C H N O Ar He Ne AR HE H2 H O2 O H2O OH H2O2 HO2 CO CO2 CH4 CH3 CH2 CH CH3O2 CH3OH CH3O CH2OH CH2O HCO C2H5 C2H4 C2H3 C2H2 CH3CO CH2CO HCCO IC3H7 C3H6 C3H5-A C4H8-1 NC7H16 NC7H15 NC7H14 NC7H15OO NC7H14OOH OONC7H14OOH NC7KET NC5H11CO IC8H18 C8H17 C8H16 C8H17O2 C8H16OOH C8H16OOH-O2 IC8KET C6H5CH3 C6H5CH2 C6H5CHO C6H5 C6H6 C6H5CO C6H5O C5H5 C4H5-N C2H5OH SC2H4OH CH3CHO C3H4 C3H3 C3H5 C3H8 I-C3H7 N-C3H7 C3H6OOH OC3H5OOH CH2CHO C2H6 N2 300.0 101325.0 Ar:1 G5/97 2.500000000E+00, 0.000000000E+00, 0.000000000E+00, 0.000000000E+00, 0.000000000E+00, -7.453750000E+02, 4.379674910E+00 2.500000000E+00, 0.000000000E+00, 0.000000000E+00, 0.000000000E+00, 0.000000000E+00, -7.453750000E+02, 4.379674910E+00 atom 136.500 3.330 0.000 0.000 0.000 0.000 0.000 He:1 G5/97 2.500000000E+00, 0.000000000E+00, 0.000000000E+00, 0.000000000E+00, 0.000000000E+00, -7.453750000E+02, 9.287239740E-01 2.500000000E+00, 0.000000000E+00, 0.000000000E+00, 0.000000000E+00, 0.000000000E+00, -7.453750000E+02, 9.287239740E-01 atom 10.200 2.576 0.000 0.000 0.000 0.000 0.000 H:2 TPIS78 2.344331120E+00, 7.980520750E-03, -1.947815100E-05, 2.015720940E-08, -7.376117610E-12, -9.179351730E+02, 6.830102380E-01 2.932865750E+00, 8.266080260E-04, -1.464023640E-07, 1.541004140E-11, -6.888048000E-16, -8.130655810E+02, -1.024328650E+00 linear 38.000 2.920 0.000 0.790 280.000 0.000 0.000 H:1 L6/94 2.500000000E+00, 0.000000000E+00, 0.000000000E+00, 0.000000000E+00, 0.000000000E+00, 2.547366000E+04, -4.466828500E-01 2.500000000E+00, 0.000000000E+00, 0.000000000E+00, 0.000000000E+00, 0.000000000E+00, 2.547366000E+04, -4.466828500E-01 atom 145.000 2.050 0.000 0.000 0.000 0.000 0.000 O:2 RUS89 3.782456360E+00, -2.996734160E-03, 9.847302010E-06, -9.681295090E-09, 3.243728370E-12, -1.063943560E+03, 3.657675730E+00 3.660960650E+00, 6.563658110E-04, -1.411496270E-07, 2.057979350E-11, -1.299134360E-15, -1.215977180E+03, 3.415362790E+00 linear 107.400 3.458 0.000 1.600 3.800 0.000 0.000 O:1 L1/90 3.168267100E+00, -3.279318840E-03, 6.643063960E-06, -6.128066240E-09, 2.112659710E-12, 2.912225920E+04, 2.051933460E+00 2.543636970E+00, -2.731624860E-05, -4.190295200E-09, 4.954818450E-12, -4.795536940E-16, 2.922601200E+04, 4.922294570E+00 atom 80.000 2.750 0.000 0.000 0.000 0.000 0.000 H:2 O:1 L5/89 4.198635200E+00, -2.036401700E-03, 6.520341600E-06, -5.487926900E-09, 1.771968000E-12, -3.029372600E+04, -8.490090100E-01 2.677038900E+00, 2.973181600E-03, -7.737688900E-07, 9.443351400E-11, -4.268999100E-15, -2.988589400E+04, 6.882550000E+00 nonlinear 572.400 2.605 1.844 0.000 4.000 0.000 0.000 H:1 O:1 IU3/03 3.991984240E+00, -2.401066550E-03, 4.616640330E-06, -3.879163060E-09, 1.363195020E-12, 3.368898360E+03, -1.039984770E-01 2.838530330E+00, 1.107412890E-03, -2.940002090E-07, 4.206987290E-11, -2.422898900E-15, 3.697808080E+03, 5.844946520E+00 linear 80.000 2.750 0.000 0.000 0.000 0.000 0.000 H:2 O:2 T8/03 4.315151490E+00, -8.473906220E-04, 1.764043230E-05, -2.267629440E-08, 9.089501580E-12, -1.770674370E+04, 3.273733190E+00 4.579773050E+00, 4.053260030E-03, -1.298447300E-06, 1.982114000E-10, -1.139687920E-14, -1.800717750E+04, 6.649706940E-01 nonlinear 107.400 3.458 0.000 0.000 3.800 0.000 0.000 H:1 O:2 T1/09 4.301798070E+00, -4.749120970E-03, 2.115829050E-05, -2.427639140E-08, 9.292252250E-12, 2.640184850E+02, 3.716662200E+00 4.172287410E+00, 1.881176270E-03, -3.462772860E-07, 1.946575490E-11, 1.762569050E-16, 3.102068390E+01, 2.957676720E+00 nonlinear 107.400 3.458 0.000 0.000 1.000 0.000 0.000 C:1 O:1 RUS79 3.579533500E+00, -6.103536900E-04, 1.016814300E-06, 9.070058600E-10, -9.044244900E-13, -1.434408600E+04, 3.508409300E+00 3.048485900E+00, 1.351728100E-03, -4.857940500E-07, 