH2* + OH <=> CH2O + H 3.000E+13 0.000 0.00 DUPLICATE CH3 + O <=> HCO + H2 2.220E+13 0.050 -136.23 T-CH2 + HO2 <=> CH2O + OH 2.000E+13 0.000 0.00 DUPLICATE CH2OH + O <=> CH2O + OH 1.000E+13 0.000 0.00 CH2OH + O2 <=> CH2O + HO2 2.410E+14 0.000 5016.73 T-CH2 + H2 <=> CH3 + H 500000.000 2.000 7229.92 DUPLICATE CH2* + H2 <=> CH3 + H 7.000E+13 0.000 0.00 DUPLICATE CH2* + H2O <=> T-CH2 + H2O 3.000E+13 0.000 0.00 DUPLICATE CH3 + OH <=> T-CH2 + H2O 42400.000 2.570 3998.57 DUPLICATE CH3 + OH <=> CH2* + H2O 1.810E+15 -0.770 1324.09 DUPLICATE CH2OH + H <=> CH3 + OH 1.820E+13 0.160 112.33 CH2OH + H <=> CH2O + H2 4.010E+06 1.860 148.18 CH2* + H2O => CH2O + H2 6.820E+10 0.250 -934.51 CH2OH + OH <=> CH2O + H2O 5.000E+12 0.000 0.00 CH3OH + O <=> CH2OH + OH 388000.000 2.500 3099.90 CH3OH + O <=> CH3O + OH 130000.000 2.500 5000.00 CH3OH + H <=> CH2OH + H2 1.540E+06 2.350 5910.61 CH3OH + H <=> CH3O + H2 5.480E+06 2.150 11099.40 CH3OH + OH <=> CH2OH + H2O 51400.000 2.620 -681.17 CH3OH + OH <=> CH3O + H2O 5710.000 2.620 -681.17 S-CH + CO2 <=> CH + CO2 0.240 4.300 -1696.94 CH + CO2 <=> HCO + CO 1.900E+14 0.000 15791.10 C2H + O2 <=> HCO + CO 1.000E+13 0.000 -755.26 HCCO + O => HCO + CO 7.830E+13 0.000 0.00 HCCO + O => CO2 + CH 4.820E+12 0.000 0.00 HCCO + O2 => CO2 + CO + H 4.780E+12 -0.140 1149.62 C2H + H (+ M) <=> C2H2 (+ M) 1.000E+17 -1.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/2.600E+33 -4.800 1900.10/ TROE/0.6464 132.0 1315.0 5566.0/ C2H2 + M <=> H2CC + M 2.450E+15 -0.640 49698.80 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE CH2* + CO <=> T-CH2 + CO 9.000E+12 0.000 0.00 DUPLICATE C2H + OH <=> HCCO + H 2.000E+13 0.000 0.00 HCCO + H <=> CH2* + CO 1.000E+14 0.000 0.00 DUPLICATE C2H2 + O <=> T-CH2 + CO 7.400E+08 1.280 2471.32 DUPLICATE C2H + OH <=> C2H2 + O 1.810E+13 0.000 0.00 CH2* + CO2 <=> T-CH2 + CO2 7.000E+12 0.000 0.00 DUPLICATE CH2* + CO2 <=> CH2O + CO 1.400E+13 0.000 0.00 DUPLICATE HCCO + OH <=> T-CH2 + CO2 89700.000 2.090 -2196.46 H2CC + O2 <=> 2HCO 1.000E+13 0.000 0.00 DUPLICATE CH2CO + O <=> T-CH2 + CO2 1.750E+12 0.000 1350.38 DUPLICATE HCCO + OH => CO + HCO + H 2.620E+15 -0.410 1006.21 T-CH2 + CH <=> C2H2 + H 4.000E+13 0.000 0.00 DUPLICATE CH3 + C <=> C2H2 + H 5.000E+13 0.000 0.00 C2H + H2 <=> C2H2 + H 236000.000 2.570 258.13 CH2O + CH <=> CH2CO + H 2.680E+14 -0.320 -767.21 C2H2 + OH <=> C2H + H2O 2.630E+06 2.140 17060.20 CH2CHO <=> CH2CO + H 1.320E+34 -6.570 48386.70 CH2CO + OH <=> CH2OH + CO 5.000E+12 0.000 0.00 CH2CHO + O <=> CH2O + HCO 3.170E+13 0.030 -394.36 C2H3 + O2 => CH2O + CO + H 2.220E+16 -1.350 783.94 CH2CHO + O2 => 2HCO + OH 2.350E+10 0.000 0.00 2T-CH2 <=> C2H2 + H2 1.600E+15 0.000 11943.10 DUPLICATE CH3 + CH <=> C2H3 + H 3.000E+13 0.000 0.00 2T-CH2 => C2H2 + 2H 2.000E+14 0.000 10989.50 DUPLICATE C2H4 + M => H2CC + H2 + M 3.710E+16 0.000 67820.30 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE C2H4 + O <=> CH2CHO + H 7.660E+09 0.880 1140.06 C2H4 + O <=> T-CH2 + CH2O 71500.000 2.470 929.73 DUPLICATE CH2CHO + OH <=> CH2OH + HCO 3.010E+13 0.000 0.00 CH3CHO + O <=> CH2CHO + OH 2.920E+12 0.000 1809.27 CH3CHO + O => CH3 + CO + OH 1.950E+13 0.000 3539.67 C2H4 + O2 => CH3 + CO2 + H 4.900E+12 0.420 75800.70 CH3CHO + O2 => CH3 + CO + HO2 5.000E+13 0.000 40000.00 CH3 + T-CH2 <=> C2H4 + H 1.000E+14 0.000 0.00 DUPLICATE CH3 + CH2* <=> C2H4 + H 1.200E+13 0.000 -571.22 DUPLICATE CH4 + CH <=> C2H4 + H 6.000E+13 0.000 0.00 CH3CHO + H <=> CH2CHO + H2 2720.000 3.100 5205.54 CH3CHO + H => CH3 + CO + H2 131000.000 2.580 1218.93 CH3CHO + OH <=> CH2CHO + H2O 0.606 3.900 -1068.36 CH3CHO + OH => CH3 + CO + H2O 970000.000 2.110 -1687.38 CH4 + T-CH2 <=> 2CH3 2.460E+06 2.000 8269.60 DUPLICATE CH4 + CH2* <=> 2CH3 1.600E+13 0.000 -571.22 DUPLICATE C2H5 + OH <=> C2H4 + H2O 2.410E+13 0.000 0.00 CH3O2 + CH3 <=> 2CH3O 1.000E+13 0.000 -1199.81 C2H5 + HO2 <=> C2H5O + OH 3.100E+13 0.000 0.00 CH3OH + CH3 <=> CH2OH + CH4 4.900E+12 0.010 15078.90 CH3OH + CH3 <=> CH3O + CH4 2.310E+13 -0.480 14596.10 HCCO + T-CH2 <=> C2H3 + CO 3.000E+13 0.000 0.00 DUPLICATE C3H2 + OH <=> C2H2 + HCO 1.000E+13 0.000 0.00 C3H2O + H <=> C2H2 + HCO 3.460E+12 0.440 5463.67 C3H3 + O <=> C3H2O + H 1.380E+14 0.000 0.00 C3H2O + H => C2H + CO + H2 131000.000 2.580 1218.93 C3H2O + OH => C2H + CO + H2O 910000.000 2.110 -1687.38 C2H + CH3 <=> C3H3 + H 2.410E+13 0.000 0.00 C2H2 + CH2* <=> C3H3 + H 3.970E+15 -0.570 -4.78 DUPLICATE C3H3 + H <=> C3H2 + H2 1.100E+10 1.130 13929.30 aC3H4 <=> pC3H4 7.760E+39 -7.800 78446.50 DUPLICATE CH2CO + CH2* <=> HCCO + CH3 3.600E+13 0.000 10999.00 CH2CO + T-CH2 => HCCO+CH3 5.9E+02 3.58 6545 CH2CO + CH2* => C2H4 + CO 5.15E+15 -0.64 -34 CH2CO + T-CH2 => C2H4 + CO 1.97E+08 1.49 7925 C3H3 + OH <=> C2H3CHO 21.000 3.220 -420.65 C3H3 + OH <=> C2H4 + CO 1.280E+09 0.730 2578.87 C3H3 + OH <=> C3H2 + H2O 113000.000 2.280 2466.54 aC3H4 + O <=> C2H4 + CO 9.630E+06 2.050 179.25 DUPLICATE pC3H4 + O <=> C3H3 + OH 15.900 3.800 3130.98 pC3H4 + O <=> C2H4 + CO 1.850E+09 1.280 2471.32 DUPLICATE pC3H4 + O <=> HCCO + CH3 1.850E+09 1.280 2471.32 DUPLICATE C3H3 + HO2 <=> aC3H4 + O2 3.000E+11 0.000 0.00 DUPLICATE C3H3 + HO2 <=> pC3H4 + O2 3.000E+11 0.000 0.00 DUPLICATE pC3H4 + O2 <=> CH3 + HCO + CO 4.000E+14 0.000 41928.80 C2H4 + CH <=> aC3H4 + H 9.980E+14 -0.310 0.00 aC3H4 + H <=> C2H2 + CH3 8.950E+13 -0.020 11250.00 DUPLICATE aC3H4 + H <=> aC3H5 2.010E+49 -10.770 19622.40 DUPLICATE aC3H4 + H <=> CH3CCH2 6.700E+42 -12.460 16359.90 DUPLICATE aC3H4 + H <=> C3H3 + H2 1.330E+06 2.530 12239.50 DUPLICATE C2H2 + CH3 <=> pC3H4 + H 1.480E+11 0.600 14306.90 DUPLICATE pC3H4 + H <=> aC3H4 + H 1.580E+18 -1.000 12122.40 DUPLICATE pC3H4 + H <=> CH3CCH2 8.830E+52 -12.360 16446.00 DUPLICATE pC3H4 + H <=> S-C3H5 1.530E+49 -11.970 14144.40 pC3H4 + H <=> C3H3 + H2 85000.000 2.700 5740.92 DUPLICATE C2H2 + CH3 <=> S-C3H5 7.450E+43 -10.130 18522.90 CH2CO + CH3 => HCCO + CH4 1.55E+02 3.38 10512 CH2CO + CH3 => C2H5 + CO 1.24E+05 2.29 10642 aC3H4 + OH <=> C3H3 + H2O 0.131 4.200 -860.42 DUPLICATE CH2CO + CH3 <=> aC3H4 + OH 5.57E+10 0.48 37811 pC3H4 + OH <=> C3H3 + H2O 805000.000 2.220 740.92 DUPLICATE CH2CO + CH3 <=> pC3H4 + OH 2.46E+10 0.59 35889 pC3H4 + OH <=> C2H5 + CO 1.280E+09 0.730 2578.87 aC3H5 + O <=> C2H3CHO + H 1.690E+13 0.030 -394.36 DUPLICATE S-C3H5 + O <=> C2H5 + CO 6.000E+13 0.000 0.00 C3H5O <=> C2H3CHO + H 1.000E+14 0.000 29098.90 C3H5O <=> C2H3 + CH2O 2.030E+12 0.090 23561.20 C2H3CHO + H => C2H3 + CO + H2 131000.000 2.580 1218.93 aC3H5 + O => C2H4 + CO + H 1.690E+13 0.030 -394.36 aC3H4 + HO2 <=> C3H3 + H2O2 9.760E+10 0.120 23370.00 pC3H4 + HO2 <=> C3H3 + H2O2 130.000 3.370 15913.00 aC3H5 + O2 <=> aC3H4 + HO2 20600.000 2.190 17590.80 DUPLICATE aC3H5 + O2 <=> C2H3CHO + OH 336000.000 1.810 19189.80 DUPLICATE aC3H5 + O2 <=> CH2CHO + CH2O 3.080E+09 0.370 16909.70 CH3CCH2 + O2 <=> pC3H4 + HO2 1.340E+06 1.610 -384.80 CH3CCH2 + O2 <=> aC3H4 + HO2 1.920E+07 1.020 -2033.94 S-C3H5 + O2 <=> pC3H4 + HO2 670000.000 1.610 -384.80 S-C3H5 + O2 <=> CH3CHO + HCO 4.050E+17 -1.860 1166.35 S-C3H5 + O2 <=> CH3CHO + CO + H 2.220E+16 -1.350 783.94 aC3H5 + O2 => C2H2 + CH2O + OH 9.710E+20 -2.700 24980.90 CH3CCH2 + O2 => CH2O + CH3 + CO 8.720E+16 -1.490 874.76 C2H3 + CH3 <=> aC3H5 + H 1.930E+18 -1.250 7669.69 DUPLICATE aC3H5 + H <=> aC3H4 + H2 9560.000 2.800 3291.11 DUPLICATE CH3CCH2 + H <=> pC3H4 + H2 3.000E+13 0.000 0.00 DUPLICATE CH3CCH2 + H <=> aC3H4 + H2 2.000E+12 0.000 0.00 S-C3H5 + H <=> pC3H4 + H2 1.500E+13 0.000 0.00 C3H6 <=> aC3H5 + H 3.870E+57 -12.220 113800.0 C3H6 <=> C2H3 + CH3 9.200E+70 -15.960 128552.0 C3H6 <=> H2CC + CH4 4.610E+68 -15.760 124811.0 CH2CHO + CH3 <=> C2H5 + HCO 4.900E+14 -0.500 0.00 C2H5 + HCO <=> C2H6 + CO 1.200E+14 0.000 0.00 aC3H5 + OH <=> aC3H4 + H2O 6.030E+12 0.000 0.00 DUPLICATE CH3CCH2 + OH <=> pC3H4 + H2O 5.000E+12 0.000 0.00 CH3CCH2 + OH <=> aC3H4 + H2O 2.410E+13 0.000 0.00 S-C3H5 + OH <=> pC3H4 + H2O 2.500E+12 0.000 0.00 C3H6 + O <=> CH2CHO + CH3 8.120E+08 1.250 540.15 C3H6 + O <=> C2H4 + CH2O 3.630E+10 0.820 1828.39 C3H6 + O <=> aC3H5 + OH 143.000 3.370 174.47 DUPLICATE CH3CHOCH2 => 2CH3 + CO 1.220E+23 -1.990 83950.80 aC3H5 + HO2 <=> C3H5O + OH 1.190E+09 1.030 -2249.04 S-C3H5 + HO2 => C2H5 + CO + OH 2.000E+13 0.000 0.00 CH3CHOCH2 + O => CH2CO + CH3 + OH 5.130E+11 0.210 4890.06 C3H6 + H <=> aC3H5 + H2 603000.000 2.390 4490.92 DUPLICATE C3H6 + H <=> S-C3H5 + H2 858.000 3.250 12165.40 C2H4 + CH3 (+ M) <=> nC3H7 (+ M) 2.550E+06 1.600 5700.29 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.000E+63 -14.600 18169.20/ TROE/0.1894 277.0 8748.0 7891.0/ C3H6 + H (+ M) <=> nC3H7 (+ M) 2.500E+11 0.510 2619.50 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/6.260E+38 -6.660 7000.48/ TROE/1.0 1000.0 1310.0 48097.0/ C3H6 + H (+ M) <=> I-C3H7 (+ M) 4.240E+11 0.510 1230.88 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/8.700E+42 -7.500 4720.36/ TROE/1.0 1000.0 645.4 6844.3/ CH3CHO + CH3 <=> CH2CHO + CH4 1.440 3.700 8857.55 nC3H7 + O <=> C2H5 + CH2O 9.600E+13 0.000 0.00 DUPLICATE I-C3H7 + O <=> CH3CHO + CH3 9.600E+13 0.000 0.00 C3H6 + OH <=> aC3H5 + H2O 4.190E+13 0.000 4651.05 DUPLICATE C3H6 + OH <=> S-C3H5 + H2O 1.670E+13 0.000 4510.04 CH3CHO + CH3 => CO + CH4 + CH3 1.550 3.700 4565.01 CH3CHOCH2 + H => CH2CO + CH3 + H2 230000.000 2.720 6259.56 nC3H7 + O2 <=> C3H6 + HO2 3.700E+16 -1.630 3417.78 DUPLICATE I-C3H7 + O2 <=> C3H6 + HO2 6.700E+20 -3.020 2504.78 C3H6 + HO2 <=> aC3H5 + H2O2 23800.000 2.550 16491.40 DUPLICATE CH3CHOCH2 + OH => CH2CO + CH3 + H2O 3.380E+07 1.740 829.35 C2H5 + CH3 <=> C2H4 + CH4 11800.000 2.450 2920.65 C2H6 + CH2* <=> C2H5 + CH3 4.000E+13 0.000 -549.71 DUPLICATE nC3H7 + H <=> C2H5 + CH3 3.700E+24 -2.920 12504.80 DUPLICATE I-C3H7 + H <=> C2H5 + CH3 1.400E+28 -3.940 15915.40 DUPLICATE nC3H7 + H <=> C3H6 + H2 1.800E+12 0.000 0.00 DUPLICATE I-C3H7 + H <=> C3H6 + H2 3.200E+12 0.000 0.00 nC3H7 + OH <=> C3H6 + H2O 2.410E+13 0.000 0.00 DUPLICATE I-C3H7 + OH <=> C3H6 + H2O 2.410E+13 0.000 0.00 C3H8 + O <=> nC3H7 + OH 190000.000 2.680 3716.54 C3H8 + O <=> I-C3H7 + OH 47600.000 2.710 2105.64 DUPLICATE C3H8 + H <=> nC3H7 + H2 9.360E+07 1.970 8200.29 C3H8 + H <=> I-C3H7 + H2 7.600E+07 1.860 5599.90 DUPLICATE C4H2 + O2 <=> 2HCCO 9.560E+12 0.000 31099.40 C4H2O + O <=> C3H2 + CO2 1.000E+13 0.000 0.00 C4H2 + OH <=> C4H + H2O 9.150E+09 1.030 21747.10 C4H2 + OH <=> C4H2O + H 3.410E+10 0.310 1195.03 C4H2 + OH <=> C3H3 + CO 2.110E+23 -3.470 7590.82 C4H2O + H <=> C2H2 + HCCO 5.000E+13 0.000 2999.52 N-C4H3 + O <=> C2H2 + HCCO 1.030E+13 0.210 -427.82 I-C4H3 + O <=> CH2CO + C2H 2.000E+13 0.000 0.00 C3H3 + HCO <=> aC3H4 + CO 2.500E+13 0.000 0.00 DUPLICATE C3H3 + HCO <=> pC3H4 + CO 2.500E+13 0.000 0.00 DUPLICATE N-C4H3 + OH <=> C4H2 + H2O 2.500E+12 0.000 0.00 DUPLICATE I-C4H3 + OH <=> C4H2 + H2O 5.000E+12 0.000 0.00 DUPLICATE C3H2 + CH3 <=> C4H4 + H 5.000E+12 0.000 0.00 C3H3 + T-CH2 <=> C4H4 + H 5.000E+13 0.000 0.00 DUPLICATE C4H4 + H <=> N-C4H3 + H2 1.160E+07 2.230 13336.50 DUPLICATE C4H4 + H <=> I-C4H3 + H2 5.800E+06 2.230 10337.00 DUPLICATE C2H3 + C2H2 <=> N-C4H5 9.300E+38 -8.760 12000.50 DUPLICATE C2H3 + C2H2 <=> iC4H5 1.600E+46 -10.980 18599.40 DUPLICATE C4H4 + H <=> N-C4H5 1.300E+51 -11.920 16501.00 DUPLICATE C4H4 + H <=> iC4H5 