7.885364400E-11, -4.698074600E-15, -1.426611700E+04, 6.017097700E+00 linear 98.100 3.650 0.000 1.950 1.800 0.000 0.000 C:1 O:2 L7/88 2.356813000E+00, 8.984129900E-03, -7.122063200E-06, 2.457300800E-09, -1.428854800E-13, -4.837197100E+04, 9.900903500E+00 4.636511100E+00, 2.741456900E-03, -9.958975900E-07, 1.603866600E-10, -9.161985700E-15, -4.902490400E+04, -1.934895500E+00 linear 244.000 3.763 0.000 2.650 2.100 0.000 0.000 C:1 H:4 G8/99 5.149114680E+00, -1.366220090E-02, 4.914539210E-05, -4.842467670E-08, 1.666034410E-11, -1.024659830E+04, -4.638488420E+00 1.653262260E+00, 1.002630990E-02, -3.316612380E-06, 5.364831380E-10, -3.146967580E-14, -1.000959360E+04, 9.905062830E+00 nonlinear 141.400 3.746 0.000 2.600 13.000 0.000 0.000 C:1 H:3 IU0702 3.657179700E+00, 2.126597900E-03, 5.458388300E-06, -6.618100300E-09, 2.465707400E-12, 1.642271600E+04, 1.673535400E+00 2.978120600E+00, 5.797852000E-03, -1.975580000E-06, 3.072979000E-10, -1.791741600E-14, 1.650951300E+04, 4.722479900E+00 linear 144.000 3.800 0.000 0.000 0.000 0.000 0.000 C:1 H:2 IU3/03 3.717578460E+00, 1.273912600E-03, 2.173472510E-06, -3.488585000E-09, 1.652088660E-12, 4.587238660E+04, 1.752979450E+00 3.146318860E+00, 3.036712590E-03, -9.964744390E-07, 1.504835800E-10, -8.573355150E-15, 4.604126050E+04, 4.723417110E+00 linear 144.000 3.800 0.000 0.000 0.000 0.000 0.000 C:1 H:1 IU3/03 3.489758300E+00, 3.243216000E-04, -1.689975100E-06, 3.162842000E-09, -1.406180300E-12, 7.061264600E+04, 2.084284100E+00 2.520936900E+00, 1.765363900E-03, -4.614766000E-07, 5.928967500E-11, -3.347450100E-15, 7.094676900E+04, 7.405182900E+00 linear 80.000 2.750 0.000 0.000 0.000 0.000 0.000 C:1 H:3 O:2 1.973392050E+00, 1.535423400E-02, -6.373148910E-06, 3.199305650E-10, 2.821939150E-13, 2.542788350E+02, 1.691942150E+01 6.479704870E+00, 7.444010800E-03, -2.523485550E-06, 3.895772960E-10, -2.251823990E-14, -1.562854410E+03, -8.194770740E+00 nonlinear 481.800 3.626 0.000 0.000 1.000 0.000 0.000 C:1 H:4 O:1 T06/02 5.658510510E+00, -1.629834190E-02, 6.919381560E-05, -7.583729260E-08, 2.804275500E-11, -2.561197360E+04, -8.973305080E-01 3.527267950E+00, 1.031787830E-02, -3.628929440E-06, 5.774480160E-10, -3.421826320E-14, -2.600288340E+04, 5.167586930E+00 nonlinear 481.800 3.626 0.000 0.000 1.000 0.000 0.000 C:1 H:3 O:1 IU1/03 3.711805020E+00, -2.804633060E-03, 3.765509710E-05, -4.730720890E-08, 1.865884200E-11, 1.295697600E+03, 6.572408640E+00 4.757792380E+00, 7.441424740E-03, -2.697051760E-06, 4.380905040E-10, -2.635370980E-14, 3.781119400E+02, -1.966800280E+00 nonlinear 417.000 3.690 1.700 0.000 2.000 0.000 0.000 C:1 H:3 O:1 IU2/03 4.478343670E+00, -1.350703100E-03, 2.784849800E-05, -3.648690600E-08, 1.479074500E-11, -3.500728900E+03, 3.309135000E+00 5.093143700E+00, 5.947612600E-03, -2.064974600E-06, 3.230081730E-10, -1.881259020E-14, -4.034096400E+03, -1.846914930E+00 nonlinear 417.000 3.690 1.700 0.000 2.000 0.000 0.000 C:1 H:2 O:1 T5/11 4.793723120E+00, -9.908333220E-03, 3.732199900E-05, -3.792852370E-08, 1.317726410E-11, -1.437919530E+04, 6.027980580E-01 3.169526650E+00, 6.193205600E-03, -2.250563660E-06, 3.659756600E-10, -2.201494580E-14, -1.454868310E+04, 6.042078980E+00 nonlinear 498.000 3.590 0.000 0.000 2.000 0.000 0.000 C:1 H:1 O:1 T5/03 4.237546100E+00, -3.320752570E-03, 1.400302640E-05, -1.342399950E-08, 4.374162080E-12, 3.872411850E+03, 3.308348690E+00 3.920015420E+00, 2.522793240E-03, -6.710041640E-07, 1.056159480E-10, -7.437982610E-15, 3.653429280E+03, 3.580770560E+00 nonlinear 498.000 3.590 0.000 0.000 0.000 0.000 0.000 C:2 H:5 8/4/4THERM 1.327302170E+00, 1.766567530E-02, -6.149265580E-06, -3.011434660E-10, 4.386177750E-13, 1.342840280E+04, 1.717892160E+01 5.887843900E+00, 1.030767930E-02, -3.468443960E-06, 5.324992570E-10, -3.065126510E-14, 1.150654990E+04, -8.496517710E+00 nonlinear 247.500 4.350 0.000 0.000 1.500 0.000 0.000 C:2 H:4 8/12/15 4.811182230E-01, 1.837780600E-02, -9.996335650E-06, 2.732110390E-09, -3.018372890E-13, 5.443866480E+03, 1.858671570E+01 5.070612890E+00, 9.111407680E-03, -3.105066920E-06, 4.807338510E-10, -2.783213960E-14, 3.663912170E+03, -6.645014140E+00 nonlinear 238.400 3.496 0.000 0.000 1.500 0.000 0.000 C:2 H:3 8/12/15 1.255450940E+00, 1.574815970E-02, -1.122183280E-05, 4.509156820E-09, -7.748615770E-13, 3.474355740E+04, 1.696640430E+01 4.996754150E+00, 6.558382710E-03, -2.209219090E-06, 3.393002720E-10, -1.953169260E-14, 3.346043820E+04, -3.014510970E+00 nonlinear 265.300 3.721 0.000 0.000 1.000 0.000 0.000 C:2 H:2 G1/91 8.086796820E-01, 2.336157620E-02, -3.551722340E-05, 2.801529580E-08, -8.500751650E-12, 2.642898080E+04, 1.393967610E+01 4.658784890E+00, 4.883966670E-03, -1.608288880E-06, 2.469745440E-10, -1.386059590E-14, 2.575940420E+04, -3.998381940E+00 linear 265.300 3.721 0.000 0.000 2.500 0.000 0.000 C:2 H:3 O:1 IU2/03 4.035870500E+00, 8.772948700E-04, 3.071001000E-05, -3.924756500E-08, 1.529686900E-11, -2.682073800E+03, 7.861768200E+00 5.313716500E+00, 9.173779300E-03, -3.322038600E-06, 5.394745600E-10, -3.245236800E-14, -3.645041400E+03, -1.675755800E+00 nonlinear 436.000 3.970 0.000 0.000 2.000 0.000 0.000 C:2 H:2 O:1 1.814225110E+00, 1.990085900E-02, -2.214160080E-05, 1.450285210E-08, -3.988770680E-12, -7.053949260E+03, 1.360793590E+01 5.358693670E+00, 6.956415860E-03, -2.648026370E-06, 4.650675920E-10, -3.086418200E-14, -7.902940130E+03, -3.985257310E+00 nonlinear 436.000 3.970 0.000 0.000 2.000 0.000 0.000 C:2 H:1 O:1 T4/09 1.876079690E+00, 2.212054180E-02, -3.588693250E-05, 3.054025410E-08, -1.012810690E-11, 2.016338400E+04, 1.369682900E+01 5.914793330E+00, 3.714087300E-03, -1.301370100E-06, 2.064733450E-10, -1.214767590E-14, 1.935963010E+04, -5.505672690E+00 nonlinear 150.000 2.500 0.000 0.000 1.000 0.000 0.000 C:3 H:7 8/12/15 -8.974671370E-01, 4.157440220E-02, -4.947783490E-05, 4.564936550E-08, -1.790854370E-11, 9.939504070E+03, 2.926417580E+01 6.707755490E+00, 1.740480760E-02, -6.076159260E-06, 9.600843510E-10, -5.656564900E-14, 7.553778210E+03, -1.036865160E+01 nonlinear 303.400 4.810 0.000 0.000 1.000 0.000 0.000 C:3 H:6 8/12/15 -1.546067370E+00, 4.365531280E-02, -5.613924170E-05, 4.984219270E-08, -1.847989230E-11, 2.070562330E+03, 2.992324950E+01 6.590323040E+00, 1.525928660E-02, -5.303694410E-06, 8.355108880E-10, -4.912155490E-14, -2.474811130E+02, -1.157482380E+01 nonlinear 307.800 4.140 0.000 0.000 1.000 0.000 0.000 C:3 H:5 8/12/15 -3.328994420E+00, 5.384234690E-02, -7.655007520E-05, 6.355122850E-08, -2.142830030E-11, 2.034206280E+04, 3.680383620E+01 7.376040970E+00, 1.234497820E-02, -4.264638820E-06, 6.690458350E-10, -3.922025540E-14, 1.773329600E+04, -1.617582040E+01 nonlinear 316.000 4.220 0.000 0.000 1.000 0.000 0.000 C:4 H:8 1.625995560E-01, 4.010527460E-02, -2.180385920E-05, 5.470707270E-09, -4.540733150E-13, -1.654026010E+03, 2.481692580E+01 1.101892950E+01, 1.827141770E-02, -6.218019070E-06, 9.620386110E-10, -5.567913410E-14, -5.809988180E+03, -3.479422870E+01 nonlinear 355.000 4.650 0.000 0.000 1.000 0.000 0.000 C:7 H:16 -9.084073230E-01, 8.527535300E-02, -5.256686710E-05, 1.629542500E-08, -2.010501300E-12, -2.574348080E+04, 3.382956110E+01 2.250123140E+01, 3.461224470E-02, -1.180439820E-05, 1.828945000E-09, -1.059556780E-13, -3.430622390E+04, -9.337118180E+01 nonlinear 459.600 6.253 0.000 0.000 1.000 0.000 0.000 C:7 H:15 3.970359780E-01, 7.415113740E-02, -3.832357780E-05, 7.740768420E-09, -1.218467050E-13, -2.612706610E+03, 3.198055160E+01 