4.900E+51 -11.920 17700.80 DUPLICATE N-C4H5 <=> iC4H5 1.500E+67 -16.890 59098.90 DUPLICATE S-C4H5 <=> iC4H5 1.500E+67 -16.890 59098.90 DUPLICATE N-C4H5 + O2 <=> C4H4 + HO2 670000.000 1.610 -384.80 N-C4H5 + O2 <=> C2H3CHO + HCO 4.050E+17 -1.860 1166.35 iC4H5 + O2 <=> C4H4 + HO2 1.340E+06 1.610 -384.80 iC4H5 + O2 <=> CH2CO + CH2CHO 3.080E+09 0.370 16909.70 DUPLICATE N-C4H5 + O2 => aC3H5 + CO + O 3.800E+11 0.190 47.80 N-C4H5 + O2 => C2H3CHO + CO + H 2.220E+16 -1.350 783.94 iC4H5 + O2 => CH2CO + C2H2 + OH 9.710E+20 -2.700 24980.90 S-C4H5 + O2 => CH2CO + CH3 + CO 170000.000 1.700 1500.96 C4H6 <=> C2H4 + C2H2 7.000E+12 0.000 67100.90 C4H6 <=> iC4H5 + H 5.700E+36 -6.270 112354.0 DUPLICATE C4H6 <=> N-C4H5 + H 5.300E+44 -8.620 123609.0 DUPLICATE C4H6-2 <=> C4H6 3.000E+13 0.000 65000.00 DUPLICATE C4H6-2 <=> iC4H5 + H 1.910E+54 -11.280 111097.0 S-C4H6 <=> C4H6 3.000E+13 0.000 65000.00 S-C4H6 <=> C4H6-2 3.000E+13 0.000 67000.50 S-C4H6 <=> S-C4H5 + H 3.800E+15 0.000 89199.30 2C2H3 <=> iC4H5 + H 1.200E+22 -2.440 13654.40 DUPLICATE 2C2H3 <=> N-C4H5 + H 2.400E+20 -2.040 15363.30 DUPLICATE N-C4H5 + H <=> iC4H5 + H 3.100E+26 -3.350 17423.50 DUPLICATE N-C4H5 + H <=> C4H4 + H2 1.500E+13 0.000 0.00 DUPLICATE iC4H5 + H <=> C3H3 + CH3 2.000E+13 0.000 2000.48 DUPLICATE iC4H5 + H <=> C4H4 + H2 3.000E+13 0.000 0.00 DUPLICATE S-C4H5 + H <=> iC4H5 + H 3.100E+26 -3.350 17423.50 DUPLICATE C4H6 + O <=> N-C4H5 + OH 7.120E+14 -0.230 9806.41 DUPLICATE C4H6 + O <=> iC4H5 + OH 3.560E+14 -0.230 6806.88 C4H6 + O <=> CH2CHO + C2H3 1.620E+09 1.250 540.15 C4H6 + O <=> aC3H4 + CH2O 7.260E+10 0.820 1828.39 C4H6-2 + O <=> iC4H5 + OH 143.000 3.370 174.47 C4H6-2 + O <=> C3H6 + CO 9.630E+06 2.050 179.25 S-C4H6 + O <=> S-C4H5 + OH 31.700 3.800 3130.98 N-C4H5 + OH <=> C4H4 + H2O 2.500E+12 0.000 0.00 DUPLICATE iC4H5 + OH <=> C4H4 + H2O 5.000E+12 0.000 0.00 DUPLICATE C4H6 + O2 <=> N-C4H5 + HO2 4.220E+13 0.000 62100.90 DUPLICATE C4H6 + O2 <=> iC4H5 + HO2 2.110E+13 0.000 59101.30 DUPLICATE C4H6-2 + O2 <=> iC4H5 + HO2 1.170E+12 0.410 38797.80 C4H6 + O2 => aC3H5 + CO2 + H 4.900E+12 0.420 75800.70 iC4H5 + HO2 => CH2CO + C2H3 + OH 1.190E+09 1.030 -2249.04 DUPLICATE S-C4H5 + HO2 => C2H2 + CH3 + CO + OH 8.000E+11 0.000 0.00 aC3H4 + CH3 <=> C3H3 + CH4 105.000 3.220 14306.90 DUPLICATE pC3H4 + CH3 <=> C3H3 + CH4 17.300 3.440 10389.60 DUPLICATE C4H6 + H <=> N-C4H5 + H2 1.160E+07 2.230 13336.50 DUPLICATE C4H6 + H <=> iC4H5 + H2 5.800E+06 2.230 10337.00 DUPLICATE C4H6-2 + H <=> C4H6 + H 2.000E+13 0.000 4000.96 C4H6-2 + H <=> aC3H4 + CH3 2.670E+12 0.470 5430.21 C4H6-2 + H <=> pC3H4 + CH3 2.550E+18 -1.090 11434.00 DUPLICATE C4H6-2 + H <=> iC4H5 + H2 603000.000 2.390 4490.92 C4H6-2 + H <=> S-C4H5 + H2 149.000 3.380 8910.13 S-C4H6 + H <=> C4H6-2 + H 2.000E+13 0.000 4000.96 S-C4H6 + H <=> pC3H4 + CH3 1.390E+16 -0.360 8630.50 S-C4H6 + H <=> S-C4H5 + H2 170000.000 2.700 5740.92 T-C4H7 => aC3H4 + CH3 1.230E+47 -9.740 74259.10 C4H6 + OH <=> N-C4H5 + H2O 156000.000 2.460 1859.46 DUPLICATE C4H6 + OH <=> iC4H5 + H2O 2.170E+06 2.080 1572.66 DUPLICATE C4H6-2 + OH <=> iC4H5 + H2O 4.190E+13 0.000 4651.05 C4H6-2 + OH <=> S-C4H5 + H2O 4.330E+12 0.000 4533.94 S-C4H6 + OH <=> S-C4H5 + H2O 1.610E+06 2.220 740.92 C2H3CHO + CH3 => C2H3 + CO + CH4 1.550 3.700 2413.96 S-C4H6 + OH => C2H4 + CO + CH3 1860.000 2.670 231.84 C4H6 + HO2 <=> N-C4H5 + H2O2 1.660E+10 0.360 22736.60 DUPLICATE C4H6 + HO2 <=> iC4H5 + H2O2 8.310E+09 0.360 19737.10 DUPLICATE aC3H5 + CH3 <=> aC3H4 + CH4 3.010E+12 -0.320 -131.45 DUPLICATE CH3CCH2 + CH3 <=> pC3H4 + CH4 9.030E+12 0.000 -764.82 DUPLICATE CH3CCH2 + CH3 <=> aC3H4 + CH4 11800.000 2.450 2920.65 S-C3H5 + CH3 <=> pC3H4 + CH4 4.520E+12 0.000 -764.82 C4H81 => aC3H5 + CH3 3.390E+15 0.000 72275.30 T-C4H8 => CH3CCH2 + CH3 1.920E+66 -14.220 128100.0 T-C4H8 + O => T-C4H7 + OH 1.210E+11 0.700 7633.84 C4H7 + HO2 => aC3H5 + CH2O + OH 7.000E+12 0.000 -999.04 DUPLICATE C3H6 + CH3 <=> aC3H5 + CH4 0.457 3.650 7153.44 DUPLICATE C3H6 + CH3 <=> S-C3H5 + CH4 52.500 3.220 14306.90 pC4H9 => C2H5 + C2H4 1.600E+13 0.130 28881.50 DUPLICATE pC4H9 => C4H81 + H 2.040E+10 0.950 33807.40 C4H81 + H => C3H6 + CH3 1.050E+09 1.400 726.58 DUPLICATE C4H81 + H => C2H5 + C2H4 9.020E+08 1.400 2308.80 DUPLICATE C4H81 + H => C4H7 + H2 3.700E+13 0.000 3900.57 DUPLICATE T-C4H9 => C3H6 + CH3 3.300E+12 0.370 30731.40 T-C4H9 => T-C4H8 + H 5.350E+10 1.060 32980.40 T-C4H8 + H => C3H6 + CH3 5.680E+33 -5.720 20000.00 T-C4H8 + H => T-C4H7 + H2 340000.000 2.500 2492.83 C4H81 + OH => C4H7 + H2O 3.000E+13 0.000 1230.88 DUPLICATE T-C4H8 + OH => T-C4H7 + H2O 5.200E+06 2.000 -298.76 CH3CHOCH2 + CH3 => CH2CO + CH4 + CH3 3.960E+11 0.000 9784.89 T-C4H8 + HO2 => T-C4H7 + H2O2 19300.000 2.600 13910.10 nC3H7 + CH3 <=> C3H6 + CH4 3.310E+12 0.000 -769.60 DUPLICATE C5H4O => 2C2H2 + CO 6.200E+41 -7.870 98709.40 C5H4O => C4H4 + CO 5.000E+11 0.000 53011.50 C5H6 + O <=> C5H5 + OH 47700.000 2.710 1106.60 C5H5 + OH <=> C4H6 + CO 8.530E+13 0.250 4349.90 C5H5 + OH <=> C5H5O + H 111000.000 1.900 33126.20 C5H5O + H <=> C5H4O + H2 6.670E+12 0.000 0.00 C5H6 + OH <=> C5H5 + H2O 3.080E+06 2.000 0.00 aC3H5 + C2H3 <=> aC3H4 + C2H4 2.410E+12 0.000 0.00 N-C4H5 + CH3 <=> C4H4 + CH4 4.520E+12 0.000 -764.82 iC4H5 + CH3 <=> C4H4 + CH4 9.040E+12 0.000 -764.82 C4H6 + CH3 <=> N-C4H5 + CH4 105.000 3.220 14306.90 DUPLICATE C4H6 + CH3 <=> iC4H5 + CH4 52.500 3.220 11307.40 DUPLICATE C4H6-2 + CH3 <=> iC4H5 + CH4 0.457 3.650 7153.44 C4H6-2 + CH3 <=> S-C4H5 + CH4 26.300 3.220 11307.40 S-C4H6 + CH3 <=> S-C4H5 + CH4 34.500 3.440 10389.60 PXC5H9 => aC3H5 + C2H4 1.600E+13 0.130 28881.50 DUPLICATE PXC5H9 => C2H3 + C3H6 1.380E+13 0.170 29914.00 aC3H5 + C2H5 <=> aC3H4 + C2H6 9.640E+11 0.000 -131.45 C5H10 => aC3H5 + C2H5 3.390E+15 0.000 72275.30 DUPLICATE C4H7 + CH3O2 => aC3H5 + CH2O + CH3O 7.000E+12 0.000 -999.04 PXC5H11 => nC3H7 + C2H4 3.240E+12 0.320 28807.40 PXC5H11 => C3H6 + C2H5 11.500 3.030 15313.10 PXC5H11 => C5H10 + H 2.040E+10 0.950 33807.40 C5H10 + H => PXC5H9 + H2 3.700E+13 0.000 3900.57 DUPLICATE T-C4H8 + CH3 => T-C4H7 + CH4 4.420 3.500 5674.00 C5H10 + OH => PXC5H9 + H2O 3.000E+13 0.000 1230.88 DUPLICATE C6H6 + H <=> A1- + H2 4.57E8 1.88 14839 C5H4CH2 + H <=> C6H6 + H 1.140E+32 -4.880 18893.40 N-C4H5 + C2H2 <=> C5H4CH2 + H 4.620E+15 -0.890 9141.97 iC4H5 + C2H2 <=> C5H4CH2 + H 6.800E+24 -3.450 20337.00 N-C4H5 + C2H2 <=> C6H6 + H 1.380E+16 -1.000 8900.57 DUPLICATE iC4H5 + C2H2 <=> C6H6 + H 1.670E+23 -3.300 24959.40 C5H6 + CH3 <=> C5H5 + CH4 0.180 4.000 0.00 2aC3H5 <=> aC3H4 + C3H6 7.500E+11 0.000 0.00 C6H12 => nC3H7 + aC3H5 8.520E+26 -3.390 76505.70 DUPLICATE S2XC6H13 => pC4H9 + C2H4 3.200E+12 0.130 28881.50 S2XC6H13 => nC3H7 + C3H6 5.520E+12 0.170 29914.00 S2XC6H13 => C2H5 + C4H81 2.760E+12 0.170 29914.00 S2XC6H13 => CH3 + C5H10 2.760E+12 0.170 29914.00 S2XC6H13 => C6H12 + H 1.780E+08 1.630 34474.20 SXC6H13 => pC4H9 + C2H4 1.600E+13 0.130 28881.50 SXC6H13 => C6H12 + H 2.040E+10 0.950 33807.40 C6H12 + H => PXC6H11 + H2 3.700E+13 0.000 3900.57 DUPLICATE C6H13O => PXC5H11 + CH2O 1.190E+18 -1.500 20181.60 C6H13O => pC4H9 + CH3CHO 7.160E+22 -2.780 22997.10 C6H13O => nC3H7 + C2H5 + HCO 4.100E+17 -1.310 19502.90 C6H12 + OH => PXC6H11 + H2O 3.000E+13 0.000 1230.88 DUPLICATE S2XC6H13 + O2 => C6H13O2 1.360E+13 -0.080 207.93 C6H13O2 => S2XC6H13 + O2 1.710E+23 -2.330 37839.40 C6H13O2 => C6H12OOH 183000.000 1.700 19335.60 C6H12OOH => C6H13O2 75300.000 1.250 5948.85 C6H12OOH => C6H12 + HO2 4.010 3.280 12753.30 C6H12OOH => C6H12O + OH 1.330E+12 -0.740 10172.10 C6H12O + OH => pC4H9 + CH2CO + H2O 3.680E+12 0.000 0.00 N-C6H14 => PXC5H11 + CH3 6.030E+18 -0.670 86551.10 N-C6H14 => pC4H9 + C2H5 1.620E+22 -1.490 87189.30 N-C6H14 => 2nC3H7 2.620E+22 -1.560 87939.80 N-C6H14 + O => S2XC6H13 + OH 1.420E+06 2.560 3016.25 N-C6H14 + O2 => S2XC6H13 + HO2 1.700E+13 0.200 50188.80 S2XC6H13 + HO2 => C6H13O + OH 7.000E+12 0.000 -999.04 C5H6 + C2H3 <=> C5H5 + C2H4 55500.000 2.020 3147.71 A1- + CH4 <=> C6H6 + CH3 0.00389 4.570 5258.13 A1CH3 + H <=> C6H6 + CH3 2.310E+06 2.170 4163.48 A1CH3 + H <=> A1CH2 + H2 6.470 3.980 3384.32 DUPLICATE A1CH3 + H <=> A1CH3* + H2 3.910E+08 1.800 16352.80 PXC7H13 => PXC5H9 + C2H4 1.600E+13 0.130 28881.50 DUPLICATE PXC7H13 => C4H7 + C3H6 1.380E+13 0.170 29914.00 PXC7H13 => aC3H5 + C4H81 1.380E+13 0.170 29914.00 PXC7H13 => C2H3 + C5H10 1.380E+13 0.170 29914.00 SXC7H13 => T-C4H9 + aC3H4 8.710E+21 -2.430 59529.20 SXC7H13 => T-C4H8 + CH3CCH2 6.320E+18 -1.800 43599.40 SXC7H13 => T-C4H7 + C3H6 2.100E+16 -1.090 17820.30 C7H14 => pC4H9 + aC3H5 3.390E+15 0.000 72275.30 DUPLICATE Y-C7H14 => T-C4H9 + aC3H5 3.980E+26 -3.480 76515.30 Y-C7H14 => T-C4H7 + I-C3H7 5.290E+24 -2.550 75855.60 C7H15 => PXC5H11 + C2H4 2.720E+12 0.130 28881.50 C7H15 => pC4H9 + C3H6 4.550E+12 0.170 29914.00 C7H15 => nC3H7 + C4H81 2.280E+12 0.170 29914.00 C7H15 => C2H5 + C5H10 2.350E+12 0.170 29914.00 C7H15 => CH3 + C6H12 2.280E+12 0.170 29914.00 C7H15 => C7H14 + H 1.780E+08 1.630 34474.20 PXC7H15 => PXC5H11 + C2H4 1.600E+13 0.130 28881.50 PXC7H15 => C7H14 + H 2.040E+10 0.950 33807.40 C7H14 + H => PXC7H13 + H2 3.700E+13 0.000 3900.57 DUPLICATE Y-C7H15 => T-C4H9 + C3H6 5.140E+23 -2.930 31496.20 Y-C7H15 => T-C4H8 + I-C3H7 5.870E+21 -2.570 32696.00 Y-C7H15 => Y-C7H14 + H 6.130E+13 0.030 36673.00 Y-C7H14 + H => SXC7H13 + H2 2.380E-13 7.670 -11388.6 C7H15O => PXC5H11 + CH3CHO 8.920E+19 -2.030 21003.80 C7H15O => pC4H9 + C2H5 + HCO 2.230E+15 -0.700 18606.60 C7H15O => 2nC3H7 + HCO 6.180E+16 -1.360 18518.20 C7H14 + OH => PXC7H13 + H2O 3.000E+13 0.000 1230.88 DUPLICATE Y-C7H14 + OH => SXC7H13 + H2O 6.460E-09 6.180 -9878.11 C7H15 + O2 => C7H15O2 1.680E+13 -0.110 241.40 C7H15O2 => C7H15 + O2 1.920E+22 -2.110 37304.00 C7H15O2 => C7H14OOH 188000.000 1.680 19003.40 C7H14OOH => C7H15O2 764000.000 0.910 6082.70 C7H14OOH => C7H14 + HO2 5850.000 2.400 15315.50 C7H14OOH => C7H14O + OH 3.970E-10 5.690 375.24 C7H14O + OH => PXC5H11 + CH2CO + H2O 3.680E+12 0.000 0.00 NC7H16 => SXC6H13 + CH3 8.790E+73 -16.610 118901.0 NC7H16 => pC4H9 + nC3H7 4.260E+78 -17.710 120700.0 DUPLICATE NC7H16 + O => C7H15 + OH 172000.000 2.810 2260.99 S2XC6H13 + CH3O2 => C6H13O + CH3O 7.000E+12 0.000 -999.04 NC7H16 + O2 => C7H15 + HO2 2.890E+13 0.200 50109.90 C7H15 + HO2 => C7H15O + OH 7.000E+12 0.000 -999.04 NC7H16 + H => C7H15 + H2 9.900E+07 2.060 5492.35 NC7H16 + OH => C7H15 + H2O 9.680E+06 2.080 -652.49 NC7H16 + HO2 => C7H15 + H2O2 7.570E+12 0.210 17633.80 PXC8H15 => PXC6H11 + C2H4 1.600E+13 0.130 28881.50 DUPLICATE PXC8H15 => PXC5H9 + C3H6 1.380E+13 0.170 29914.00 PXC8H15 => C4H7 + C4H81 1.380E+13 0.170 29914.00 PXC8H15 => aC3H5 + C5H10 1.380E+13 0.170 29914.00 PXC8H15 => C2H3 + C6H12 1.380E+13 0.170 29914.00 C8H16 => PXC5H11 + aC3H5 3.390E+15 0.000 72275.30 DUPLICATE PXC8H17 => SXC6H13 + C2H4 1.600E+13 0.130 28881.50 PXC8H17 => C8H16 + H 2.040E+10 0.950 33807.40 C8H16 + H => PXC8H15 + H2 3.700E+13 0.000 3900.57 DUPLICATE C-C8H17 => Y-C7H14 + CH3 2.550E+39 -7.470 45286.80 C-C8H17 => T-C4H9 + T-C4H8 4.280E+22 -2.810 30521.00 C-C8H17 => T-C4H8 + CH3 + C3H6 4.220E+24 -3.340 37920.70 C8H16 + OH => PXC8H15 + H2O 3.000E+13 0.000 1230.88 DUPLICATE D-C8H17O => T-C4H8 + CH3 + CH3CHOCH2 1.330E+23 -2.980 15401.50 D-C8H17O => T-C4H9 + I-C3H7 + HCO 