2.141742240E+01, 3.283920730E-02, -1.116281880E-05, 1.725851550E-09, -9.983901420E-14, -1.064554670E+04, -8.359624650E+01 nonlinear 437.300 6.168 0.000 0.000 1.000 0.000 0.000 C:7 H:14 7/19/0THERM -1.165332790E+00, 7.904398060E-02, -4.961016660E-05, 1.585690090E-08, -2.053464330E-12, -1.173623590E+04, 3.598710700E+01 2.061920470E+01, 3.148529910E-02, -1.071620570E-05, 1.658276620E-09, -9.599117850E-14, -1.967131620E+04, -8.225193870E+01 nonlinear 457.800 6.173 0.300 0.000 1.000 0.000 0.000 C:7 H:15 O:2 1.201982600E+00, 9.338363460E-02, -6.508458520E-05, 2.351525890E-08, -3.475955470E-12, -2.133158510E+04, 2.851954390E+01 2.726448430E+01, 3.269456560E-02, -1.114501700E-05, 1.726329150E-09, -9.999595300E-14, -3.038578090E+04, -1.114918920E+02 nonlinear 561.000 6.317 1.700 0.000 1.000 0.000 0.000 C:7 H:15 O:2 1.283569070E+00, 9.449556670E-02, -6.719109820E-05, 2.468305520E-08, -3.696446050E-12, -1.342214070E+04, 2.983007130E+01 2.797889380E+01, 3.173409510E-02, -1.083005530E-05, 1.678920630E-09, -9.730814040E-14, -2.261915500E+04, -1.133401930E+02 nonlinear 561.000 6.317 1.700 0.000 1.000 0.000 0.000 C:7 H:15 O:4 2.320430860E+00, 1.020803590E-01, -6.806658860E-05, 2.173538940E-08, -2.611499600E-12, -3.138801600E+04, 2.902632180E+01 3.394610150E+01, 3.203481430E-02, -1.109362680E-05, 1.737151550E-09, -1.014042530E-13, -4.262427230E+04, -1.419659540E+02 nonlinear 677.149 6.436 0.000 0.000 0.000 0.000 0.000 C:7 H:14 O:3 -4.648856800E-01, 1.033571790E-01, -7.611398230E-05, 2.787515650E-08, -4.037306930E-12, -4.996585960E+04, 3.949186040E+01 3.136549460E+01, 2.838253700E-02, -9.597636550E-06, 1.480802430E-09, -8.560699680E-14, -6.079507430E+04, -1.309693870E+02 nonlinear 581.300 6.506 2.000 0.000 1.000 0.000 0.000 C:6 H:11 O:1 2.038996940E+00, 5.978344970E-02, -3.084872560E-05, 5.756992350E-09, 8.354772710E-14, -1.450876420E+04, 2.303580580E+01 2.007125330E+01, 2.471090290E-02, -8.469378820E-06, 1.316981540E-09, -7.650122140E-14, -2.141615470E+04, -7.620933480E+01 nonlinear 498.600 6.009 2.000 0.000 1.000 0.000 0.000 C:8 H:18 4/9/16 -2.320103000E+00, 9.944218270E-02, -5.506466250E-05, 1.245242690E-08, -5.630668000E-13, -3.000983870E+04, 3.700600080E+01 2.898367670E+01, 3.735591230E-02, -1.298977150E-05, 2.039739910E-09, -1.192999760E-13, -4.195230720E+04, -1.349805370E+02 nonlinear 458.500 6.414 0.000 0.000 1.000 0.000 0.000 C:8 H:17 4/17/16THERM -1.981001910E+00, 9.608145880E-02, -5.409791090E-05, 1.266000480E-08, -6.775743730E-13, -5.687626860E+03, 3.879935470E+01 2.843563080E+01, 3.526917270E-02, -1.226931070E-05, 1.927235700E-09, -1.127480130E-13, -1.723412990E+04, -1.281261980E+02 nonlinear 458.500 6.414 0.000 0.000 1.000 0.000 0.000 C:8 H:16 4/24/16THERM -2.769186910E+00, 9.939907010E-02, -6.839067340E-05, 2.383960650E-08, -3.316396510E-12, -1.642571060E+04, 3.889703530E+01 2.567050290E+01, 3.368559560E-02, -1.132664910E-05, 1.739071700E-09, -1.001394650E-13, -2.627084230E+04, -1.139247010E+02 nonlinear 485.600 6.440 0.300 0.000 1.000 0.000 0.000 C:8 H:17 O:2 4/11/16 -2.176573270E-01, 1.041715530E-01, -6.119386870E-05, 1.560063040E-08, -1.168395820E-12, -2.422595050E+04, 3.404403510E+01 3.340982920E+01, 3.594203580E-02, -1.264563800E-05, 2.001016900E-09, -1.176532240E-13, -3.691436820E+04, -1.501872730E+02 nonlinear 581.300 6.506 2.000 0.000 1.000 0.000 0.000 C:8 H:17 O:2 16THERM -8.483796680E-01, 1.077440520E-01, -6.714595440E-05, 1.929966080E-08, -1.956342860E-12, -1.656170810E+04, 3.940280410E+01 3.341131200E+01, 3.564134070E-02, -1.247533510E-05, 1.967475080E-09, -1.154178760E-13, -2.920455540E+04, -1.473305940E+02 nonlinear 581.300 6.506 2.000 0.000 1.000 0.000 0.000 C:8 H:17 O:4 16THERM 9.745249530E-01, 