7.950E+33 -6.000 23319.80 D-C8H17O => Y-C7H15 + CH2O 2.690E+20 -2.080 15055.00 PXC8H17 + O2 => C8H17O2 1.650E+22 -2.850 4727.53 C8H17O2 => PXC8H17 + O2 2.480E+21 -1.940 36025.30 C8H17O2 => C8H16OOH 1.110E+06 1.400 19065.50 C8H16OOH => C8H16O + OH 307.000 2.150 5872.37 C8H16OOH => C8H16 + HO2 5.110E+06 1.400 16749.50 C8H16O + OH => SXC6H13 + CH2CO + H2O 3.090E+13 -0.270 384.80 NC8H18 => Y-C7H15 + CH3 6.180E+25 -2.460 83709.40 NC8H18 => T-C4H8 + I-C3H7 + CH3 2.460E+23 -2.010 83401.10 NC8H18 => 2T-C4H9 7.830E+29 -3.930 84149.10 NC8H18 + O => C-C8H17 + OH 4690.000 3.190 1080.31 C7H15 + CH3O2 => C7H15O + CH3O 7.000E+12 0.000 -999.04 NC8H18 + O2 => C-C8H17 + HO2 1.030E+11 0.840 46914.40 C-C8H17 + HO2 => D-C8H17O + OH 7.000E+12 0.000 -999.04 NC8H18 + H => C-C8H17 + H2 9.080 4.120 1780.59 NC8H18 + OH => C-C8H17 + H2O 270000.000 2.430 -965.58 NC8H18 + HO2 => C-C8H17 + H2O2 9.850E+10 0.730 16943.10 PXC3H6-3-1C6H11 => PXC7H13 + C2H4 1.600E+13 0.130 28881.50 PXC3H6-3-1C6H11 => PXC6H11 + C3H6 1.380E+13 0.170 29914.00 PXC3H6-3-1C6H11 => PXC5H9 + C4H81 1.380E+13 0.170 29914.00 PXC3H6-3-1C6H11 => C4H7 + C5H10 1.380E+13 0.170 29914.00 PXC3H6-3-1C6H11 => aC3H5 + C6H12 1.380E+13 0.170 29914.00 PXC3H6-3-1C6H11 => C2H3 + C7H14 1.380E+13 0.170 29914.00 C9H18 => SXC6H13 + aC3H5 3.390E+15 0.000 72275.30 PXC9H19 => PXC7H15 + C2H4 1.600E+13 0.130 28881.50 PXC9H19 => C9H18 + H 2.040E+10 0.950 33807.40 C9H18 + H => PXC3H6-3-1C6H11 + H2 3.700E+13 0.000 3900.57 C9H18 + OH => PXC3H6-3-1C6H11 + H2O 3.000E+13 0.000 1230.88 C-C8H17 + CH3O2 => D-C8H17O + CH3O 7.000E+12 0.000 -999.04 NC8H18 + CH3 => C-C8H17 + CH4 1.140E-18 9.250 -2124.76 NC8H18 + CH3O2 => C-C8H17 + CH3O + OH 9.850E+10 0.730 16943.10 PXC10H19 => PXC8H15 + C2H4 1.600E+13 0.130 28881.50 DUPLICATE PXC10H19 => PXC7H13 + C3H6 1.380E+13 0.170 29914.00 PXC10H19 => PXC6H11 + C4H81 1.380E+13 0.170 29914.00 PXC10H19 => PXC5H9 + C5H10 1.380E+13 0.170 29914.00 PXC10H19 => C4H7 + C6H12 1.380E+13 0.170 29914.00 PXC10H19 => aC3H5 + C7H14 1.380E+13 0.170 29914.00 PXC10H19 => C2H3 + C8H16 1.380E+13 0.170 29914.00 C10H20 => PXC7H15 + aC3H5 3.390E+15 0.000 72275.30 DUPLICATE PXC10H21 => PXC8H17 + C2H4 1.600E+13 0.130 28881.50 PXC10H21 => C10H20 + H 2.040E+10 0.950 33807.40 C10H20 + H => PXC10H19 + H2 3.700E+13 0.000 3900.57 DUPLICATE C10H20 + OH => PXC10H19 + H2O 3.000E+13 0.000 1230.88 DUPLICATE PXC12H23 => PXC10H19 + C2H4 1.600E+13 0.130 28881.50 DUPLICATE PXC12H23 => PXC3H6-3-1C6H11 + C3H6 1.380E+13 0.170 29914.00 PXC12H23 => PXC8H15 + C4H81 1.380E+13 0.170 29914.00 PXC12H23 => PXC7H13 + C5H10 1.380E+13 0.170 29914.00 PXC12H23 => PXC5H9 + C7H14 1.380E+13 0.170 29914.00 PXC12H23 => C4H7 + C8H16 1.380E+13 0.170 29914.00 PXC12H23 => aC3H5 + C9H18 1.380E+13 0.170 29914.00 PXC12H23 => C2H3 + C10H20 1.380E+13 0.170 29914.00 C12H24 => PXC9H19 + aC3H5 9.530E+15 -0.180 71226.10 DUPLICATE C12H24 => PXC8H17 + C4H7 1.870E+15 0.040 70948.90 C12H24 => PXC7H15 + PXC5H9 1.500E+15 -0.020 71008.60 C12H24 => PXC5H11 + PXC7H13 2.080E+15 -0.040 71039.70 C12H24 => pC4H9 + PXC8H15 1.510E+13 0.520 70392.00 S4XC12H25 => PXC10H21 + C2H4 1.440E+12 0.130 28881.50 S4XC12H25 => PXC9H19 + C3H6 2.480E+12 0.170 29914.00 S4XC12H25 => PXC8H17 + C4H81 2.480E+12 0.170 29914.00 S4XC12H25 => PXC7H15 + C5H10 1.240E+12 0.170 29914.00 S4XC12H25 => SXC6H13 + C6H12 1.240E+12 0.170 29914.00 S4XC12H25 => PXC5H11 + C7H14 1.240E+13 0.170 29914.00 S4XC12H25 => pC4H9 + C8H16 1.240E+13 0.170 29914.00 S4XC12H25 => nC3H7 + C9H18 1.240E+12 0.170 29914.00 S4XC12H25 => C2H5 + C10H20 1.240E+12 0.170 29914.00 S4XC12H25 => C12H24 + H 1.780E+08 1.630 34474.20 C12H25O => PXC10H21 + CH3CHO 4.350E+08 1.310 15485.20 C12H25O => PXC9H19 + C2H5 + HCO 8.370E+18 -1.840 19832.70 C12H25O => PXC8H17 + nC3H7 + HCO 9.830E+44 -9.700 32117.60 C12H25O => PXC7H15 + pC4H9 + HCO 8.350E+61 -14.500 42966.10 C12H25O => SXC6H13 + PXC5H11 + HCO 4.630E+64 -15.380 43695.00 S4XC12H25 + O2 => C12H25O2 9.520E+12 -0.040 54.97 C12H25O2 => S4XC12H25 + O2 1.520E+22 -2.310 37425.90 C12H25O2 => P12OOHX2 1.130E+06 1.460 19161.10 P12OOHX2 => C12H25O2 4.470E+21 -3.860 13888.60 P12OOHX2 => C12H24 + HO2 2.210E+14 -0.810 20253.40 DUPLICATE P12OOHX2 => C12H24O + OH 3.250E-11 5.920 -1873.80 C12H24O + OH => PXC8H17 + C2H4 + CH2CO + H2O 3.090E+13 -0.270 384.80 NC12H26 => PXC10H21 + C2H5 1.680E+24 -2.110 88154.90 NC12H26 => PXC9H19 + nC3H7 2.460E+24 -2.120 88735.70 NC12H26 => PXC8H17 + pC4H9 1.210E+24 -2.070 88346.10 NC12H26 => PXC7H15 + PXC5H11 1.130E+24 -2.060 88331.70 NC12H26 => 2SXC6H13 2.590E+24 -2.120 88358.00 NC12H26 + O => S4XC12H25 + OH 397000.000 2.760 2196.46 O + H + M <=> S-OH + M 3.000E+12 0.000 5975.14 AR/0.88/ H2/2.5/ H2O/16.3/ S-OH + O2 <=> OH + O2 2.100E+12 0.500 -482.79 S-OH + H2O <=> OH + H2O 1.550E+12 0.500 -862.81 S-CH + AR <=> CH + AR 3.130E+11 0.000 0.00 CH2* + AR <=> T-CH2 + AR 9.000E+12 0.000 599.90 DUPLICATE S-OH + AR <=> OH + AR 1.690E+12 0.000 4139.58 2O + AR <=> O2 + AR 1.890E+13 0.000 -1787.76 S-CH <=> CH 1.860E+06 0.000 0.00 C + H + M <=> S-CH + M 3.630E+13 0.000 0.00 S-CH + N2 <=> CH + N2 303.000 3.400 -406.31 C + OH <=> CO + H 5.000E+13 0.000 0.00 CH + O <=> CO + H 5.700E+13 0.000 0.00 CH + H <=> C + H2 1.100E+14 0.000 0.00 CH2* + N2 <=> T-CH2 + N2 1.500E+13 0.000 599.90 DUPLICATE CH + H2 <=> T-CH2 + H 1.080E+14 0.000 3109.46 DUPLICATE CH2* + H <=> CH + H2 3.000E+13 0.000 0.00 CH + H2 (+ M) <=> CH3 (+ M) 1.970E+12 0.430 -370.46 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/4.820E+25 -2.800 590.34/ TROE/0.578 122.0 2535.0 9365.0/ T-CH2 + H (+ M) <=> CH3 (+ M) 4.190E+14 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/1.040E+26 -2.760 1598.95/ TROE/0.562 91.0 5836.0 8552.0/ CH3 + O2 (+ M) <=> CH3O2 (+ M) 1.010E+08 1.630 0.00 LOW/3.820E+31 -4.890 3432.12/ TROE/0.045 880.1 2.5E+09 1.786E+09/ CH3OH (+ M) <=> CH3 + OH (+ M) 2.080E+18 -0.610 92545.40 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.390E+51 -9.360 103975.00/ TROE/0.7656 59.51 1910.0 9374.0/ CH3OH (+ M) <=> CH2* + H2O (+ M) 3.120E+18 -1.020 91716.10 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/7.760E+48 -8.680 100442.00/ TROE/0.9922 47310.0 943.0 47110.0/ CH3OH + O2 => CH2OH + HO2 358000.000 2.270 42762.90 CH3O2 + HO2 => CH3O + OH + O2 2.470E+11 0.000 -1570.27 CH3OH + HO2 <=> CH2OH + H2O2 0.000162 4.990 10578.40 CH3OH + HO2 <=> CH3O + H2O2 0.865 3.890 18413.00 C + O2 <=> CO + O 5.800E+13 0.000 576.00 CH + CO (+ M) <=> HCCO (+ M) 5.000E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/2.690E+28 -3.740 1935.95/ TROE/0.5757 237.0 1652.0 5069.0/ C2H + O <=> S-CH + CO 1.440E+13 0.000 456.50 S-CH + CO <=> CH + CO 2.440E+12 0.500 0.00 C2H + O <=> CH + CO 5.000E+13 0.000 0.00 T-CH2 + C <=> C2H + H 5.000E+13 0.000 0.00 DUPLICATE T-CH2 + CO (+ M) <=> CH2CO (+ M) 8.100E+11 0.500 4510.04 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/2.690E+33 -5.110 7096.08/ TROE/0.5907 275.0 1226.0 5185.0/ CH3CHO (+ M) <=> CH3 + HCO (+ M) 2.720E+22 -1.740 86359.90 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.630E+59 -11.340 95917.80/ TROE/0.0 1.0 1.0 -670.0/ C2H5O (+ M) <=> CH3 + CH2O (+ M) 6.310E+10 0.930 17098.50 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/4.700E+25 -3.000 16532.00/ TROE/0.426 0.3 2046.0 100000.0/ CH3O2 + CH2O => CH3O + OH + HCO 1.990E+12 0.000 11670.60 CH3CHO + HO2 => CH3 + CO + H2O2 0.00278 4.500 4827.92 CH3CHO + HO2 <=> CH2CHO + H2O2 0.0543 4.100 18647.20 C2H5O + O2 <=> CH3CHO + HO2 2.290E+10 0.000 874.76 2CH3O2 => 2CH3O + O2 1.400E+16 -1.610 1859.46 HCCO + CH <=> C2H2 + CO 5.000E+13 0.000 0.00 C3H2 + O <=> C2H + HCO 1.360E+14 0.000 0.00 C2H + HCO <=> C3H2O 5.000E+13 0.000 0.00 C3H2 + O2 <=> HCCO + CO + H 1.250E+11 0.000 999.04 C3H2O + O => C2H + CO + OH 1.950E+13 0.000 3539.67 C3H2O + O2 => C2H + CO + HO2 5.000E+13 0.000 40000.00 C2H2 + CH <=> C3H2 + H 1.890E+14 0.000 0.00 C3H2 + H (+ M) <=> C3H3 (+ M) 1.020E+13 0.270 279.64 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/2.800E+30 -3.860 3319.79/ TROE/0.782 207.5 2663.0 6095.0/ C3H2O + HO2 => C2H + CO + H2O2 0.00278 4.500 4827.92 aC3H4 + M <=> C3H3 + H + M 2.150E+43 -6.810 100528.0 pC3H4 + M <=> C3H3 + H + M 2.150E+43 -6.810 100528.0 C2H3CHO + HO2 => C2H3 + CO + H2O2 0.00278 4.500 4827.92 C3H5O + O2 <=> C2H3CHO + HO2 1.000E+12 0.000 5999.04 CH3CHOCH2 + O2 => CH2CO + CH3 + HO2 6.030E+13 0.000 48499.00 CH3CHOCH2 + HO2 => CH2CO + CH3 + H2O2 1.700E+13 0.000 20461.30 nC3H7 + H (+ M) <=> C3H8 (+ M) 3.610E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/4.420E+61 -13.550 11357.50/ TROE/0.315 369.0 3285.0 6667.0/ I-C3H7 + H (+ M) <=> C3H8 (+ M) 2.400E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/1.700E+58 -12.080 11264.30/ TROE/0.498 1314.0 1314.0 50000.0/ C3H8 (+ M) <=> C2H5 + CH3 (+ M) 1.290E+37 -5.840 97387.70 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/5.640E+74 -15.740 98718.90/ TROE/0.31 50.0 3000.0 9000.0/ C3H8 + OH <=> nC3H7 + H2O 5150.000 2.940 -418.26 C3H8 + OH <=> I-C3H7 + H2O 181000.000 2.440 -535.37 DUPLICATE C3H8 + HO2 <=> nC3H7 + H2O2 47600.000 2.550 16491.40 C3H8 + HO2 <=> I-C3H7 + H2O2 9630.000 2.600 13910.10 DUPLICATE C4H + O2 => C2H + 2CO 1.000E+13 0.000 -755.26 C4H2 <=> C4H + H 2.200E+14 0.000 116599.0 C4H2 + O <=> C3H2 + CO 2.800E+13 0.000 1730.40 C4H2 + O <=> C4H2O 4.000E+13 0.000 0.00 C3H2 + CH <=> C4H2 + H 5.000E+13 0.000 0.00 C4H2 + H <=> C4H + H2 2.000E+14 0.000 25999.00 C2H2 + C2H <=> C4H2 + H 7.800E+13 0.000 0.00 C4H2 + H <=> N-C4H3 1.370E+39 -7.870 15442.20 DUPLICATE N-C4H3 <=> I-C4H3 4.100E+43 -9.500 52999.50 DUPLICATE C4H2 + H (+ M) <=> I-C4H3 (+ M) 4.310E+10 1.160 1751.91 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/2.300E+45 -8.100 2507.17/ TROE/0.099 12.5 10000.0 6674.0/ C4H2O + OH <=> CH2CO + HCCO 1.000E+07 2.000 2000.48 N-C4H3 + O2 <=> C4H2 + HO2 670000.000 1.610 -384.80 I-C4H3 + O2 <=> C4H2 + HO2 1.340E+06 1.610 -384.80 I-C4H3 + O2 <=> HCCO + CH2CO 1.630E+11 0.000 -1799.71 DUPLICATE C3H2 + T-CH2 <=> N-C4H3 + H 5.000E+13 0.000 0.00 C3H3 + CH <=> I-C4H3 + H 5.000E+13 0.000 0.00 N-C4H3 + H <=> I-C4H3 + H 2.500E+20 -1.670 10800.70 DUPLICATE N-C4H3 + H <=> C4H4 2.000E+47 -10.260 13071.20 DUPLICATE I-C4H3 + H <=> C4H4 3.400E+43 -9.010 12120.00 DUPLICATE N-C4H3 + H <=> C2H2 + H2CC 6.300E+25 -3.340 10014.30 DUPLICATE I-C4H3 + H <=> C2H2 + H2CC 2.800E+23 -2.550 10779.20 DUPLICATE N-C4H3 + H <=> C4H2 + H2 1.500E+13 0.000 0.00 DUPLICATE I-C4H3 + H <=> C4H2 + H2 3.000E+13 0.000 0.00 DUPLICATE C4H4 <=> C4H2 + H2 1.300E+15 0.000 94679.70 C4H4 <=> 2C2H2 3.400E+13 0.000 77100.90 C3H2O + CH3 => C2H + CO + CH4 1.550 3.700 4565.01 C4H4 + OH <=> N-C4H3 + H2O 22300.000 2.750 2215.58 DUPLICATE C4H4 + OH <=> I-C4H3 + H2O 11200.000 2.750 -783.94 DUPLICATE C4H4 + OH <=> aC3H5 + CO 1.280E+09 0.730 2578.87 N-C4H5 + O <=> aC3H5 + CO 1.030E+13 0.210 -427.82 iC4H5 + O <=> CH2CO + C2H3 3.170E+13 0.030 -394.36 C3H3 + CH3 (+ M) <=> C4H6-2 (+ M) 4.090E+13 0.000 -258.13 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/2.600E+57 -11.940 9772.94/ TROE/0.175 1341.0 60000.0 9770.0/ C3H8 + CH3 <=> nC3H7 + CH4 0.903 3.650 7153.44 C3H8 + CH3 <=> I-C3H7 + CH4 1.510 3.460 7153.44 DUPLICATE C3H2 + HCCO <=> N-C4H3 + CO 1.000E+13 0.000 0.00 C5H4O + O => C3H3 + HCO + CO 1.020E+08 1.660 657.27 C3H3 + C2H2 <=> C5H5 6.870E+55 -12.500 42017.20 C5H5 + O <=> N-C4H5 + CO 1.270E+14 0.260 3943.59 DUPLICATE C5H5O => C5H4O + H 8.180E+16 -2.320 8723.71 C5H5O => N-C4H5 + CO 2.150E+64 -15.140 66443.60 C5H4O + H => C2H3 + C2H2 + CO 2.670E+12 0.470 5430.21 C5H5 + O2 <=> C5H4O + OH 9.110E+15 -2.210 2437.86 C5H5 + O2 <=> C5H5O + O 4370.000 2.400 50549.70 C5H5O + O <=> C5H4O + OH 3.330E+12 0.000 0.00 C5H5O + O2 <=> C5H4O + HO2 7.220E+09 0.000 1749.52 C5H6 <=> C5H5 + H 3.240E+49 -10.010 101195.0 C5H6 + O2 <=> C5H5 + HO2 1.000E+14 0.000 37151.10 C5H5 + HO2 <=> C5H5O + OH 6.860E+13 0.250 5090.82 C5H5O + OH <=> C5H4O + H2O 1.670E+12 0.000 0.00 C4H4 + CH3 <=> N-C4H3 + CH4 52.500 3.220 14306.90 C4H4 + CH3 <=> I-C4H3 + CH4 26.300 3.220 11307.40 C5H6 + H <=> C5H5 + H2 8.590E+07 1.850 3338.91 C5H6 + H <=> aC3H5 + C2H2 7.740E+36 -6.810 32887.20 C5H6 + HO2 <=> C5H5 + H2O2 11000.000 2.600 12899.10 C4H2 + C2H <=> C6H2 + H 7.800E+13 0.000 0.00 C2H2 + C4H <=> C6H2 + H 7.800E+13 0.000 0.00 C6H2 + OH => C4H2 + HCCO 3.410E+10 0.310 1195.03 O-C6H4 => C4H2 + C2H2 1.200E+18 -0.340 87829.80 OC6H4O => C5H4O + CO 7.400E+11 0.000 59001.00 OC6H4O + O => CH2CO + C2H2 + 2CO 3.000E+13 0.000 5000.00 N-C4H3 + C2H2 <=> O-C6H4 + H 6.900E+46 -10.010 30100.40 DUPLICATE N-C4H3 + C2H2 <=> A1- 9.600E+70 -17.770 31300.20 DUPLICATE A1- (+ M) <=> O-C6H4 + H (+ M) 4.300E+12 0.620 77301.60 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.000E+84 -18.870 90100.40/ TROE/0.902 696.0 358.0 3856.0/ A1- + O <=> A1O 1.000E+14 0.000 0.00 A1O <=> C5H5 + CO 2.900E+10 0.000 36424.50 O-C6H4 + OH => C5H5 + CO 1.000E+13 0.000 0.00 A1- + O2 <=> A1O + O 8.570E+20 -2.270 7189.29 A1- + O2 <=> OC6H4O + H 3.000E+13 0.000 8981.84 A1O + O <=> OC6H4O + H 6.340E+13 0.030 -394.36 OC6H4O + H => C5H5O + CO 4.300E+09 1.450 3867.11 A1O + O2 <=> OC6H4O + OH 6.510E+07 1.300 17667.30 C6H6 <=> A1- + H 1.290E+61 -12.480 148086.0 C5H4CH2 <=> C6H6 1.450E+45 -8.900 97002.90 C5H4CH2 <=> A1- + H 2.240E+68 -14.650 142576.0 2C3H3 <=> C5H4CH2 8.250E+46 -10.100 16959.80 2C3H3 <=> C6H6 1.070E+45 -9.570 17014.80 2C3H3 <=> A1- + H 5.770E+37 -7.000 31505.70 C6H6 + O <=> A1- + OH 2.000E+13 0.000 14698.90 C6H6 + O <=> A1O + H 1.990E+07 1.800 3974.67 C6H6 + O <=> A1OH 1.530E+10 0.920 3295.89 C6H6 + O <=> C5H6 + CO 1.530E+17 -0.890 15509.10 A1- + OH <=> A1O + H 3.000E+13 0.000 0.00 A1OH <=> C5H6 + CO 6.590E+15 -0.610 74118.10 A1OH <=> A1O + H 1.010E+71 -15.920 124790.0 C6H6 + O2 <=> A1- + HO2 4.340E+14 0.000 64292.50 A1- + HO2 <=> A1O + OH 3.000E+13 0.000 0.00 C6H6 + OH <=> A1- + H2O 23400.000 2.680 733.75 C6H6 + OH <=> A1OH + H 132.000 3.250 5590.34 A1OH + H <=> A1O + H2 5.480E+06 2.150 11099.40 A1OH + OH <=> A1O + H2O 5710.000 2.620 -681.17 C5H5 + CH3 => C5H4CH2 + 2H 4.910E+31 -4.850 24772.90 aC3H5 + C3H3 => C5H4CH2 + 2H 1.880E+38 -7.530 23879.10 PXC6H11 => C4H7 + C2H4 1.600E+13 0.130 28881.50 PXC6H11 => aC3H5 + C3H6 1.380E+13 0.170 29914.00 PXC6H11 => C2H3 + C4H81 1.380E+13 0.170 29914.00 OC6H11OOH => C2H5 + CH3CHO + CH2CO + OH 3.260E+09 1.930 38506.20 C6H12OOH + O2 => C6H13O4 7.710E+12 -0.010 -14.34 C6H13O4 => C6H12OOH + O2 2.310E+21 -1.970 36579.80 C6H13O4 => OC6H11OOH + OH 6.470E+09 0.180 19839.90 N-C6H14 + H => S2XC6H13 + H2 6.160E+07 2.100 5475.62 N-C6H14 + OH => S2XC6H13 + H2O 7.490E+06 2.090 -623.80 N-C6H14 + HO2 => S2XC6H13 + H2O2 6.270E+12 0.210 17698.40 A1CHO => A1- + CO + H 2.720E+22 -1.740 86359.90 A1CHO + O => A1- + CO + OH 1.950E+13 0.000 3539.67 A1CH2 <=> C5H5 + C2H2 8.200E+14 0.000 80676.40 DUPLICATE A1CH2 + O <=> C6H6 + HCO 6.980E+12 0.330 685.95 A1CH2 + O <=> A1CHO + H 2.750E+13 0.070 731.36 A1CH2O <=> A1CHO + H 5.260E+28 -5.080 22249.00 A1CH2O <=> A1- + CH2O 7.210E+33 -6.210 36849.90 A1CH2O <=> C6H6 + HCO 2.370E+32 -6.100 28809.80 A1CHO + H <=> A1- + CH2O 7.380E+13 -0.100 12067.40 A1CHO + H => A1- + CO + H2 131000.000 2.580 1218.93 OA1CH3 => C5H4CH2 + CO + H 2.900E+10 0.000 36424.50 A1CH3* + O <=> OA1CH3 1.000E+14 0.000 0.00 A1CH2 + O2 <=> A1CHO + OH 3.760E+15 -1.550 11321.70 A1CH2O + O <=> A1CHO + OH 6.670E+12 0.000 0.00 A1CHO + OH => A1- + CO + H2O 970000.000 2.110 -1687.38 A1CH3* + O2 <=> OA1CH3 + O 8.570E+20 -2.270 7189.29 A1CH3* + O2 => C5H4CH2 + CO2 + H 2.550E+13 -0.440 -1649.14 A1CH3* + O2 => pC3H4 + C2H3 + 2CO 2.550E+13 -0.440 -1649.14 A1CH2O + O2 <=> A1CHO + HO2 4.110E+10 0.000 1749.52 S-C4H5 + C3H3 <=> A1CH3 1.870E+46 -9.840 16804.50 S-C4H5 + C3H3 <=> A1CH3* + H 5.770E+37 -7.000 31505.70 A1CH3 <=> A1CH2 + H 1.560E+13 0.680 89206.50 A1CH3 <=> A1- + CH3 4.350E+22 -1.730 104209.0 A1CH2 + H <=> A1- + CH3 5.830E+67 -14.150 68329.40 DUPLICATE A1CH3 <=> A1CH3* + H 8.390E+60 -12.480 148086.0 A1CH3 + O <=> A1CH2 + OH 95000.000 2.680 3716.54 DUPLICATE A1CH3 + O <=> OA1CH3 + H 1.660E+07 1.800 3974.67 A1CH3 + O <=> HOA1CH3 1.280E+10 0.920 3295.89 A1CH2O + H <=> A1CHO + H2 1.330E+13 0.000 0.00 HOA1CH3 <=> OA1CH3 + H 1.010E+71 -15.920 124790.0 A1CH3 + O <=> A1CH3* + OH 1.600E+13 0.000 14698.90 A1CH3* + OH <=> OA1CH3 + H 3.000E+13 0.000 0.00 A1CH3 + O2 <=> A1CH2 + HO2 2.180E+07 2.500 46044.50 DUPLICATE A1CH2 + HO2 <=> A1CH2O + OH 1.190E+09 1.030 -2249.04 A1CH2O + OH <=> A1CHO + H2O 3.330E+12 0.000 0.00 HOA1CH3 + O <=> OA1CH3 + OH 130000.000 2.500 5000.00 A1CH3* + HO2 <=> OA1CH3 + OH 3.000E+13 0.000 0.00 A1OH + CH3 <=> A1O + CH4 2.310E+13 -0.480 14596.10 A1CH3 + OH <=> A1CH2 + H2O 177000.000 2.390 -602.29 DUPLICATE A1CH3 + OH <=> A1OH + CH3 783.000 2.880 3221.80 A1CH3 + OH <=> HOA1CH3 + H 31.400 3.370 4720.36 HOA1CH3 + H <=> OA1CH3 + H2 5.480E+06 2.150 11099.40 A1CH3 + OH <=> A1CH3* + H2O 13600.000 2.690 619.02 A1CH3 + HO2 <=> A1CH2 + H2O2 93300.000 2.500 14684.50 DUPLICATE HOA1CH3 + OH <=> OA1CH3 + H2O 5710.000 2.620 -681.17 OC7H13OOH => nC3H7 + CH3CHO + CH2CO + OH 3.260E+09 1.930 38506.20 C7H14OOH + O2 => C7H15O4 1.510E+13 -0.090 126.67 C7H15O4 => C7H14OOH + O2 1.710E+22 -2.130 37122.40 C7H15O4 => OC7H13OOH + OH 4.250E+10 -0.110 19474.20 2C4H <=> C8H2 1.000E+14 0.000 0.00 C6H2 + C2H <=> C8H2 + H 7.800E+13 0.000 0.00 C4H2 + C4H <=> C8H2 + H 7.800E+13 0.000 0.00 C8H2 + OH => C6H2 + HCCO 3.410E+10 0.310 1195.03 A1C2H <=> A1C2H* + H 4.300E+60 -12.480 148086.0 A1C2H + O <=> A1- + HCCO 3.700E+09 1.280 2471.32 A1CHOCHO => A1- + 2CO + H 5.440E+22 -1.740 86359.90 A1CHOCHO + O => A1CHO + CO + O 3.900E+13 0.000 3539.67 A1- + C2H2 <=> A1C2H + H 2.660E+32 -5.300 23785.80 A1- + C2H2 <=> A1C2H2 4.800E+44 -9.900 17626.70 DUPLICATE A1C2H2 <=> A1C2H3* 5.900E+10 0.550 27566.90 A1C2H2 <=> A1C2H + H 1.810E+54 -12.690 51391.00 C6H6 + C2H <=> A1C2H + H 2.000E+14 0.000 0.00 A1C2H + H <=> A1C2H* + H2 2.010E+08 1.800 16352.80 A1C2H2 + O <=> A1CH2 + CO 1.030E+13 0.210 -427.82 A1C2H + OH <=> A1C2H* + H2O 7800.000 2.680 733.75 A1C2H + OH <=> A1- + CH2CO 21.000 3.220 -420.65 A1C2H + OH <=> A1CH2 + CO 6.400E+08 0.730 2578.87 A1C2H2 + O2 <=> A1C2H + HO2 670000.000 1.610 -384.80 A1C2H2 + O2 => A1CH2 + CO + O 3.800E+11 0.190 47.80 A1C2H2 + O2 <=> A1CHO + HCO 4.050E+17 -1.860 1166.35 A1C2H2 + O2 => A1CHO + CO + H 2.220E+16 -1.350 783.94 A1CHOCH2 + O <=> A1CHOCHO + H 2.750E+13 0.070 731.36 A1CHOCH2 + O <=> A1CHO + HCO 6.980E+12 0.330 685.95 A1CHOCHO + H => A1CHO + CO + H 262000.000 2.580 1218.93 A1CHOCHO + OH => A1CHO + CO + OH 1.940E+06 2.110 -1687.38 A1C2H3 => C6H6 + H2CC 2.400E+14 0.000 78131.00 A1- + C2H3 <=> A1C2H3 6.000E+12 0.000 0.00 A1C2H3 <=> A1C2H2 + H 3.010E+14 0.340 111255.0 A1C2H3 <=> A1C2H3* + H 4.300E+60 -12.480 148086.0 A1C2H2 + H <=> A1C2H + H2 1.500E+13 0.000 0.00 A1C2H3 + O <=> A1CH2 + HCO 1.950E+08 1.360 886.71 A1C2H3 + O <=> A1CHO + T-CH2 35800.000 2.470 929.73 A1C2H2 + OH <=> A1C2H + H2O 2.500E+12 0.000 0.00 A1CH3CHO <=> A1CHOCH2 + H 1.560E+13 0.680 89206.50 A1CH3CHO => A1- + CO + CH3 4.350E+22 -1.730 104209.0 A1CH3CHO => A1CH3* + CO + H 2.720E+22 -1.740 86359.90 A1CH3CHO + O <=> A1CHOCH2 + OH 95000.000 2.680 3716.54 A1CH3CHO + O => A1CH3* + CO + OH 1.950E+13 0.000 3539.67 A1CHOCH2 + HO2 => A1CHOCHO + H + OH 1.190E+09 1.030 -2249.04 A1- + C2H4 <=> A1C2H3 + H 3.620E+28 -4.240 23864.70 A1C2H3 + H <=> C6H6 + C2H3 5.620E+24 -3.000 19830.30 A1C2H3 + H <=> A1C2H2 + H2 63500.000 2.750 11649.10 A1C2H3 + H <=> A1C2H3* + H2 2.010E+08 1.800 16352.80 A1C2H4 <=> A1- + C2H4 1.720E+11 0.780 38704.60 A1C2H4 <=> A1C2H3 + H 3.790E+06 1.990 32105.60 A1CH3CH2 => C6H6 + H + C2H2 8.200E+14 0.000 80676.40 A1- + C2H4 <=> C6H6 + C2H3 0.00945 4.470 4471.80 A1CHO + CH3 => A1- + CO + CH4 1.550 3.700 4565.01 A1C2H3 + OH <=> A1OH + C2H3 783.000 2.880 3221.80 A1C2H3 + OH <=> A1C2H2 + H2O 11200.000 2.750 2215.58 A1C2H3 + OH <=> A1C2H3* + H2O 7800.000 2.680 733.75 A1C2H4 + O <=> A1CH2 + CH2O 9.600E+13 0.000 0.00 A1CH3CH2 + O <=> A1CH3CHO + H 2.750E+13 0.070 731.36 A1CH3CH2 + O <=> A1CH3 + HCO 6.980E+12 0.330 685.95 A1CH3CHO + H <=> A1CHOCH2 + H2 6.470 3.980 3384.32 A1CH3CHO + H => A1CH3* + CO + H2 131000.000 2.580 1218.93 A1C2H4 + O2 <=> A1C2H3 + HO2 3.080E+13 0.000 18083.20 A1CH3CH2 + O2 <=> A1CH3CHO + OH 138.000 2.420 7440.25 A1CH3CHO + OH <=> A1CHOCH2 + H2O 177000.000 2.390 -602.29 A1CH3CHO + OH => A1CH3* + CO + H2O 970000.000 2.110 -1687.38 A1C2H4 + H <=> A1C2H5 3.610E+13 0.000 0.00 A1CH2 + CH3 <=> A1C2H5 2.000E+13 0.000 0.00 A1- + C2H5 <=> A1C2H5 2.000E+13 0.000 0.00 A1C2H4 + H <=> A1C2H3 + H2 1.800E+12 0.000 0.00 A1CH3CH3 <=> A1CH3CH2 + H 2.120E+13 0.680 89206.50 A1CH3CH3 <=> A1CH3* + CH3 8.700E+22 -1.730 104209.0 A1CH3CH2 + H <=> A1CH3* + CH3 5.830E+67 -14.150 68329.40 A1C2H5 + O <=> A1C2H4 + OH 99500.000 2.680 3716.54 A1C2H4 + OH <=> A1C2H3 + H2O 2.410E+13 0.000 0.00 A1CH3CH3 + O <=> A1CH3CH2 + OH 190000.000 2.680 3716.54 A1CH3CH3 + O => A1CH3 + CO + 2H 1.820E+08 1.550 3090.34 A1C2H4 + HO2 => A1CH2 + CH2O + OH 7.000E+12 0.000 -999.04 A1CH3CH3 + O2 <=> A1CH3CH2 + HO2 4.360E+07 2.500 46044.50 A1CH3CH2 + HO2 => A1CH3CHO + H + OH 1.190E+09 1.030 -2249.04 C5H6 + aC3H5 <=> C5H5 + C3H6 21.500 3.310 25523.40 A1CH3 + CH3 <=> A1CH2 + CH4 0.452 3.650 7153.44 DUPLICATE A1CH3 + CH3 <=> A1CH3* + CH4 0.0179 4.460 13637.70 A1C2H5 + H <=> C6H6 + C2H5 2.310E+06 2.170 4163.48 A1C2H5 + H <=> A1C2H4 + H2 4.680E+07 1.970 8200.29 A1CH3CH3 + H <=> A1CH3CH2 + H2 12.900 3.980 3384.32 A1CH3CH3 + H <=> A1CH3 + CH3 4.620E+06 2.170 4163.48 HOA1CH3 + CH3 <=> OA1CH3 + CH4 2.310E+13 -0.480 14596.10 A1C2H5 + OH <=> A1OH + C2H5 783.000 2.880 3221.80 A1C2H5 + OH <=> A1C2H4 + H2O 2670.000 2.940 -418.26 A1CH3CH3 + OH <=> A1CH3CH2 + H2O 354000.000 2.390 -602.29 A1CH3CH3 + OH <=> HOA1CH3 + CH3 1570.000 2.880 3221.80 A1C2H5 + HO2 <=> A1C2H4 + H2O2 23800.000 2.550 16491.40 A1CH3CH3 + HO2 <=> A1CH3CH2 + H2O2 187000.000 2.500 14684.50 C8H16O3 => pC4H9 + CH3CHO + CH2CO + OH 4.440E+32 -4.980 49708.40 C8H16OOH + O2 => C8H17O4 1.160E+11 0.530 -855.64 C8H17O4 => C8H16OOH + O2 1.370E+23 -2.370 37641.00 C8H17O4 => C8H16O3 + OH 9.980E+06 1.020 20057.40 C9H6O => O-C6H4 + C2H2 + CO 6.200E+41 -7.870 98709.40 C9H6O + O => O-C6H4 + CH2CO + CO 1.020E+08 1.660 657.27 C9H7 + O => A1C2H2 + CO 5.080E+13 0.260 3943.59 DUPLICATE C9H6O + H => A1C2H2 + CO 1.370E+09 1.460 1355.16 C9H7 + O2 => C9H6O + OH 3.640E+15 -2.210 2437.86 C9H7 + O2 => C9H6O + O + H 1750.000 2.400 50549.70 A1- + C3H3 <=> C9H8 1.000E+13 0.000 0.00 C9H8 <=> C9H7 + H 3.240E+49 -10.010 