1.154498030E-01, -7.352829350E-05, 2.168126460E-08, -2.301175460E-12, -3.435106880E+04, 3.439565980E+01 3.848212940E+01, 3.609724990E-02, -1.274917450E-05, 2.022549800E-09, -1.191295550E-13, -4.815595710E+04, -1.699025510E+02 nonlinear 581.300 6.506 2.000 0.000 1.000 0.000 0.000 C:8 H:16 O:3 4/23/16THERM -1.586744510E-01, 1.118938280E-01, -8.313046020E-05, 3.245339050E-08, -5.220318420E-12, -5.164126020E+04, 3.719692820E+01 3.110218570E+01, 3.645901700E-02, -1.249431760E-05, 1.942237670E-09, -1.127820390E-13, -6.227987800E+04, -1.298762850E+02 nonlinear 581.300 6.506 2.000 0.000 1.000 0.000 0.000 C:7 H:8 l6/87 -2.433953380E+00, 5.526653860E-02, -1.430125150E-05, -1.342114030E-08, 6.316476380E-12, 4.433347510E+03, 3.664319880E+01 1.294003400E+01, 2.669128700E-02, -9.683850500E-06, 1.573862900E-09, -9.466360100E-14, -6.586705530E+02, -4.668554200E+01 nonlinear 495.300 5.680 0.375 12.300 1.000 0.000 0.000 C:7 H:7 iu3/03 -5.828267860E+00, 8.661265520E-02, -9.210762880E-05, 6.010752770E-08, -1.820427790E-11, 2.360908460E+04, 4.925941760E+01 1.472305200E+01, 2.303424400E-02, -8.484735900E-06, 1.391696200E-09, -8.424796700E-14, 1.802762460E+04, -5.589516950E+01 nonlinear 495.300 5.680 0.375 12.300 1.000 0.000 0.000 C:7 H:6 O:1 5/16/90THERM -2.603533450E+00, 6.455218100E-02, -4.652254810E-05, 1.750209230E-08, -2.859025170E-12, -6.093499660E+03, 3.951978740E+01 1.740248930E+01, 1.895083170E-02, -6.586943070E-06, 1.034130460E-09, -6.047931550E-14, -1.313479230E+04, -6.832842240E+01 nonlinear 622.400 5.530 3.000 12.300 1.000 0.000 0.000 C:6 H:5 T04/02 -3.070540640E+00, 4.823581780E-02, -2.226153840E-05, -4.121532840E-09, 4.053262970E-12, 3.983604560E+04, 3.853904460E+01 1.084447620E+01, 1.732124730E-02, -6.292332490E-06, 1.023699610E-09, -6.162168280E-14, 3.559191420E+04, -3.533887510E+01 nonlinear 412.300 5.349 0.300 10.320 1.000 0.000 0.000 C:6 H:6 G6/01 -3.095521550E+00, 4.896675720E-02, -1.531209460E-05, -1.123685220E-08, 6.104484050E-12, 8.869812570E+03, 3.617939470E+01 1.108095760E+01, 2.071767460E-02, -7.521459910E-06, 1.223209840E-09, -7.360912790E-14, 4.341599660E+03, -4.000331930E+01 nonlinear 412.300 5.349 0.000 10.320 1.000 0.000 0.000 C:7 H:5 O:1 -1.997603080E+00, 6.735022330E-02, -5.836268020E-05, 2.663873030E-08, -5.068050170E-12, 1.024168000E+04, 3.486786200E+01 1.795874710E+01, 1.582184950E-02, -5.481548540E-06, 8.587093390E-10, -5.014352990E-14, 3.793618590E+03, -7.062333640E+01 nonlinear 622.400 5.530 2.000 12.300 1.000 0.000 0.000 C:6 H:5 O:1 T05/02 -3.203615010E+00, 6.450731240E-02, -5.453870620E-05, 2.399008720E-08, -4.946492430E-12, 5.019858860E+03, 3.875263940E+01 1.372217200E+01, 1.746887710E-02, -6.355045200E-06, 1.034923080E-09, -6.234105040E-14, 3.140299180E+02, -4.878926680E+01 nonlinear 450.000 5.500 0.700 10.320 1.000 0.000 0.000 C:5 H:5 TAK0505 -3.975553770E+00, 7.413709310E-02, -1.118033280E-04, 9.046285940E-08, -2.809996780E-11, 3.017694040E+04, 3.671536050E+01 1.336757150E+00, 3.247939120E-02, -1.675877740E-05, 4.035141370E-09, -3.707390360E-13, 3.007305250E+04, 1.603158060E+01 nonlinear 408.000 5.200 0.419 8.000 1.000 0.000 0.000 C:4 H:5 H6W/94 -6.575907030E-01, 4.653798680E-02, -5.285747430E-05, 3.696273580E-08, -1.131200660E-11, 4.150411900E+04, 2.687533590E+01 9.850197800E+00, 1.077900800E-02, -1.367212500E-06, -7.720053500E-10, 1.836631400E-13, 3.884695060E+04, -2.599171810E+01 nonlinear 329.000 5.100 0.000 0.000 1.000 0.000 0.000 C:2 H:6 O:1 l8/88 4.858695700E+00, -3.740172600E-03, 6.955537800E-05, -8.865479600E-08, 3.516883500E-11, -2.999613200E+04, 4.801854500E+00 6.562436500E+00, 1.520422200E-02, -5.389679500E-06, 8.622501100E-10, -5.128978700E-14, -3.152562100E+04, -9.473020200E+00 nonlinear 