101195.0 C9H8 + O <=> C9H7 + OH 47700.000 2.710 1106.60 C9H7 + OH => A1C2H3 + CO 3.410E+13 0.250 4349.90 C9H7 + OH => C9H6O + 2H 44400.000 1.900 33126.20 C9H8 + O2 <=> C9H7 + HO2 1.000E+14 0.000 37151.10 C9H7 + HO2 => C9H6O + OH + H 2.740E+13 0.250 5090.82 A1CH2 + C2H2 <=> C9H8 + H 31600.000 2.480 11061.20 DUPLICATE C9H8 + H <=> C9H7 + H2 8.590E+07 1.850 3338.91 C9H8 + OH <=> C9H7 + H2O 3.080E+06 2.000 0.00 A1CHOCHO + CH3 => A1CHO + CO + CH3 3.100 3.700 4565.01 C9H8 + HO2 <=> C9H7 + H2O2 11000.000 2.600 12899.10 C5H6 + N-C4H5 <=> C5H5 + C4H6 7.300E+10 0.760 15179.30 A1CH3CHO + CH3 <=> A1CHOCH2 + CH4 0.452 3.650 7153.44 A1CH3CHO + CH3 => A1CH3* + CO + CH4 1.550 3.700 4565.01 A1C2H4 + CH3 <=> A1C2H3 + CH4 3.310E+12 0.000 -769.60 A1C2H5 + CH3 <=> A1C2H4 + CH4 0.452 3.650 7153.44 A1CH3CH3 + CH3 <=> A1CH3CH2 + CH4 0.903 3.650 7153.44 A2- <=> A2* 1.510E+07 0.000 44180.20 A1C2H + C2H <=> A2- 6.670E+13 0.000 0.00 A1C2H* + C2H2 <=> A2- 13400.000 2.500 1283.46 A2- + O <=> A2O 1.000E+14 0.000 0.00 A2* + O <=> A2O 1.000E+14 0.000 0.00 A2O <=> C9H7 + CO 2.900E+10 0.000 36424.50 A2- + O2 <=> A2O + O 8.570E+20 -2.270 7189.29 A2* + O2 <=> A2O + O 8.570E+20 -2.270 7189.29 A2- + O2 => C9H6O + CO + H 3.000E+13 0.000 8981.84 A2* + O2 => C9H6O + CO + H 3.000E+13 0.000 8981.84 A2O + O => C9H6O + CO + H 1.680E+14 0.000 0.00 A2O + O2 => C9H6O + CO + OH 6.510E+07 1.300 17667.30 A2 <=> A2- + H 8.600E+60 -12.480 148076.0 DUPLICATE A2 <=> A2* + H 8.600E+60 -12.480 148076.0 DUPLICATE A2 + O <=> A2O + H 3.320E+07 1.800 3974.67 A2 + O <=> A2OH 2.550E+10 0.920 3295.89 A2 + O <=> C9H8 + CO 2.550E+17 -0.890 15509.10 A2- + OH <=> A2O + H 3.000E+13 0.000 0.00 A2* + OH <=> A2O + H 3.000E+13 0.000 0.00 A2OH <=> C9H8 + CO 8.620E+15 -0.610 74118.10 A2OH <=> A2O + H 1.010E+71 -15.920 124790.0 A2 + H <=> A2- + H2 4.010E+08 1.800 16352.80 DUPLICATE A2 + H <=> A2* + H2 4.010E+08 1.800 16352.80 DUPLICATE A1C2H3 + C2H <=> A2 + H 6.670E+13 0.000 0.00 A1C2H2 + C2H2 <=> A2 + H 2.620E+06 2.000 4579.35 A1C2H3* + C2H2 <=> A2 + H 3020.000 2.550 3181.17 A1C2H + C2H3 <=> A2 + H 4.500E+16 -1.150 14581.70 A1C2H* + C2H4 <=> A2 + H 3.620E+28 -4.240 23864.70 A1- + C4H4 <=> A2 + H 12600.000 2.610 1434.03 A2 + OH <=> A2- + H2O 39000.000 2.680 733.75 DUPLICATE A2 + OH <=> A2* + H2O 39000.000 2.680 733.75 DUPLICATE A2 + OH <=> A2OH + H 220.000 3.250 5590.34 A2OH + H <=> A2O + H2 68.300 3.400 7232.31 A2OH + OH <=> A2O + H2O 17.300 3.400 -1142.45 2C5H5 => A2 + 2H 6.390E+29 -4.030 35205.50 2C5H5 <=> C9H7 + CH3 2.500E+12 0.000 9560.23 A1CH2 + C3H3 => A2 + 2H 1.880E+38 -7.530 23879.10 C9H7 + CH3 => A2 + 2H 1.960E+31 -4.850 24772.90 C5H5 + C5H6 => C9H8 + CH3 0.786 3.070 5728.97 C9H8 + CH3 <=> C9H7 + CH4 0.180 4.000 0.00 A2CHO => A2- + CO + H 2.720E+22 -1.740 86359.90 A2CHO + O => A2- + CO + OH 1.950E+13 0.000 3539.67 A2CH2 <=> C9H7 + C2H2 8.200E+14 0.000 80676.40 DUPLICATE A2CH2 + O <=> A2 + HCO 6.980E+12 0.330 685.95 A2CH2 + O <=> A2CHO + H 2.750E+13 0.070 731.36 A2CH2O <=> A2CHO + H 5.260E+28 -5.080 22249.00 A2CH2O <=> A2- + CH2O 7.210E+33 -6.210 36849.90 A2CHO + H => A2- + CO + H2 131000.000 2.580 1218.93 A2CH2 + O2 <=> A2CHO + OH 3.760E+15 -1.550 11321.70 A2CH2O + O <=> A2CHO + OH 6.670E+12 0.000 0.00 A2CHO + OH => A2- + CO + H2O 970000.000 2.110 -1687.38 A2CH2O + O2 <=> A2CHO + HO2 4.110E+10 0.000 1749.52 A2CH3 <=> A2CH2 + H 1.250E+18 -0.600 94787.30 A2CH3 <=> A2- + CH3 3.200E+34 -5.020 114252.0 A2CH2 + H <=> A2- + CH3 5.830E+67 -14.150 68329.40 A2CH3 + O <=> A2CH2 + OH 1.180 4.090 2545.41 A2CH3 + O => A2 + CO + 2H 1.100E+13 0.000 4531.55 A2CH3 + O => C9H7 + CH3 + CO 1.470E+13 0.000 4531.55 A2CH2O + H <=> A2CHO + H2 1.330E+13 0.000 0.00 A2CH3 + O2 <=> A2CH2 + HO2 2.180E+07 2.500 46044.50 A2CH2 + HO2 <=> A2CH2O + OH 1.190E+09 1.030 -2249.04 A2CH2O + OH <=> A2CHO + H2O 3.330E+12 0.000 0.00 A2CH3 + H <=> A2 + CH3 2.310E+06 2.170 4163.48 A2CH3 + H <=> A2CH2 + H2 6.470 3.980 3384.32 A2OH + CH3 <=> A2O + CH4 0.00037 4.700 4827.92 A2CH3 + OH <=> A2OH + CH3 783.000 2.880 3221.80 A2CH3 + OH <=> A2CH2 + H2O 177000.000 2.390 -602.29 A2CH3 + HO2 <=> A2CH2 + H2O2 93300.000 2.500 14684.50 A1CH3CH2 + C3H3 => A2CH3 + 2H 1.880E+38 -7.530 23879.10 A2R5- + O2 => A2- + 2CO 8.570E+20 -2.270 7189.29 A2C2HA <=> A2C2HA* + H 2.150E+60 -12.480 148076.0 A2C2HB <=> A2C2HB* + H 2.150E+60 -12.480 148076.0 A2R5 <=> A2R5- + H 8.600E+60 -12.480 148076.0 A2 + C2H <=> A2C2HA + H 1.670E+14 0.000 0.00 A2 + C2H <=> A2C2HB + H 1.670E+14 0.000 0.00 A2- + C2H2 <=> A2R5 + H 2.810E+07 1.770 2239.48 A2* + C2H2 <=> A2C2HB + H 5.380E+07 1.650 2559.75 A2C2H2A <=> A2C2HA + H 1.810E+54 -12.690 51391.00 A2C2H2B <=> A2C2HB + H 1.810E+54 -12.690 51391.00 A2C2HA + H <=> A2C2HA* + H2 1.000E+08 1.800 16352.80 A2C2HB + H <=> A2C2HB* + H2 1.000E+08 1.800 16352.80 A2C2H2A <=> A2R5 + H 2.880E+11 0.230 17026.80 A2C2HA + H <=> A2R5 + H 3.520E+12 0.000 13360.40 A2R5 + H <=> A2R5- + H2 4.010E+08 1.800 16352.80 A2C2HA + OH <=> A2C2HA* + H2O 3900.000 2.680 733.75 A2C2HB + OH <=> A2C2HB* + H2O 3900.000 2.680 733.75 A2R5 + OH <=> A2R5- + H2O 13400.000 2.680 733.75 A2R5 + OH => A2 + HCCO 176.000 3.250 5590.34 C9H7 + C3H3 => A2R5 + 2H 1.880E+38 -7.530 23879.10 A2C2H2A + H <=> A2C2HA + H2 1.500E+13 0.000 0.00 A2C2H2B + H <=> A2C2HB + H2 1.500E+13 0.000 0.00 2A1- <=> P2 7.340E+20 -2.340 4125.24 2A1- <=> P2- + H 2.440E+13 0.890 43178.80 P2 <=> P2- + H 8.600E+60 -12.480 148076.0 A2C2H2A + OH <=> A2C2HA + H2O 2.500E+12 0.000 0.00 A2C2H2B + OH <=> A2C2HB + H2O 2.500E+12 0.000 0.00 A2 + C2H3 <=> A2C2H2A + H2 9.010E+16 -1.150 14581.70 A2 + C2H3 <=> A2C2H2B + H2 9.010E+16 -1.150 14581.70 A2- + C2H4 <=> A2C2H2A + H2 3.620E+28 -4.240 23864.70 DUPLICATE A2* + C2H4 <=> A2C2H2B + H2 3.620E+28 -4.240 23864.70 DUPLICATE C6H6 + A1- <=> P2 + H 9.550E+11 0.000 2167.78 P2 + H <=> P2- + H2 4.010E+08 1.800 16352.80 A2CHO + CH3 => A2- + CO + CH4 1.550 3.700 4565.01 P2 + OH <=> P2- + H2O 13400.000 2.680 733.75 A2CH3 + CH3 <=> A2CH2 + CH4 17.300 3.440 10389.60 C12H24O3 => PXC8H17 + CH3CHO + CH2CO + OH 8.950E+14 0.320 40893.90 P12OOHX2 + O2 => C12H25O4 1.320E+13 -0.080 112.33 C12H25O4 => P12OOHX2 + O2 1.920E+23 -2.420 37667.30 C12H25O4 => C12H24O3 + OH 1.280E+07 0.890 17251.40 NC12H26 + O2 => S4XC12H25 + HO2 1.050E+14 0.100 50136.20 S4XC12H25 + HO2 => C12H25O + OH 7.000E+12 0.000 -999.04 NC12H26 + H => S4XC12H25 + H2 3.590E+08 1.970 5535.37 NC12H26 + OH => S4XC12H25 + H2O 2.180E+07 2.050 -705.07 NC12H26 + HO2 => S4XC12H25 + H2O2 2.860E+13 0.110 17669.70 A1CH3 + A1- <=> A1CH2 + C6H6 7.940E+13 0.000 11950.30 DUPLICATE S4XC12H25 + CH3O2 => C12H25O + CH3O 7.000E+12 0.000 -999.04 A2R5C2H <=> A2R5C2H* + H 2.150E+60 -12.480 148076.0 A2R5 + C2H <=> A2R5C2H + H 1.670E+14 0.000 0.00 A2R5- + C2H2 <=> A2R5C2H + H 5.380E+07 1.650 2559.75 A2R5C2H2 <=> A2R5C2H + H 2.090E+38 -7.740 46890.50 A2R5C2H + H <=> A2R5C2H* + H2 1.000E+08 1.800 16352.80 A2C2HA + C2H <=> A3- 3.330E+13 0.000 0.00 A2C2HB + C2H <=> A3- 3.330E+13 0.000 0.00 A2C2HA* + C2H2 <=> A3* 13400.000 2.500 1283.46 A2C2HB* + C2H2 <=> A3* 13400.000 2.500 1283.46 A3* <=> A2R5- + C2H2 1.300E+11 1.080 70399.10 DUPLICATE A2R5C2H + OH <=> A2R5C2H* + H2O 3900.000 2.680 733.75 A3* + O2 => A2C2H2B + 2CO 8.570E+20 -2.270 7189.29 A3- + O2 => A2C2H2A + 2CO 8.570E+20 -2.270 7189.29 A2R5C2H2 + H <=> A2R5C2H + H2 1.650E+11 0.490 10631.00 A1C2H* + A1- <=> A3 1.390E+13 0.000 112.33 A3 <=> A3* + H 4.300E+60 -12.480 148076.0 A3 <=> A3- + H 8.600E+60 -12.480 148076.0 DUPLICATE A2R5C2H2 + OH <=> A2R5C2H + H2O 2.500E+12 0.000 0.00 A2R5 + C2H3 <=> A2R5C2H2 + H2 9.010E+16 -1.150 14581.70 A2R5- + C2H4 <=> A2R5C2H2 + H2 3.620E+28 -4.240 23864.70 P2- + C2H2 <=> A3 + H 3020.000 2.550 3181.17 A1C2H + A1- <=> A3 + H 3.180E+11 0.000 2167.78 A1C2H* + C6H6 <=> A3 + H 9.550E+11 0.000 2167.78 A2C2H2A + C2H2 <=> A3 + H 2.620E+06 2.000 4579.35 A2C2H2B + C2H2 <=> A3 + H 2.620E+06 2.000 4579.35 A2C2HA + C2H3 <=> A3 + H 2.250E+16 -1.150 14581.70 A2C2HB + C2H3 <=> A3 + H 2.250E+16 -1.150 14581.70 A2C2HA* + C2H4 <=> A3 + H 3.620E+28 -4.240 23864.70 A2C2HB* + C2H4 <=> A3 + H 3.620E+28 -4.240 23864.70 A2- + C4H4 <=> A3 + H 12600.000 2.610 1434.03 DUPLICATE A2* + C4H4 <=> A3 + H 12600.000 2.610 1434.03 DUPLICATE A3 + H <=> A3* + H2 2.000E+08 1.800 16352.80 DUPLICATE A3 + H <=> A3- + H2 4.010E+08 1.800 16352.80 DUPLICATE A3 + OH <=> A3* + H2O 7800.000 2.680 733.75 DUPLICATE A3 + OH <=> A3- + H2O 15600.000 2.680 733.75 DUPLICATE A3 + OH => A2C2HA + CH3 + CO 110.000 3.250 5590.34 A3 + OH => A2C2HB + CH3 + CO 110.000 3.250 5590.34 C9H7 + C5H5 => A3 + 2H 2.560E+29 -4.030 35205.50 A2CH2 + C3H3 => A3 + 2H 1.880E+38 -7.530 23879.10 A2R5C2H* + C2H2 <=> A3R5- 13400.000 2.500 1283.46 A4- + O2 => A3* + 2CO 8.570E+20 -2.270 7189.29 A3R5- + O2 => A3* + 2CO 8.570E+20 -2.270 7189.29 A3R5 <=> A3R5- + H 2.150E+60 -12.480 148076.0 A4 <=> A4- + H 1.720E+60 -12.480 148076.0 DUPLICATE A2R5C2H2 + C2H2 <=> A3R5 + H 2.620E+06 2.000 4579.35 A3- + C2H2 <=> A3R5 + H 2.810E+07 1.770 2239.48 A2R5- + C4H4 <=> A3R5 + H 12600.000 2.610 1434.03 A3R5 + H <=> A3R5- + H2 2.010E+08 1.800 16352.80 A3* + C2H2 <=> A4 + H 5.380E+07 1.650 2559.75 DUPLICATE A4 + H <=> A4- + H2 8.030E+08 1.800 16352.80 DUPLICATE A3R5 + OH <=> A3R5- + H2O 7800.000 2.680 733.75 A4 + OH <=> A4- + H2O 31200.000 2.680 733.75 DUPLICATE A4 + OH => A3 + HCCO 220.000 3.250 5590.34 A3R5 + OH => A3 + HCCO 220.000 3.250 5590.34 FLTN + OH => A3 + HCCO 220.000 3.250 5590.34 A2- + A1- => FLTN + 2H 1.390E+13 0.000 112.33 A2 + A1- => FLTN + H2 + H 6.370E+11 0.000 2167.78 A2- + C6H6 => FLTN + H2 + H 9.550E+11 0.000 2167.78 A4- + C2H2 <=> A4R5 + H 2.810E+07 1.770 2239.48 A3R5- + C2H2 <=> A4R5 + H 5.380E+07 1.650 2559.75 DUPLICATE A4R5 + OH => A4 + HCCO 220.000 3.250 5590.34 S-OH + N2 <=> OH + N2 1.080E+11 0.500 -1240.44 S-OH <=> OH 1.450E+06 0.000 0.00 H2O + H2O <=> OH + H + H2O 1.000E+26 -2.440 120160.0 CH2* + AR <=> T-CH2 + AR 9.000E+12 0.000 600.00 DUPLICATE CH + N2 <=> HCN + N 3.120E+09 0.880 20130.00 CH2* + N2 <=> T-CH2 + N2 1.500E+13 0.000 600.00 DUPLICATE H2CN + N <=> N2 + T-CH2 6.000E+13 0.000 400.00 T-CH2 + N2 <=> HCN + NH 1.000E+13 0.000 74000.00 CH2* + N2 <=> NH + HCN 1.000E+11 0.000 65000.00 HCNN + H <=> T-CH2 + N2 1.000E+14 0.000 0.00 O + T-CH2 <=> H + HCO 8.000E+13 0.000 0.00 DUPLICATE T-CH2 + O2 <=> O + CH2O 2.400E+12 0.000 1500.00 DUPLICATE T-CH2 + O2 => OH + H + CO 5.000E+12 0.000 1500.00 T-CH2 + O2 => 2H + CO2 5.800E+12 0.000 1500.00 DUPLICATE CH + H2 <=> H + T-CH2 1.080E+14 0.000 3110.00 DUPLICATE H + T-CH2 (+ M) <=> CH3 (+ M) 6.000E+14 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/1.040E+26 -2.760 1600.00/ TROE/0.562 91.0 5836.0 8552.0/ OH + T-CH2 <=> H + CH2O 2.000E+13 0.000 0.00 DUPLICATE OH + T-CH2 <=> CH + H2O 1.130E+07 2.000 3000.00 DUPLICATE O + CH3 => H + H2 + CO 3.370E+13 0.000 0.00 HO2 + T-CH2 <=> OH + CH2O 2.000E+13 0.000 0.00 DUPLICATE T-CH2 + H2 <=> H + CH3 500000.000 2.000 7230.00 DUPLICATE H + CH2OH (+ M) <=> CH3OH (+ M) 1.055E+12 0.500 86.00 H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/4.360E+31 -4.650 5080.00/ TROE/0.6 100.0 90000.0 10000.0/ H + CH3O (+ M) <=> CH3OH (+ M) 2.430E+12 0.515 50.00 H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/4.660E+41 -7.440 14080.00/ TROE/0.7 100.0 90000.0 10000.0/ H + CH2OH <=> CH2* + H2O 3.280E+13 -0.090 610.00 CH3O + H <=> CH2OH + H 4.150E+07 1.630 1924.00 OH + CH3 <=> T-CH2 + H2O 5.600E+07 1.600 5420.00 DUPLICATE CH2* + H2O <=> T-CH2 + H2O 3.000E+13 0.000 0.00 DUPLICATE OH + CH3 => H2 + CH2O 8.000E+09 0.500 -1755.00 C + T-CH2 <=> H + C2H 5.000E+13 0.000 0.00 DUPLICATE T-CH2 + CO (+ M) <=> CH2CO (+ M) 8.100E+11 0.500 4510.