470.600 4.410 0.000 0.000 1.500 0.000 0.000 C:2 H:5 O:1 t10/04 4.222832500E+00, 5.121747980E-03, 3.483865220E-05, -4.919436370E-08, 2.011837230E-11, -8.205039390E+03, 8.016757000E+00 6.358423020E+00, 1.243562760E-02, -4.330968390E-06, 6.845303810E-10, -4.037132380E-14, -9.379004320E+03, -6.051061120E+00 nonlinear 470.600 4.410 0.000 0.000 1.500 0.000 0.000 C:2 H:4 O:1 L8/88 4.729459500E+00, -3.193285800E-03, 4.753492100E-05, -5.745861100E-08, 2.193111200E-11, -2.157287800E+04, 4.103015900E+00 5.404110800E+00, 1.172305900E-02, -4.226313700E-06, 6.837245100E-10, -4.098486300E-14, -2.259312200E+04, -3.480791700E+00 nonlinear 436.000 3.970 0.000 0.000 2.000 0.000 0.000 C:3 H:4 000000 2.613044500E+00, 1.212257500E-02, 1.853988000E-05, -3.452514900E-08, 1.533507900E-11, 2.154156700E+04, 1.022613900E+01 6.316872200E+00, 1.113372800E-02, -3.962937800E-06, 6.356423800E-10, -3.787554000E-14, 2.011749500E+04, -1.099576600E+01 linear 324.800 4.290 0.000 0.000 1.000 0.000 0.000 C:3 H:3 T7/11 1.351108730E+00, 3.274112910E-02, -4.738274070E-05, 3.763102200E-08, -1.185411280E-11, 4.076799410E+04, 1.520585980E+01 7.142217190E+00, 7.619022110E-03, -2.674600300E-06, 4.249149040E-10, -2.514754430E-14, 3.957095940E+04, -1.258486900E+01 linear 324.800 4.290 0.000 0.000 1.000 0.000 0.000 C:3 H:5 PD5/98 1.363183500E+00, 1.981382100E-02, 1.249706000E-05, -3.335555500E-08, 1.584657100E-11, 1.924562900E+04, 1.717321400E+01 6.500787700E+00, 1.432473100E-02, -5.678163200E-06, 1.108080100E-09, -9.036388700E-14, 1.748244900E+04, -1.124305000E+01 nonlinear 316.000 4.220 0.000 0.000 1.000 0.000 0.000 C:3 H:8 8/12/15 2.408784700E-01, 3.395485990E-02, -1.609308740E-05, 2.834806280E-09, 2.781951720E-14, -1.403628530E+04, 2.165008000E+01 9.155413100E+00, 1.725741390E-02, -5.856148680E-06, 9.041901550E-10, -5.225237720E-14, -1.757624390E+04, -2.774185100E+01 nonlinear 303.400 4.810 0.000 0.000 1.000 0.000 0.000 C:3 H:7 000000 1.444919900E+00, 2.099911200E-02, 7.703622200E-06, -1.847625300E-08, 7.128296200E-12, 9.422372400E+03, 2.011631700E+01 6.519274100E+00, 1.722010400E-02, -5.736421700E-06, 8.413073200E-10, -4.456591300E-14, 7.322719300E+03, -9.083021500E+00 nonlinear 303.400 4.810 0.000 0.000 1.000 0.000 0.000 C:3 H:7 000000 1.049117300E+00, 2.600897300E-02, 2.354251600E-06, -1.959513200E-08, 9.372020700E-12, 1.031234600E+04, 2.113603400E+01 7.709747900E+00, 1.603148500E-02, -5.272023800E-06, 7.588835200E-10, -3.886271900E-14, 7.976223600E+03, -1.551529700E+01 nonlinear 303.400 4.810 0.000 0.000 1.000 0.000 0.000 C:3 H:7 O:2 000000 1.910050110E+00, 4.116668330E-02, -2.516302170E-05, 7.118568730E-09, -6.988387320E-13, -1.793050930E+03, 2.345144570E+01 1.461399800E+01, 1.437230150E-02, -4.886351440E-06, 7.565196200E-10, -4.383649920E-14, -6.461014570E+03, -4.574782450E+01 nonlinear 487.900 4.820 0.000 0.000 1.000 0.000 0.000 C:3 H:6 O:3 000000 7.689330340E-01, 5.469058800E-02, -4.650724050E-05, 2.031595850E-08, -3.583989990E-12, -3.632388610E+04, 2.682916370E+01 1.702852710E+01, 1.307167840E-02, -4.593108560E-06, 7.261351560E-10, -4.266583370E-14, -4.163342170E+04, -5.925135770E+01 nonlinear 487.900 4.820 0.000 0.000 1.000 0.000 0.000 C:2 H:3 O:1 T03/10 2.795026000E+00, 1.010994720E-02, 1.617506450E-05, -3.103031450E-08, 1.394361390E-11, 1.629449750E+02, 1.236466570E+01 6.539283380E+00, 7.802386290E-03, -2.764136120E-06, 4.420989060E-10, -2.629542900E-14, -1.188586590E+03, -8.720913930E+00 nonlinear 436.000 3.970 0.000 0.000 2.000 0.000 0.000 C:2 H:6 G8/88 4.291425720E+00, -5.501549010E-03, 5.994384580E-05, -7.084664690E-08, 2.686858360E-11, -1.152220560E+04, 2.666789940E+00 4.046664110E+00, 1.535388020E-02, -5.470394850E-06, 8.778265440E-10, -5.231675310E-14, -1.244734990E+04, -9.686983130E-01 nonlinear 247.500 4.350 0.000 0.000 1.500 0.000 0.000 N:2 G8/02 3.531005280E+00, -1.236609880E-04, -5.029994330E-07, 2.435306120E-09, -1.408812350E-12, -1.046976280E+03, 2.967470380E+00 2.952576370E+00, 1.396900400E-03, -4.926316030E-07, 7.860101950E-11, -4.607552040E-15, -9.239486880E+02, 5.871887620E+00 linear 97.530 3.621 0.000 1.760 4.000 0.000 0.000 C3H4 + O [=] C2H4 + CO 2.000000E+04 1.8 1000.000000 C3H4:1.0 O:1 C2H4:1.0 CO:1 CH3 + C2H2 [=] C3H4 + H 2.560000E+06 1.1 13643.880000 CH3:1.0 C2H2:1 C3H4:1.0 H:1 C3H4 + O [=] HCCO + CH3 7.300000E+09 0.0 2250.000000 C3H4:1.0 O:1 HCCO:1.0 CH3:1 C3H3 + H (+ M) [=] C3H4 (+ M) 3.000000E+10 0.0 0.000000 9.000000E+09 1.0 0.000000 0.5 1e+30 1e-30 C3H3:1.0 H:1 C3H4:1.0 C3H3 + HO2 [=] C3H4 + O2 2.500000E+09 0.0 0.000000 C3H3:1.0 HO2:1 C3H4:1.0 O2:1 C3H4 + OH [=] C3H3 + H2O 5.300000E+03 2.0 2000.000000 C3H4:1.0 OH:1 C3H3:1.0 H2O:1 C3H3 + O2 [=] CH2CO + HCO 3.000000E+07 0.0 2868.070000 C3H3:1.0 O2:1 CH2CO:1.0 HCO:1 C3H4 + H (+ M) [=] C3H5 (+ M) 4.000000E+10 0.0 0.000000 3.000000E+18 -2.0 0.000000 0.8 1e+30 1e-30 C3H4:1.0 H:1 C3H5:1.0 C3H5 + H [=] C3H4 + H2 1.800000E+10 0.0 0.000000 C3H5:1.0 H:1 C3H4:1.0 H2:1 C3H5 + O2 [=] C3H4 + HO2 4.990000E+12 -1.4 22428.060000 C3H5:1.0 O2:1 C3H4:1.0 HO2:1 C3H5 + CH3 [=] C3H4 + CH4 3.000000E+09 -0.32 -130.980000 C3H5:1.0 CH3:1 C3H4:1.0 CH4:1 C2H2 + CH3 (+ M) [=] C3H5 (+ M) 6.000000E+05 0.0 0.000000 2.000000E+03 1.0 0.000000 0.5 1e+30 1e-30 C2H2:1.0 CH3:1 C3H5:1.0 C3H5 + OH [=] C3H4 + H2O 6.000000E+09 0.0 0.000000 C3H5:1.0 OH:1 C3H4:1.0 H2O:1 C3H3 + HCO [=] C3H4 + CO 2.500000E+10 0.0 0.000000 C3H3:1.0 HCO:1 C3H4:1.0 CO:1 C3H3 + HO2 [=] OH + CO + C2H3 8.000000E+08 0.0 0.000000 C3H3:1.0 HO2:1 OH:1.0 CO:1 C2H3:1 C3H4 + O2 [=] CH3 + HCO + CO 4.000000E+11 0.0 41826.000000 C3H4:1.0 O2:1 CH3:1.0 HCO:1 CO:1 C3H6 + O [=] C2H5 + HCO 3.500000E+04 1.65 -972.750000 C3H6:1.0 O:1 C2H5:1.0 HCO:1 C3H6 + OH [=] C3H5 + H2O 3.100000E+03 2.0 -298.280000 C3H6:1.0 OH:1 C3H5:1.0 H2O:1 C3H6 + O [=] CH2CO + CH3 + H 1.200000E+05 1.65 327.440000 C3H6:1.0 O:1 CH2CO:1.0 CH3:1 H:1 C3H6 + H [=] C3H5 + H2 1.700000E+02 2.5 2492.830000 C3H6:1.0 H:1 C3H5:1.0 H2:1 C3H5 + H (+ M) [=] C3H6 (+ M) 2.000000E+11 0.0 0.000000 1.330000E+54 -12.0 5967.970000 AR:0.7 C2H6:3.0 CH4:2.0 CO:1.5 CO2:2.0 H2:2.0 H2O:6.0 0.02 1097 1097 6860 C3H5:1.0 H:1 C3H6:1.0 C3H5 + HO2 [=] C3H6 + O2 2.660000E+09 0.0 0.000000 C3H5:1.0 HO2:1 C3H6:1.0 O2:1 C3H5 + HO2 [=] OH + C2H3 + CH2O 3.000000E+09 0.0 0.000000 C3H5:1.0 HO2:1 OH:1.0 C2H3:1 CH2O:1 C2H3 + CH3 (+ M) [=] C3H6 (+ M) 2.500000E+10 0.0 0.000000 4.270000E+52 -11.94 9770.550000 AR:0.7 C2H6:3.0 CH4:2.0 CO:1.5 CO2:2.0 H2:2.0 H2O:6.0 0.175 1341 60000 10140 C2H3:1.0 CH3:1 C3H6:1.0 C3H6 + H [=] C2H4 + CH3 1.600000E+19 -2.39 11185.470000 C3H6:1.0 H:1 C2H4:1.0 CH3:1 CH3 + C2H3 [=] C3H5 + H 1.500000E+21 -2.83 18618.550000 CH3:1.0 C2H3:1 C3H5:1.0 H:1 C3H8 (+ M) [=] CH3 + C2H5 (+ M) 1.100000E+17 0.0 84392.930000 7.830000E+15 0.0 64978.010000 0.76 1900 38 C3H8:1.0 CH3:1.0 C2H5:1 C3H8 + O2 [=] I-C3H7 + HO2 4.000000E+10 0.0 47500.000000 C3H8:1.0 O2:1 I-C3H7:1.0 HO2:1 C3H8 + O2 [=] N-C3H7 + HO2 4.000000E+10 0.0 50932.120000 C3H8:1.0 O2:1 N-C3H7:1.0 HO2:1 C3H8 + H [=] I-C3H7 + H2 1.300000E+03 2.4 4471.080000 C3H8:1.0 H:1 I-C3H7:1.0 H2:1 C3H8 + H [=] N-C3H7 + H2 1.330000E+03 2.54 6761.470000 C3H8:1.0 H:1 N-C3H7:1.0 H2:1 C3H8 + O [=] I-C3H7 + OH 4.760000E+01 2.71 2107.310000 C3H8:1.0 O:1 I-C3H7:1.0 OH:1 C3H8 + O [=] N-C3H7 + OH 1.900000E+02 2.68 3718.450000 C3H8:1.0 O:1 N-C3H7:1.0 OH:1 C3H8 + OH [=] N-C3H7 + H2O 1.000000E+07 1.0 1599.900000 C3H8:1.0 OH:1 N-C3H7:1.0 H2O:1 C3H8 + OH [=] I-C3H7 + H2O 2.000000E+04 -1.6 -99.900000 C3H8:1.0 OH:1 