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/2.690E+33 -5.110 7095.00/ TROE/0.5907 275.0 1226.0 5185.0/ O + C2H2 <=> CO + T-CH2 6.940E+06 2.000 1900.00 DUPLICATE CH2* + CO <=> T-CH2 + CO 9.000E+12 0.000 0.00 DUPLICATE O + CH2CO <=> T-CH2 + CO2 1.750E+12 0.000 1350.00 DUPLICATE CH2* + CO2 <=> T-CH2 + CO2 7.000E+12 0.000 0.00 DUPLICATE CH + T-CH2 <=> H + C2H2 4.000E+13 0.000 0.00 DUPLICATE HCCOH + H <=> CH2CO + H 1.000E+13 0.000 0.00 OH + C2H2 <=> H + HCCOH 504000.000 2.300 13500.00 O + CH2CHO => H + T-CH2 + CO2 1.500E+14 0.000 0.00 2T-CH2 <=> H2 + C2H2 1.600E+15 0.000 11944.00 DUPLICATE 2T-CH2 => 2H + C2H2 2.000E+14 0.000 10989.00 DUPLICATE C2H4 (+ M) <=> H2 + C2H2 (+ M) 8.000E+12 0.440 86770.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.580E+51 -9.300 97800.00/ TROE/0.7345 180.0 1035.0 5417.0/ T-CH2 + CH3 <=> H + C2H4 4.000E+13 0.000 0.00 DUPLICATE O + C2H5 <=> H + CH3CHO 1.096E+14 0.000 0.00 T-CH2 + CH4 <=> 2CH3 2.460E+06 2.000 8270.00 DUPLICATE T-CH2 + HCCO <=> C2H3 + CO 3.000E+13 0.000 0.00 DUPLICATE CH3 + C2H4 (+ M) <=> I-C3H7 (+ M) 2.550E+06 1.600 5700.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.000E+63 -14.600 18170.00/ TROE/0.1894 277.0 8748.0 7891.0/ O + I-C3H7 <=> C2H5 + CH2O 9.640E+13 0.000 0.00 H + I-C3H7 <=> CH3 + C2H5 4.060E+06 2.190 890.00 DUPLICATE H + I-C3H7 (+ M) <=> C3H8 (+ M) 3.613E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/4.420E+61 -13.545 11357.00/ TROE/0.315 369.0 3285.0 6667.0/ O + C3H8 <=> OH + I-C3H7 193000.000 2.680 3716.00 DUPLICATE OH + I-C3H7 <=> C2H5 + CH2OH 2.410E+13 0.000 0.00 HO2 + I-C3H7 <=> O2 + C3H8 2.550E+10 0.255 -943.00 HO2 + I-C3H7 => OH + C2H5 + CH2O 2.410E+13 0.000 0.00 H + C3H8 <=> I-C3H7 + H2 1.320E+06 2.540 6756.00 DUPLICATE OH + C3H8 <=> I-C3H7 + H2O 3.160E+07 1.800 934.00 DUPLICATE I-C3H7 + H2O2 <=> HO2 + C3H8 378.000 2.720 1500.00 DUPLICATE CH3 + I-C3H7 <=> 2C2H5 1.927E+13 -0.320 0.00 CH3 + C3H8 <=> I-C3H7 + CH4 0.903 3.650 7154.00 DUPLICATE N2O + H <=> N2 + OH 3.870E+14 0.000 18880.00 NH + NO <=> N2 + OH 2.160E+13 -0.230 0.00 NH + NO <=> N2O + H 3.650E+14 -0.450 0.00 NNH + O <=> OH + N2 2.500E+13 0.000 0.00 NNH + O <=> NH + NO 7.000E+13 0.000 0.00 H + O2 + H2O <=> HO2 + H2O 1.126E+19 -0.760 0.00 H + O2 + AR <=> HO2 + AR 7.000E+17 -0.800 0.00 HCN + M <=> H + CN + M 1.040E+29 -3.300 126600.0 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ HNCO + M <=> NH + CO + M 1.180E+16 0.000 84720.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ CH + N2 (+ M) <=> HCNN (+ M) 3.100E+12 0.150 0.00 AR/1.0/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.300E+25 -3.160 740.00/ TROE/0.667 235.0 2117.0 4536.0/ CN + OH <=> NCO + H 4.000E+13 0.000 0.00 NCO + H <=> NH + CO 5.400E+13 0.000 0.00 HCN + O <=> NCO + H 20300.000 2.640 4980.00 HCN + O <=> NH + CO 5070.000 2.640 4980.00 HCN + O <=> CN + OH 3.910E+09 1.580 26600.00 CH + NO <=> HCN + O 4.100E+13 0.000 0.00 CH + NO <=> H + NCO 1.620E+13 0.000 0.00 CH + NO <=> N + HCO 2.460E+13 0.000 0.00 NCO + OH <=> NO + H + CO 2.500E+12 0.000 0.00 HNCO + O <=> NH + CO2 9.800E+07 1.410 8500.00 HNCO + O <=> HNO + CO 1.500E+08 1.570 44000.00 HNCO + O <=> NCO + OH 2.200E+06 2.110 11400.00 NH + CO2 <=> HNO + CO 1.000E+13 0.000 14350.00 HCNN + O <=> CO + H + N2 2.200E+13 0.000 0.00 HCNN + O <=> HCN + NO 2.000E+12 0.000 0.00 HCNN + O2 <=> O + HCO + N2 1.200E+13 0.000 0.00 H + HCN (+ M) <=> H2CN (+ M) 3.300E+13 0.000 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.400E+26 -3.400 1900.00/ CN + H2 <=> HCN + H 295000.000 2.450 2240.00 CN + H2O <=> HCN + OH 8.000E+12 0.000 7460.00 HCN + OH <=> HOCN + H 1.100E+06 2.030 13370.00 HCN + OH <=> HNCO + H 4400.000 2.260 6400.00 HCN + OH <=> NH2 + CO 160.000 2.560 9000.00 T-CH2 + NO <=> H + HNCO 3.100E+17 -1.380 1270.00 T-CH2 + NO <=> OH + HCN 2.900E+14 -0.690 760.00 T-CH2 + NO <=> H + HCNO 3.800E+13 -0.360 580.00 CH2* + NO <=> H + HNCO 3.100E+17 -1.380 1270.00 CH2* + NO <=> OH + HCN 2.900E+14 -0.690 760.00 CH2* + NO <=> H + HCNO 3.800E+13 -0.360 580.00 HNCO + H <=> NH2 + CO 2.250E+07 1.700 3800.00 HNCO + H <=> H2 + NCO 105000.000 2.500 13300.00 HCNO + H <=> HNCO + H 2.100E+15 -0.690 2850.00 HCNO + H <=> OH + HCN 2.700E+11 0.180 2120.00 HCNO + H <=> NH2 + CO 1.700E+14 -0.750 2890.00 HOCN + H <=> HNCO + H 2.000E+07 2.000 2000.00 HNCO + OH <=> NCO + H2O 3.300E+07 1.500 3600.00 HNCO + OH <=> NH2 + CO2 3.300E+06 1.500 3600.00 HCNN + OH <=> H + HCO + N2 1.200E+13 0.000 0.00 CH3 + N <=> H2CN + H 6.100E+14 -0.310 290.00 CH3 + N <=> HCN + H2 3.700E+12 0.150 -90.00 CH3 + NO <=> HCN + H2O 9.600E+13 0.000 28800.00 CH3 + NO <=> H2CN + OH 1.000E+12 0.000 21750.00 NNH + CH3 <=> CH4 + N2 2.500E+13 0.000 0.00 NCO + M <=> N + CO + M 3.100E+14 0.000 54050.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ CN + O <=> CO + N 7.700E+13 0.000 0.00 C + NO <=> CN + O 1.900E+13 0.000 0.00 C + NO <=> CO + N 2.900E+13 0.000 0.00 CN + O2 <=> NCO + O 6.140E+12 0.000 -440.00 NCO + O <=> NO + CO 2.350E+13 0.000 0.00 N + CO2 <=> NO + CO 3.000E+12 0.000 11300.00 NCO + O2 <=> NO + CO2 2.000E+12 0.000 20000.00 C + N2 <=> CN + N 6.300E+13 0.000 46020.00 NCO + N <=> N2 + CO 2.000E+13 0.000 0.00 NCO + NO <=> N2O + CO 1.900E+17 -1.520 740.00 NCO + NO <=> N2 + CO2 3.800E+18 -2.000 800.00 CN + NO2 <=> NCO + NO 6.160E+15 -0.752 345.00 NCO + NO2 <=> N2O + CO2 3.250E+12 0.000 -705.00 HCCO + NO <=> HCNO + CO 9.000E+12 0.000 0.00 H + NO + M <=> HNO + M 4.480E+19 -1.320 740.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ NNH + M <=> N2 + H + M 1.300E+14 -0.110 4980.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ N + OH <=> NO + H 3.360E+13 0.000 385.00 NH + O <=> NO + H 4.000E+13 0.000 0.00 NO2 + H <=> NO + OH 1.320E+14 0.000 360.00 NH + O2 <=> HNO + O 461000.000 2.000 6500.00 NH + O2 <=> NO + OH 1.280E+06 1.500 100.00 HNO + O <=> NO + OH 2.500E+13 0.000 0.00 HO2 + NO <=> NO2 + OH 2.110E+12 0.000 -480.00 HNO + O2 <=> HO2 + NO 1.000E+13 0.000 13000.00 NH + N <=> N2 + H 1.500E+13 0.000 0.00 NNH <=> N2 + H 3.300E+08 0.000 0.00 H + O2 + N2 <=> HO2 + N2 2.600E+19 -1.240 0.00 N2O + OH <=> N2 + HO2 2.000E+12 0.000 21060.00 NNH + O2 <=> HO2 + N2 5.000E+12 0.000 0.00 H + O2 + O2 <=> HO2 + O2 2.080E+19 -1.240 0.00 NH + H <=> N + H2 3.200E+13 0.000 330.00 NH + OH <=> HNO + H 2.000E+13 0.000 0.00 NH + OH <=> N + H2O 2.000E+09 1.200 0.00 NH2 + O <=> OH + NH 3.000E+12 0.000 0.00 NH2 + O <=> H + HNO 3.900E+13 0.000 0.00 HNO + H <=> H2 + NO 9.000E+11 0.720 660.00 HNO + OH <=> NO + H2O 1.300E+07 1.900 -950.00 NNH + H <=> H2 + N2 5.000E+13 0.000 0.00 NNH + OH <=> H2O + N2 2.000E+13 0.000 0.00 NH2 + H <=> NH + H2 4.000E+13 0.000 3650.00 NH + H2O <=> HNO + H2 2.000E+13 0.000 13850.00 NH2 + OH <=> NH + H2O 9.000E+07 1.500 -460.00 NH3 + O <=> NH2 + OH 9.400E+06 1.940 6460.00 NH3 + H <=> NH2 + H2 540000.000 2.400 9915.00 NH3 + OH <=> NH2 + H2O 5.000E+07 1.600 955.00 NO + O + M <=> NO2 + M 1.060E+20 -1.410 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ N2O (+ M) <=> N2 + O (+ M) 7.910E+10 0.000 56020.00 AR/0.625/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/6.370E+14 0.000 56640.00/ N + O2 <=> NO + O 9.000E+09 1.000 6500.00 NO2 + O <=> NO + O2 3.900E+12 0.000 -240.00 N + NO <=> N2 + O 2.700E+13 0.000 355.00 N2O + O <=> N2 + O2 1.400E+12 0.000 10810.00 N2O + O <=> 2NO 2.900E+13 0.000 23150.00 IC16H33 => C4H81 + C8H16 + 0.4pC4H9 + 0.6T-C4H9 3.000E+13 0.000 29000.00 IC16H33 => 0.56C3H6 + C4H81 + C8H16 + 0.67CH3 + 0.33PXC5H11 2.000E+13 0.000 29000.00 IC16H33 => C8H16 + S3XC8H17 5.000E+13 0.000 29000.00 IC16H33 => 2C8H16 + H 2.000E+14 0.000 38000.00 O2 + IC16H33 => 2C8H16 + HO2 2.500E+11 0.000 3500.00 O2 + IC16H33 => IC16H33-OO 2.000E+12 0.000 0.00 IC16H33-OO => O2 + IC16H33 6.300E+13 0.000 30800.00 IC16H33-OO => IC16-QOOH 1.000E+12 0.000 24000.00 IC16-QOOH => IC16H33-OO 1.200E+12 0.000 20500.00 IC16-QOOH => 2C8H16 + HO2 1.500E+11 0.000 21000.00 IC16-QOOH => CH2O + C3H6 + C4H81 + C8H16 + OH 5.000E+11 0.000 21500.00 O2 + IC16-QOOH => IC16-OOQOOH 2.000E+12 0.000 0.00 IC16-OOQOOH => O2 + IC16-QOOH 2.000E+13 0.000 30500.00 IC16H34 => 0.67C3H6 + C4H81 + T-C4H9 + 0.67PXC5H11 + 0.33S3XC8H17 2.500E+17 0.000 77000.00 IC16H34 + O => OH + IC16H33 2.165E+07 2.000 2579.54 O2 + IC16H34 => HO2 + IC16H33 2.726E+07 2.000 40722.50 IC16H34 + H => H2 + IC16H33 3.851E+07 2.000 3950.57 IC16H34 + OH => H2O + IC16H33 6.38997E+06 2.000 -2259.83 IC16H34 + HO2 => H2O2 + IC16H33 861997.000 2.000 11887.70 IC16H34 + HCO => CH2O + IC16H33 2.021E+06 2.000 12360.40 IC16H34 + CH3 => CH4 + IC16H33 624502.000 2.000 4871.29 IC16H34 + CH2OH => CH3OH + IC16H33 452400.000 2.000 10472.60 IC16H34 + CH3O => CH3OH + IC16H33 684699.000 2.000 1583.56 IC16H34 + HCCO => CH2CO + IC16H33 684699.000 2.000 5333.37 IC16H34 + C2H3 => C2H4 + IC16H33 1.085E+06 2.000 4871.29 IC16H34 + CH3CO => CH3CHO + IC16H33 2.165E+06 2.000 14065.90 IC16H34 + CH2CHO => CH3CHO + IC16H33 367700.000 2.000 11415.50 IC16H34 + C3H3 => aC3H4 + IC16H33 432000.000 2.000 14730.60 IC16H34 + S-C3H5 => C3H6 + IC16H33 432000.000 2.000 4594.58 IC16H34 + aC3H5 => C3H6 + IC16H33 385100.000 2.000 15253.30 IC16H34 + CH3CCH2 => C3H6 + IC16H33 432000.000 2.000 4594.58 IC16H34 + I-C4H3 => C4H4 + IC16H33 653902.000 2.000 5333.37 IC16H34 + iC4H5 => C4H6 + IC16H33 432000.000 2.000 4594.58 IC16H34 + C4H7 => C4H81 + IC16H33 543900.000 2.000 15253.30 IC16H34 + A1- => C6H6 + IC16H33 216500.000 2.000 -111.23 IC16H34 + A1O => A1OH + IC16H33 432000.000 2.000 12549.60 A1C2H2 => A1- + C2H2 4.000E+13 0.000 68000.00 DUPLICATE O + C9H7 <=> A1C2H2 + CO 1.000E+14 0.000 0.00 DUPLICATE O2 + C9H7 => A1C2H + CO + OH 5.000E+11 0.000 17500.00 O + C9H8 => A1- + C2H3 + CO 6.000E+12 0.000 0.00 OH + C9H7 => 0.5A1C2H3 + 0.5CO + 0.5A1C2H2 + 0.5HCO 1.000E+13 0.000 0.00 HO2 + C9H7 => A1- + CO + CH2CHO 1.000E+13 0.000 0.00 A1CH3* + C2H2 <=> C9H8 + H 1.000E+12 0.000 5000.00 CH3 + A1C2H => C9H8 + H 3.000E+11 0.000 7600.00 OH + C9H8 => A1- + C2H4 + CO 6.000E+12 0.000 0.00 A2 <=> A2- + H 5.000E+15 0.000 116000.0 DUPLICATE H + A2O => C9H8 + CO 5.000E+13 0.000 0.00 H + A2 => 0.5RTETRALIN + 0.5A2- 5.000E+12 0.000 2500.00 HCO + C9H8 => CH2O + C9H7 757800.000 2.000 11485.90 OH + A2 => C9H8 + CO + H 2.000E+12 0.000 5000.00 C9H7 + CH2O => C9H8 + HCO 108300.000 2.000 13285.90 H + C10H10 => RTETRALIN 1.000E+13 0.000 2500.00 RTETRALIN => C9H8 + CH3 1.500E+13 0.000 30500.00 RTETRALIN => A2 + H2 + H 2.000E+13 0.000 30500.00 RTETRALIN => C10H10 + H 3.000E+14 0.000 41000.00 CH3 + C9H8 => A2 + H2 + H 3.000E+11 0.000 7600.00 A2CH2 => C9H7 + C2H2 6.000E+13 0.000 70000.00 DUPLICATE C9H7 + C2H2 => A2CH2 1.000E+12 0.000 20000.00 DUPLICATE C9H7 + C2H2 => C9H8 + C2H 27070.000 2.000 24161.30 A2CH2O => A2 + H + CO 5.000E+11 0.000 44000.00 C2H2 + C9H8 => A2CH3 3.000E+11 0.000 30000.00 C2H3 + C9H8 => C2H4 + C9H7 407000.000 2.000 5706.99 C9H7 + C2H4 => C9H8 + C2H3 108300.000 2.000 24307.00 H + A3 => 0.6875A3- + 0.4375RTETRALIN 1.000E+13 0.000 3500.00 O2 + RTETRALIN => 2CO + A1- + H2 + C2H4 2.500E+11 0.000 1000.00 O2 + RTETRALIN => HO2 + C10H10 5.000E+11 0.000 3000.00 TETRALIN => aC3H5 + A1CH3* 1.000E+14 0.000 76500.00 TETRALIN => C2H3 + A1C2H3 + H 2.000E+14 0.000 76500.00 TETRALIN => A1- + C2H3 + C2H4 1.000E+13 0.000 76500.00 TETRALIN => A1C2H3 + C2H4 1.500E+13 0.000 70000.00 TETRALIN => C10H10 + H2 5.000E+13 0.000 70000.00 O + TETRALIN => OH + RTETRALIN 2.165E+07 2.000 2579.54 O2 + TETRALIN => HO2 + RTETRALIN 2.726E+07 2.000 40722.50 H + TETRALIN => H2 + RTETRALIN 3.851E+07 2.000 3950.57 H + TETRALIN => A1- + 2C2H4 8.000E+12 0.000 5000.00 TETRALIN + H => C2H4 + A1C2H3 + H 1.000E+12 0.000 5000.00 OH + TETRALIN => H2O + RTETRALIN 6.390E+06 2.000 -2259.83 OH + TETRALIN => A1CH3 + HCO + C2H4 3.000E+12 0.000 2000.00 HO2 + TETRALIN => H2O2 + RTETRALIN 862000.000 2.000 11887.70 HCO + TETRALIN => CH2O + RTETRALIN 2.021E+06 2.000 12360.40 CH3 + TETRALIN => CH4 + RTETRALIN 624500.000 2.000 4871.29 C2H3 + TETRALIN => C2H4 + RTETRALIN 1.085E+06 2.000 4871.29 A1- + C9H8 => A3 + CH3 1.000E+12 0.000 8000.00 A1CH3* + C9H8 => A1CH3 + C9H7 81200.000 2.000 724.47 C9H7 + A1CH3 => C9H8 + A1CH3* 135300.000 2.000 24824.50 C9H7 + A1C2H => C9H8 + A1C2H* 135300.000 2.000 24161.30 A1C2H2 + C9H8 => A1C2H3 + C9H7 81200.000 2.000 724.47 C9H7 + A1C2H3 => C9H8 + A1C2H2 135300.000 2.000 24824.50 A1CH3* + TETRALIN => A1CH3 + RTETRALIN 216500.000 2.000 -111.23 A1C2H2 + TETRALIN => A1C2H3 + RTETRALIN 216500.000 2.000 -111.23 C9H7 + A2 => C9H8 + A2- 216500.000 2.000 24824.50 A2- + C9H8 => A2 + C9H7 51230.000 2.000 724.47 C9H7 + A2OH => C9H8 + A2O 135300.000 2.000 19025.60 C9H7 + C10H10 => C9H8 + A2 + H 189500.000 2.000 15681.40 C9H7 + TETRALIN => C9H8 + RTETRALIN 216500.000 2.000 15681.40 C9H7 + A2CH3 => C9H8 + C10H6CH3 189500.000 2.000 24824.50 C9H7 + A2CH3 => C9H8 + A2CH2 40600.000 2.000 15681.40 C10H6CH3 + C9H8 => A2CH3 + C9H7 81200.000 2.000 724.47 C9H7 + CH3C10H6OH => C9H8 + A2CH2O 47370.000 2.000 15681.40 A2- + TETRALIN => A2 + RTETRALIN 136600.000 2.000 -111.23 C10H6CH3 + TETRALIN => A2CH3 + RTETRALIN 216500.000 2.000 -111.23 C9H7 + A3 => C9H8 + A3- 270700.000 2.000 24161.30 T-CH2 + O <=> HCO + H 8.000E+13 0.000 0.00 DUPLICATE T-CH2 + O2 <=> HCO + OH 1.060E+13 0.000 1500.00 DUPLICATE T-CH2 + O2 <=> CO2 + 2H 2.640E+12 0.000 1500.00 DUPLICATE T-CH2 + H (+ M) <=> CH3 (+ M) 2.500E+16 -0.800 0.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/3.200E+27 -3.140 1230.00/ TROE/0.68 78.0 1995.0 5590.0/ T-CH2 + OH <=> CH2O + H 2.000E+13 0.000 0.00 DUPLICATE T-CH2 + HO2 <=> CH2O + OH 2.000E+13 0.000 0.00 DUPLICATE T-CH2 + H2 <=> H + CH3 500000.000 2.000 7230.00 DUPLICATE CH2* + H2O <=> T-CH2 + H2O 3.000E+13 0.000 0.00 DUPLICATE CH3 + OH <=> T-CH2 + H2O 5.600E+07 1.600 5420.00 DUPLICATE T-CH2 + CO (+ M) <=> CH2CO (+ M) 8.100E+11 0.500 4510.00 AR/0.7/ H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ DUPLICATE LOW/2.690E+33 -5.110 7095.00/ TROE/0.5907 275.0 1226.0 5185.0/ CH2* + CO <=> T-CH2 + CO 9.000E+12 0.000 0.00 DUPLICATE C2H2 + O <=> T-CH2 + CO 4.080E+06 2.000 1900.00 DUPLICATE CH2* + CO2 <=> T-CH2 + CO2 7.000E+12 0.000 0.00 DUPLICATE CH2CO + O <=> T-CH2 + CO2 1.750E+12 0.000 1350.00 DUPLICATE 2T-CH2 <=> C2H2 + H2 3.200E+13 0.000 0.00 DUPLICATE C2H4 + O <=> T-CH2 + CH2O 384000.000 1.830 220.00 DUPLICATE CH3 + T-CH2 <=> C2H4 + H 4.000E+13 0.000 0.00 DUPLICATE CH4 + T-CH2 <=> 2CH3 2.460E+06 2.000 8270.00 DUPLICATE HCCO + T-CH2 <=> C2H3 + CO 3.000E+13 0.000 0.00 DUPLICATE C3H3 + O <=> CH2O + C2H 2.000E+13 0.000 0.00 C2H2 + T-CH2 <=> C3H3 + H 1.200E+13 0.000 6620.00 CH4 + C2H <=> C2H2 + CH3 1.810E+12 0.000 500.00 C4H2 + H <=> N-C4H3 1.100E+42 -8.720 15300.00 DUPLICATE C4H2 + H <=> I-C4H3 1.100E+30 -4.920 10800.00 N-C4H3 <=> I-C4H3 4.100E+43 -9.490 53000.00 DUPLICATE C2H2 + C2H (+ M) <=> N-C4H3 (+ M) 8.300E+10 0.899 -363.00 H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H2/2.5/ C2H4/2.5/ C2H6/3.0/ LOW/1.240E+31 -4.718 1871.00/ TROE/1.0 100.0 5613.0 13387.0/ C2H2 + C2H (+ M) <=> I-C4H3 (+ M) 8.300E+10 0.899 -363.00 H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H2/2.5/ C2H4/2.5/ C2H6/3.0/ LOW/1.240E+31 -4.718 1871.00/ TROE/1.0 100.0 5613.0 13387.0/ I-C4H3 + O2 <=> HCCO + CH2CO 7.860E+16 -1.800 0.00 DUPLICATE N-C4H3 + H <=> I-C4H3 + H 2.500E+20 -1.670 10800.00 DUPLICATE N-C4H3 + H <=> C2H2 + H2CC 6.300E+25 -3.340 10014.00 DUPLICATE N-C4H3 + H <=> C4H4 2.000E+47 -10.260 13070.00 DUPLICATE N-C4H3 + H <=> C4H2 + H2 3.000E+13 0.000 0.00 DUPLICATE I-C4H3 + H <=> C2H2 + H2CC 2.800E+23 -2.550 10780.00 DUPLICATE I-C4H3 + H <=> C4H4 3.400E+43 -9.010 12120.00 DUPLICATE I-C4H3 + H <=> C4H2 + H2 6.000E+13 0.000 0.00 DUPLICATE N-C4H3 + OH <=> C4H2 + H2O 2.000E+12 0.000 0.00 DUPLICATE I-C4H3 + OH <=> C4H2 + H2O 4.000E+12 0.000 0.00 DUPLICATE C2H3 + C2H2 <=> N-C4H5 9.300E+38 -8.760 12000.00 DUPLICATE C2H4 + C2H <=> C4H4 + H 1.200E+13 0.000 0.00 C3H3 + T-CH2 <=> C4H4 + H 5.000E+13 0.000 0.00 DUPLICATE C4H4 + H <=> N-C4H5 1.300E+51 -11.920 16500.00 DUPLICATE C4H4 + H <=> N-C4H3 + H2 665000.000 2.530 12240.00 DUPLICATE C4H4 + H <=> I-C4H3 + H2 333000.000 2.530 9240.00 DUPLICATE N-C4H5 <=> iC4H5 1.500E+67 -16.890 59100.00 DUPLICATE S-C4H5 <=> iC4H5 1.500E+67 -16.890 59100.00 DUPLICATE c-C4H5 <=> C4H4 + H 3.000E+12 0.000 52000.00 c-C4H5 <=> C2H3 + C2H2 2.000E+12 0.000 58000.00 C4H4 + OH <=> N-C4H3 + H2O 3.100E+07 2.000 3430.00 DUPLICATE C4H4 + OH <=> I-C4H3 + H2O 1.550E+07 2.000 430.00 DUPLICATE c-C4H5 + O <=> CH2CHO + C2H2 1.000E+14 0.000 0.00 S-C4H5 + O2 <=> CH3CO + CH2CO 2.160E+10 0.000 2500.00 c-C4H5 + O2 <=> CH2CHO + CH2CO 4.800E+11 0.000 19000.00 2C2H3 <=> N-C4H5 + H 2.400E+20 -2.040 15361.00 DUPLICATE N-C4H5 + H <=> iC4H5 + H 3.100E+26 -3.350 17423.00 DUPLICATE N-C4H5 + H <=> C4H4 + H2 1.500E+13 0.000 0.00 DUPLICATE iC4H5 + H <=> S-C4H5 + H 3.100E+26 -3.350 17423.00 DUPLICATE C4H6 <=> N-C4H5 + H 5.300E+44 -8.620 123608.0 DUPLICATE c-C4H5 + H <=> C4H6 1.000E+13 0.000 0.00 c-C4H5 + H <=> C2H4 + C2H2 1.000E+13 0.000 0.00 N-C4H5 + OH <=> C4H4 + H2O 2.000E+12 0.000 0.00 DUPLICATE C4H6 + O <=> N-C4H5 + OH 7.500E+06 1.900 3740.00 DUPLICATE N-C4H5 + HO2 <=> C2H3 + CH2CO + OH 6.600E+12 0.000 0.00 N-C4H5 + HO2 <=> C4H6 + O2 6.000E+11 0.000 0.00 DUPLICATE S-C4H5 + HO2 <=> OH + C2H2 + CH3CO 8.000E+11 0.000 0.00 C4H6 + H <=> N-C4H5 + H2 1.330E+06 2.530 12240.00 DUPLICATE C4H6 + OH <=> N-C4H5 + H2O 6.200E+06 2.000 3430.00 DUPLICATE N-C4H5 + H2O2 <=> C4H6 + HO2 1.210E+10 0.000 -596.00 DUPLICATE pC3H4 + C2H <=> C2H2 + C3H3 1.000E+13 0.000 0.00 C3H3 + C2H2 <=> C5H4 + H 2.350E+11 0.000 9995.20 C5H4 + H <=> C5H3 + H2 1.000E+06 2.500 5000.00 C5H5 + O <=> C5H4O + H 5.810E+13 -0.020 20.00 C5H5O <=> c-C4H5 + CO 1.000E+12 0.000 36000.00 C5H4O + H <=> CO + c-C4H5 4.300E+09 1.450 3900.00 C5H5 + O <=> N-C4H5 + CO 3.200E+13 -0.170 440.00 DUPLICATE C5H4O + H <=> CO + N-C4H5 4.300E+09 1.450 3900.57 N-C4H5 + HCO <=> C4H6 + CO 5.000E+12 0.000 0.00 C5H5 + HO2 <=> C5H4O + H2O 1.190E+33 -6.520 13401.00 C4H6 + CH3 <=> N-C4H5 + CH4 2.000E+14 0.000 22800.00 DUPLICATE N-C4H3 + C2H2 <=> A1- 9.600E+70 -17.770 31300.00 DUPLICATE N-C4H3 + C2H2 <=> O-C6H4 + H 6.900E+46 -10.010 30100.00 DUPLICATE A1- + O <=> C5H5 + CO 1.000E+14 0.000 0.00 A1O + O <=> HCO + 2C2H2 + CO 3.000E+13 0.000 0.00 A1- + H <=> O-C6H4 + H2 2.000E+11 1.100 24500.00 C5H3 + CH3 <=> C2H2 + C4H4 2.000E+13 0.000 0.00 C6H6 + O <=> C5H5 + HCO 1.390E+13 0.000 4530.00 A1O + H <=> C5H5 + HCO 1.000E+13 0.000 12000.00 A1OH + O <=> A1O + OH 2.800E+13 0.000 7352.00 N-C4H5 + C2H2 <=> C6H6 + H 1.600E+16 -1.330 5400.00 DUPLICATE S-C4H5 + C2H2 <=> C6H6 + H 5.000E+14 0.000 25000.00 N-C4H5 + C2H3 <=> C6H6 + H2 1.840E-13 7.070 -3611.00 C4H6 + C2H3 <=> N-C4H5 + C2H4 5.000E+13 0.000 22800.00 C4H6 + C2H3 <=> C6H6 + H2 + H 5.620E+11 0.000 3240.00 C3H3 + C4H4 <=> A1CH2 653000.000 1.280 -4611.00 A1CH2 <=> C5H5 + C2H2 2.000E+14 0.000 70000.00 DUPLICATE A1- + CH2O <=> C6H6 + HCO 85500.000 2.190 38.00 A1CH2 + H <=> A1- + CH3 1.500E+66 -13.940 64580.00 DUPLICATE A1CH3 + O <=> A1CH2 + OH 6.300E+11 0.000 0.00 DUPLICATE A1CH3 + O2 <=> A1CH2 + HO2 3.000E+14 0.000 42992.00 DUPLICATE C3H3 + C4H6 <=> A1CH3 + H 653000.000 1.280 -4611.00 A1CH3 + H <=> A1CH2 + H2 1.259E+14 0.000 8359.00 DUPLICATE A1CH3 + H <=> A1- + CH4 0.600 5.000 30000.00 A1CH3 + OH <=> A1CH2 + H2O 1.620E+13 0.000 2770.00 DUPLICATE A1CH3 + HO2 <=> A1CH2 + H2O2 3.975E+11 0.000 14069.00 DUPLICATE A1C2H + O => C2H + A1O 2.200E+13 0.000 4530.00 A1C2H + OH => A1O + C2H2 1.300E+13 0.000 10600.00 2C4H4 <=> A1C2H3 1.500E+14 0.000 38000.00 A1C2H3 + O => A1- + CH3 + CO 1.920E+07 1.830 220.00 A1C2H3 + O => C2H3 + A1O 2.200E+13 0.000 4530.00 A1CH2 + T-CH2 <=> A1C2H3 + H 1.000E+13 0.000 0.00 N-C4H5 + C4H4 <=> A1C2H3 + H 3.160E+11 0.000 600.00 A1OH + C2H3 <=> A1O + C2H4 6.000E+12 0.000 0.00 A1C2H3 + OH => A1O + C2H4 1.300E+13 0.000 10600.00 A1CH3 + T-CH2 <=> A1C2H3 + H2 3.000E+13 0.000 0.00 A1- + C2H6 <=> C6H6 + C2H5 2.100E+11 0.000 4443.00 A1CH3 + CH3 <=> A1CH2 + CH4 3.160E+11 0.000 9500.00 DUPLICATE C9H7 + O <=> C9H6O + H 2.800E+13 0.000 0.00 C9H6O + H => A1C2H3* + CO 1.790E+07 2.100 841.30 C9H8 + O => C9H6O + 2H 6.650E+12 -0.100 360.90 C9H7 + HO2 <=> C9H6O + H2O 4.760E+32 -6.500 13401.00 A1CH2 + C2H2 <=> C9H8 + H 31600.000 2.500 11061.20 DUPLICATE C6H6 + C3H3 <=> C9H8 + H 6.260E+09 2.610 56500.00 A1C2H + CH3 => A1C2H* + CH4 0.881 3.843 12253.80 A1C2H* + CH4 => A1C2H + CH3 0.195 4.154 3700.90 C9H8 + OH => O-C6H4 + C2H4 + HCO 1.880E+36 -7.800 7060.20 A1C2H* + C2H2 => A1C2HC2H2 23000.000 2.530 2860.00 A1C2HC2H2 => A1C2H* + C2H2 4.800E+13 0.456 43186.00 A1C2HC2H2 => A1C2HC2H2u 2.700E+12 0.040 5092.00 A1C2HC2H2u => A1C2HC2H2 3.890E+12 0.029 4307.00 A1C2HC2H2u => A2- 1.200E+12 -0.003 4484.00 A2- => A1C2HC2H2u 2.980E+12 0.681 59594.00 A2- + H <=> A2* + H 2.400E+24 -1.810 45281.00 A2 <=> A2* + H 8.600E+60 -12.500 148076.0 DUPLICATE A1- + N-C4H3 <=> A2 1.510E+75 -17.900 39600.00 A1- + N-C4H3 <=> A2* + H 1.840E+72 -16.100 57630.00 A1- + N-C4H3 <=> A2- + H 1.840E+72 -16.100 57630.00 A2 + O => CH2CO + A1C2H 2.200E+13 0.000 4530.00 A1- + C4H4 <=> A1C2H3 + C2H 3.200E+11 0.000 1900.00 A2 + H => A2- + H2 2.450E+08 1.884 9829.50 DUPLICATE A2- + H2 => A2 + H 49000.000 2.467 2926.40 DUPLICATE A2 + H => A2* + H2 2.110E+08 1.908 9455.60 DUPLICATE A2* + H2 => A2 + H 50600.000 2.472 2747.10 DUPLICATE A2 + OH <=> A2- + H2O 1.600E+08 1.420 1450.00 DUPLICATE A2 + OH <=> A2* + H2O 1.600E+08 1.420 1450.00 DUPLICATE A2 + OH => A1C2H + CH2CO + H 1.300E+13 0.000 10600.00 A1- + C4H6 <=> A1C2H3 + C2H3 3.200E+11 0.000 1900.00 A2 + CH3 => A2- + CH4 0.399 3.933 11771.00 A2- + CH4 => A2 + CH3 0.0448 4.248 4277.00 A2 + CH3 => A2* + CH4 2.950 3.916 11463.00 A2* + CH4 => A2 + CH3 0.394 4.212 4145.00 2O-C6H4 <=> BIPHEN 4.600E+12 0.000 0.00 A2- + C2H2 <=> A2C2H2A 15840.000 2.550 3951.60 A2- + C2H2 <=> A2C2HA + H 1.300E+24 -3.060 22600.00 A2* + C2H2 <=> A2C2H2B 3.290E+06 2.000 3162.10 P2- <=> BIPHEN + H 1.300E+16 0.000 33203.00 C9H7 + C3H2 <=> A2R5 + H 1.000E+13 0.000 0.00 A2C2HA + OH => A2- + CH2CO 0.000218 4.500 -1000.00 A2C2HB + OH => A2* + CH2CO 0.000218 4.500 -1000.00 A2C2HA + OH => A1C2H + C4H2O + H 1.300E+13 0.000 10600.00 A2C2HB + OH => A1C2H + C4H2O + H 1.300E+13 0.000 10600.00 A2- + C2H3 <=> A2C2H2A + H 9.400 4.140 23234.00 A2* + C2H3 <=> A2C2H2B + H 9.400 4.140 23234.00 C9H7 + C3H3 <=> A2R5 + H2 4.100E+43 -9.200 15153.00 P2- + H <=> BIPHEN + H2 6.020E+12 0.000 0.00 2A1- <=> BIPHEN + H2 5.600E+12 -0.074 7550.00 A2- + C2H4 <=> A2C2H2A + H2 3.620E+28 -4.200 23864.70 DUPLICATE A2* + C2H4 <=> A2C2H2B + H2 3.620E+28 -4.200 23864.70 DUPLICATE A1OH + A1- <=> A1O + C6H6 4.910E+12 0.000 4400.00 A1CH3 + A1- <=> A1CH2 + C6H6 2.103E+12 0.000 4400.00 DUPLICATE P2 + CH3 => P2- + CH4 0.149 4.002 11934.10 P2- + CH4 => P2 + CH3 0.0127 4.309 5108.70 A2C2HB* + C2H2 <=> A2R5C2H + H 1.800E+19 -1.670 18800.00 A2C2HA + C2H <=> A2R5C2H + H 5.000E+13 0.000 0.00 A2C2HB + C2H <=> A2R5C2H + H 5.000E+13 0.000 0.00 A2C2HB* + C2H2 => A3- 23000.000 2.530 2860.00 A2R5C2H + H => A3- 1.200E+09 1.530 3695.50 A2R5C2H + H => A3* 1.200E+09 1.530 3695.50 A3* => A2R5- + C2H2 2.300E+09 1.6031 61850.00 DUPLICATE A2R5- + C2H2 => A3* 3.290E+06 2.000 3162.10 DUPLICATE A3- + H <=> A3* + H 3.800E+40 -6.309 61782.00 A3 <=> A3- + H 4.300E+60 -12.500 148076.0 DUPLICATE A2C2HB* + C2H3 => A3 9.400 4.140 23234.00 A3 + O => A2C2HA + CH2CO 1.100E+13 0.000 4530.00 A3 + O => A2C2HB + CH2CO 1.100E+13 0.000 4530.00 A2- + C4H4 => A3 + H 12600.000 2.610 1649.20 DUPLICATE A2* + C4H4 => A3 + H 12600.000 2.610 1649.20 DUPLICATE A3 + H => A3* + H2 6.120E+07 1.921 9824.50 DUPLICATE A3* + H2 => A3 + H 29600.000 2.498 4751.60 DUPLICATE A3 + H => A3- + H2 1.050E+08 1.908 9455.60 DUPLICATE A3- + H2 => A3 + H 50600.000 2.472 2747.10 DUPLICATE A3 + OH <=> A3- + H2O 1.600E+08 1.420 1450.00 DUPLICATE A3 + OH <=> A3* + H2O 1.600E+08 1.420 1450.00 DUPLICATE A3 + OH => A2C2HB + CH2CO + H 6.500E+12 0.000 10600.00 A3 + OH => A2C2HA + CH2CO + H 6.500E+12 0.000 10600.00 A3 + CH3 => A3* + CH4 0.0117 4.177 12246.00 A3* + CH4 => A3 + CH3 0.00313 4.486 6563.70 A3 + CH3 => A3- + CH4 1.470 3.916 11463.00 A3- + CH4 => A3 + CH3 0.394 4.212 4145.00 A4- + H <=> A4 1.000E+14 0.000 0.00 DUPLICATE A4-2 + H <=> A4 1.000E+14 0.000 0.00 A4-4 + H <=> A4 1.000E+14 0.000 0.00 A3 + C2H <=> A3C2H + H 5.000E+13 0.000 0.00 A3* + C2H2 <=> A3C2H2 1.280E+06 2.050 1931.17 A3* + C2H2 <=> A3C2H + H 1.280E+06 2.050 1931.17 A3C2H + H <=> A3C2H2 3.180E+09 1.175 4580.00 A3C2H + H <=> A4 + H 3.180E+09 1.175 4580.00 A3C2H2 <=> A4 + H 1.910E+09 1.138 1629.00 A3- + C2H2 <=> A3C2H-2 + H 2.080E+15 -0.130 20860.00 A3* + C2H2 => A4 + H 1.280E+06 2.050 1931.17 DUPLICATE A1C2H* + A1C2H => A4 + H 8.510E+11 0.000 3986.00 A4 + H => A4- + H2 4.900E+08 1.884 9829.50 DUPLICATE A4- + H2 => A4 + H 49000.000 2.467 2926.40 DUPLICATE A4 + H => A4-2 + H2 4.900E+08 1.884 9829.50 A4-2 + H2 => A4 + H 49000.000 2.467 2926.40 A4 + H => A4-4 + H2 4.900E+08 1.884 9829.50 A4-4 + H2 => A4 + H 49000.000 2.467 2926.40 A3C2H-2 + H => A3C2H-2JS + H2 1.350E+08 1.890 10767.00 A3C2H-2JS + H2 => A3C2H-2 + H 53800.000 2.469 2827.10 A4 + OH <=> A4- + H2O 1.600E+08 1.420 1450.00 DUPLICATE A4 + OH <=> A4-2 + H2O 1.600E+08 1.420 1450.00 A4 + OH <=> A4-4 + H2O 1.600E+08 1.420 1450.00 A3C2H-2 + OH <=> A3C2H-2JS + H2O 1.600E+08 1.420 1450.00 A3C2H-2 + OH <=> A3- + CH2CO 0.000218 4.500 -1000.00 A3C2H + OH => A3* + CH2CO 0.000218 4.500 -1000.00 A3C2H + OH => A2C2HA + C4H2O + H 6.500E+12 0.000 10600.00 A3C2H + OH => A2C2HB + C4H2O + H 6.500E+12 0.000 10600.00 A4 + OH => A3* + CH2CO 1.300E+13 0.000 10600.00 A4 + CH3 => A4- + CH4 0.798 3.933 11771.00 A4- + CH4 => A4 + CH3 0.0448 4.248 4277.00 A4 + CH3 => A4-2 + CH4 0.798 3.933 11771.00 A4-2 + CH4 => A4 + CH3 0.0448 4.248 4277.00 A4 + CH3 => A4-4 + CH4 0.798 3.933 11771.00 A4-4 + CH4 => A4 + CH3 0.0448 4.248 4277.00 A3C2H-2 + CH3 => A3C2H-2JS + CH4 0.881 3.843 12253.80 A3C2H-2JS + CH4 => A3C2H-2 + CH3 0.195 4.154 3700.90 A3R5- + C2H2 <=> A4R5 + H 1.280E+06 2.000 1931.20 DUPLICATE A4-2 + C2H2 <=> A4R5 + H 15840.000 2.550 3951.60 A3C2H-2JS + C2H2 <=> CHRYSENJ1 1.870E+07 1.787 3262.00 A4- + C2H2 <=> PYC2H-1 + H 7.920E-06 5.710 13330.00 A4-2 + C2H2 <=> PYC2H-2 + H 1.250E+17 -0.560 22560.00 A4-4 + C2H2 <=> PYC2H-4 + H 7.920E-06 5.710 13330.00 PYC2H-1 + H => PYC2H-1JP + H2 1.350E+08 1.890 10767.00 PYC2H-2 + H => PYC2H-2JS + H2 1.350E+08 1.890 10767.00 PYC2H-1JP + H2 => PYC2H-1 + H 53800.000 2.469 2827.10 PYC2H-2JS + H2 => PYC2H-2 + H 53800.000 2.469 2827.10 PYC2H-4 + H => PYC2H-4JS + H2 1.350E+08 1.890 10767.00 PYC2H-4JS + H2 => PYC2H-4 + H 53800.000 2.469 2827.10 PYC2H-1 + OH <=> PYC2H-1JP + H2O 1.600E+08 1.420 1450.00 PYC2H-2 + OH <=> PYC2H-2JS + H2O 1.600E+08 1.420 1450.00 PYC2H-2 + OH <=> A4-2 + CH2CO 0.000218 4.500 -1000.00 PYC2H-4 + OH <=> PYC2H-4JS + H2O 1.600E+08 1.420 1450.00 CHRYSEN + CH3 => CHRYSENJ1 + CH4 0.798 3.933 11771.00 CHRYSENJ1 + CH4 => CHRYSEN + CH3 0.0448 4.248 4277.00 CHRYSEN + CH3 => CHRYSENJ4 + CH4 0.798 3.933 11771.00 CHRYSENJ4 + CH4 => CHRYSEN + CH3 0.0448 4.248 4277.00 CHRYSEN + CH3 => CHRYSENJ5 + CH4 0.798 3.933 11771.00 CHRYSENJ5 + CH4 => CHRYSEN + CH3 0.0448 4.248 4277.00 C5H3 + H <=> C5H4 1.000E+13 0.000 0.00 C5H3 + H <=> C3H2 + C2H2 5.000E+13 0.000 0.00 C5H5 (+ M) <=> C2H2 + C3H3 (+ M) 6.310E+13 -0.075 62300.00 LOW/1.000E+45 8.400 47500.00/ A1- + H (+ M) <=> C6H6 (+ M) 1.000E+14 0.000 0.00 H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ LOW/6.600E+75 -16.300 7000.00/ TROE/1.0 0.1 584.9 6113.0/ A1O + H (+ M) <=> A1OH (+ M) 2.500E+14 0.000 0.00 H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.000E+94 -21.840 13880.00/ TROE/0.043 304.2 60000.0 5896.4/ A1OH + O2 <=> A1O + HO2 7.320E+13 0.000 41400.60 A1CH2 + H (+ M) <=> A1CH3 (+ M) 1.000E+14 0.000 0.00 H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/1.100E+103 -24.630 14590.00/ TROE/0.431 383.0 152.0 4730.0/ A1C2H* + H (+ M) <=> A1C2H (+ M) 1.000E+14 0.000 0.00 H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/6.600E+75 -16.300 7000.00/ TROE/1.0 0.1 584.9 6113.0/ A1C2H3* + H (+ M) <=> A1C2H3 (+ M) 1.000E+14 0.000 0.00 H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/6.600E+75 -16.300 7000.00/ TROE/1.0 0.1 584.9 6113.0/ A2- + H (+ M) <=> A2 (+ M) 1.000E+14 0.000 0.00 H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.800E+127 -31.434 18676.00/ TROE/0.2 122.8 478.4 5411.9/ A2* + H (+ M) <=> A2 (+ M) 1.000E+14 0.000 0.00 H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/9.500E+129 -32.132 18782.00/ TROE/0.87 492.7 117.9 5652.0/ A1OH + N-C4H5 <=> A1O + C4H6 6.000E+12 0.000 0.00 A2C2HB* + H (+ M) <=> A2C2HB (+ M) 1.000E+14 0.000 0.00 H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/3.800E+127 -31.434 18676.00/ TROE/0.2 122.8 478.4 5411.9/ A2R5- + H (+ M) <=> A2R5 (+ M) 1.000E+14 0.000 0.00 H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/6.600E+75 -16.300 7000.00/ TROE/1.0 0.1 584.9 6113.0/ A2C2HA + O => HCCO + A2- 2.040E+07 2.000 1900.00 A2C2HB + O => HCCO + A2* 2.040E+07 2.000 1900.00 A1CH2 + A1OH <=> A1CH3 + A1O 1.050E+11 0.000 9500.00 A3- + H (+ M) <=> A3 (+ M) 1.000E+14 0.000 0.00 H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/4.000E+148 -37.505 20551.00/ TROE/1.0 536.3 144.9 5632.8/ A3* + H (+ M) <=> A3 (+ M) 1.000E+14 0.000 0.00 H2/2.0/ H2O/6.0/ CH4/2.0/ CO/1.5/ CO2/2.0/ C2H6/3.0/ LOW/2.100E+139 -34.803 18378.00/ TROE/0.001 171.4 171.4 4992.8/ A3C2H + O => A2C2HA + C4H2O 1.100E+13 0.000 4530.00 A3C2H + O => A2C2HB + C4H2O 1.100E+13 0.000 4530.00 A4 + O => A3* + HCCO 2.200E+13 0.000 4530.00 A3C2H-2 + O <=> A3- + HCCO 2.040E+07 2.000 1900.00 A1CH2 + C9H7 => A4 + 2H2 2.000E+12 0.000 2000.00 PYC2H-2 + O <=> A4-2 + HCCO 2.040E+07 2.000 1900.00 CHRYSENJ1 + O2 => A3C2H-2 + HCO + CO 2.100E+12 0.000 7470.00 CHRYSENJ1 + H <=> CHRYSEN 5.000E+13 0.000 0.00 CHRYSENJ4 + H <=> CHRYSEN 5.000E+13 0.000 0.00 CHRYSENJ5 + H <=> CHRYSEN 5.000E+13 0.000 0.00 CHRYSEN + O <=> A3C2H-2 + CH2CO 1.100E+13 0.000 4530.00 A3- + C4H4 => CHRYSEN + H 12600.000 2.610 1649.20 CHRYSEN + H => CHRYSENJ1 + H2 4.900E+08 1.884 9829.50 CHRYSENJ1 + H2 => CHRYSEN + H 49000.000 2.467 2926.40 CHRYSEN + H => CHRYSENJ4 + H2 4.900E+08 1.884 9829.50 CHRYSENJ4 + H2 => CHRYSEN + H 49000.000 2.467 2926.40 CHRYSEN + H => CHRYSENJ5 + H2 4.900E+08 1.884 9829.50 CHRYSENJ5 + H2 => CHRYSEN + H 49000.000 2.467 2926.40 CHRYSEN + OH <=> CHRYSENJ1 + H2O 1.600E+08 1.420 1450.00 CHRYSEN + OH <=> CHRYSENJ4 + H2O 1.600E+08 1.420 1450.00 CHRYSEN + OH <=> CHRYSENJ5 + H2O 1.600E+08 1.420 1450.00 CHRYSEN + OH => A3C2H-2 + CH2CO + H 6.500E+12 0.000 10600.00 2C9H7 => A4 + C2H2 + H2 6.390E+29 -4.030 35205.50 PYC2H-1 + CH3 => PYC2H-1JP + CH4 0.881 3.843 12253.80 PYC2H-2 + CH3 => PYC2H-2JS + CH4 0.881 3.843 12253.80 PYC2H-1JP + CH4 => PYC2H-1 + CH3 0.195 4.154 3700.90 PYC2H-2JS + CH4 => PYC2H-2 + CH3 0.195 4.154 3700.90 PYC2H-4 + CH3 => PYC2H-4JS + CH4 0.881 3.843 12253.80 PYC2H-4JS + CH4 => PYC2H-4 + CH3 0.195 4.154 3700.90 PYC2H-1JP + C2H2 => BAPYRJS 1.870E+07 1.787 3262.00 PYC2H-2JS + C2H2 => BAPYRJS 1.870E+07 1.787 3262.00 PYC2H-4JS + C2H2 => BEPYRENJS 1.870E+07 1.787 3262.00 BAPYRJS + O2 => PYC2H-2 + HCO + CO 2.100E+12 0.000 7470.00 BAPYRJS + H <=> BAPYR 5.000E+13 0.000 0.00 BEPYRENJS + H <=> BEPYREN 5.000E+13 0.000 0.00 BAPYR + O <=> PYC2H-2 + CH2CO 1.100E+13 0.000 4530.00 A4- + C4H4 => BAPYR + H 12600.000 2.610 1649.20 A4-2 + C4H4 => BAPYR + H 12600.000 2.610 1649.20 A4-4 + C4H4 => BEPYREN + H 12600.000 2.610 1649.20 CHRYSENJ4 + C2H2 <=> BAPYR + H 1.870E+07 1.787 3262.00 CHRYSENJ5 + C2H2 <=> BAPYR + H 1.870E+07 1.787 3262.00 BEPYREN + H => BEPYRENJS + H2 6.120E+07 1.921 9824.50 BEPYRENJS + H2 => BEPYREN + H 29600.000 2.498 4751.60 BAPYR + H <=> BAPYRJS + H2 2.03E8 2.01 14719 BAPYR + OH => PYC2H-2 + CH2CO + H 6.500E+12 0.000 10600.00 BEPYREN + OH <=> BEPYRENJS + H2O 1.600E+08 1.420 1450.00 BAPYR + OH <=> BAPYRJS + H2O 1.600E+08 1.420 1450.00 BEPYREN + CH3 => BEPYRENJS + CH4 0.0117 4.177 12246.00 BEPYRENJS + CH4 => BEPYREN + CH3 0.394 4.212 4145.00 BAPYR + CH3 => BAPYRJS + CH4 3.09E1 3.58 12223 BAPYRJS + CH4 => BAPYR + CH3 0.394 4.212 4145.00 ANTHANJS + O2 => BAPYRJS + 2CO 2.100E+12 0.000 7470.00 ANTHAN + O => BAPYRJS + HCCO 2.200E+13 0.000 4530.00 BEPYRENJS + C2H2 => BGHIPER + H 1.870E+07 1.787 3262.00 BAPYRJS + C2H2 => ANTHAN + H 1.870E+07 1.787 3262.00 ANTHAN + H => ANTHANJS + H2 4.900E+08 1.884 9829.50 ANTHANJS + H2 => ANTHAN + H 49000.000 2.467 2926.40 BGHIPER + H => BGHIPEJS1 + H2 6.120E+07 1.921 9824.50 BGHIPEJS1 + H2 => BGHIPER + H 29600.000 2.498 4751.60 ANTHAN + OH => ANTHANJS + H2O 1.600E+08 1.420 1450.00 ANTHAN + OH => BAPYRJS + CH2CO 1.300E+13 0.000 10600.00 BGHIPER + OH <=> BGHIPEJS1 + H2O 1.600E+08 1.420 1450.00 ANTHAN + CH3 => ANTHANJS + CH4 0.798 3.933 11771.00 ANTHANJS + CH4 => ANTHAN + CH3 0.0448 4.248 4277.00 BGHIPER + CH3 => BGHIPEJS1 + CH4 0.0117 4.177 12246.00 BGHIPEJS1 + CH4 => BGHIPER + CH3 0.394 4.212 4145.00 BAPYR + C3H3 => BAPYRJS + pC3H4 1.18E3 3.16 22197 A2- + C4H4 => A2 + I-C4H3 2.91 3.579 5300 A2 + I-C4H3 => A2- + C4H4 4.25 3.468 21160 A2- + C4H4 => A2 + N-C4H3 0.9 3.77 8490 A2 + N-C4H3 => A2- + C4H4 3.71 3.468 9580 A2* + C4H4 => A2 + I-C4H3 4.97 3.525 5240 A2 + I-C4H3 => A2* + C4H4 3.34 3.512 20920 A2* + C4H4 => A2 + N-C4H3 2.73 3.615 8780 A2 + N-C4H3 => A2* + C4H4 12.3 3.576 9040 END