I-C3H7:1.0 H2O:1 C3H8 + HO2 [=] I-C3H7 + H2O2 9.640000E+00 2.6 13917.300000 C3H8:1.0 HO2:1 I-C3H7:1.0 H2O2:1 C3H8 + HO2 [=] N-C3H7 + H2O2 4.760000E+01 2.55 16491.400000 C3H8:1.0 HO2:1 N-C3H7:1.0 H2O2:1 I-C3H7 + C3H8 [=] N-C3H7 + C3H8 8.400000E-06 4.2 8675.910000 I-C3H7:1.0 C3H8:1 N-C3H7:1.0 C3H8:1 C3H6 + H (+ M) [=] I-C3H7 (+ M) 1.330000E+10 0.0 1560.710000 8.700000E+36 -7.5 4732.310000 AR:0.7 C2H6:3.0 CH4:2.0 CO:1.5 CO2:2.0 H2:2.0 H2O:6.0 1 1000 645.4 6844 C3H6:1.0 H:1 I-C3H7:1.0 I-C3H7 + O2 [=] C3H6 + HO2 1.300000E+08 0.0 0.000000 I-C3H7:1.0 O2:1 C3H6:1.0 HO2:1 N-C3H7 (+ M) [=] CH3 + C2H4 (+ M) 1.230000E+13 -0.1 30210.330000 5.490000E+46 -10.0 35778.920000 -1.17 251 1e-15 1185 N-C3H7:1.0 CH3:1.0 C2H4:1 H + C3H6 (+ M) [=] N-C3H7 (+ M) 1.330000E+10 0.0 3260.040000 6.260000E+32 -6.66 7000.480000 AR:0.7 C2H6:3.0 CH4:2.0 CO:1.5 CO2:2.0 H2:2.0 H2O:6.0 1 1000 1310 48100 H:1.0 C3H6:1 N-C3H7:1.0 N-C3H7 + O2 [=] C3H6 + HO2 3.500000E+13 -1.6 3500.000000 N-C3H7:1.0 O2:1 C3H6:1.0 HO2:1 N-C3H7 + O2 [=] C3H6OOH 2.000000E+09 0.0 0.000000 N-C3H7:1.0 O2:1 C3H6OOH:1.0 C3H6OOH [=] C3H6 + HO2 2.500000E+35 -8.3 22000.000000 C3H6OOH:1.0 C3H6:1.0 HO2:1 C3H6OOH + O2 [=] OC3H5OOH + OH 1.500000E+05 0.0 -7000.000000 C3H6OOH:1.0 O2:1 OC3H5OOH:1.0 OH:1 OC3H5OOH [=] CH2CHO + CH2O + OH 1.000000E+15 0.0 43000.000000 OC3H5OOH:1.0 CH2CHO:1.0 CH2O:1 OH:1 C6H5CH3 + OH [=] C6H5CH2 + H2O 7.700000E+01 1.39 -602.000000 C6H5CH3:1.0 OH:1 C6H5CH2:1.0 H2O:1 C6H5CH3 + O2 [=] C6H5CH2 + HO2 1.500000E+03 2.0 30000.000000 C6H5CH3:1.0 O2:1 C6H5CH2:1.0 HO2:1 C6H5CH2 + OH [=] C6H5CHO + H2 3.000000E+11 0.0 0.000000 C6H5CH2:1.0 OH:1 C6H5CHO:1.0 H2:1 C6H5CH2 + HO2 [=] C6H5CHO + H2O 3.000000E+11 0.0 0.000000 C6H5CH2:1.0 HO2:1 C6H5CHO:1.0 H2O:1 C6H5CH2 + O [=] C6H5CHO + H 2.110000E+12 0.0 0.000000 C6H5CH2:1.0 O:1 C6H5CHO:1.0 H:1 C6H5CH2 + O [=] C6H5 + CH2O 5.950000E+10 0.0 0.000000 C6H5CH2:1.0 O:1 C6H5:1.0 CH2O:1 C6H5CH3 (+ M) [=] C6H5CH2 + H (+ M) 2.780000E+15 0.17 91200.000000 1.000000E+95 -22.9 99900.000000 0.0655 15.1 1e+10 7.6e+07 C6H5CH3:1.0 C6H5CH2:1.0 H:1 C6H5CH3 (+ M) [=] C6H5 + CH3 (+ M) 1.950000E+27 -3.16 107000.000000 1.000000E+95 -23.0 122000.000000 0.705 1e+10 460 8.21e+09 C6H5CH3:1.0 C6H5:1.0 CH3:1 C6H5CH3 + H [=] C6H6 + CH3 9.490000E+02 2.0 944.000000 C6H5CH3:1.0 H:1 C6H6:1.0 CH3:1 C6H5CHO + H [=] C6H5CO + H2 1.310000E+02 2.58 1220.000000 C6H5CHO:1.0 H:1 C6H5CO:1.0 H2:1 C6H5CHO + OH [=] C6H5CO + H2O 3.370000E+09 0.0 -619.000000 C6H5CHO:1.0 OH:1 C6H5CO:1.0 H2O:1 C6H5 + CO [=] C6H5CO 1.700000E+09 0.63 16900.000000 C6H5:1.0 CO:1 C6H5CO:1.0 C6H5 + H (+ M) [=] C6H6 (+ M) 1.000000E+13 0.0 0.000000 6.600000E+71 -16.3 7000.000000 CH4:2.0 CO:1.5 CO2:2.0 H2:2.0 H2O:6.0 1 0.1 585 6110 C6H5:1.0 H:1 C6H6:1.0 C6H6 + H [=] C6H5 + H2 2.500000E+11 0.0 16000.000000 C6H6:1.0 H:1 C6H5:1.0 H2:1 C6H6 + O [=] C6H5 + OH 2.000000E+10 0.0 14700.000000 C6H6:1.0 O:1 C6H5:1.0 OH:1 C6H6 + OH [=] C6H5 + H2O 1.200000E-03 4.1 -301.000000 C6H6:1.0 OH:1 C6H5:1.0 H2O:1 C6H5 + O2 [=] C6H5O + O 6.000000E+12 0.0 11200.000000 C6H5:1.0 O2:1 C6H5O:1.0 O:1 C6H5O [=] CO + C5H5 2.000000E+13 0.0 35000.000000 C6H5O:1.0 CO:1.0 C5H5:1 C5H5 + O [=] C4H5-N + CO 3.200000E+10 -0.17 440.000000 C5H5:1.0 O:1 C4H5-N:1.0 CO:1 C2H3 + C2H2 [=] C4H5-N 1.100000E+28 -7.14 5600.000000

0.0132

1.100000E+29 -7.33 6200.000000

0.0263

2.400000E+28 -6.95 5600.000000

0.12

9.300000E+35 -8.76 12000.000000

1.0

8.100000E+34 -8.09 13400.000000

10.0

C2H3:1.0 C2H2:1 C4H5-N:1.0 NC7H16 + O2 =] NC7H15 + HO2 9.000000E+10 0.0 50424.099000 NC7H16:1.0 O2:1 NC7H15:1.0 HO2:1 NC7H15 + HO2 =] NC7H16 + O2 6.000000E+08 0.0 1172.530000 NC7H15:1.0 HO2:1 NC7H16:1.0 O2:1 NC7H16 + OH =] NC7H15 + H2O 1.000000E+11 0.0 2906.981000 NC7H16:1.0 OH:1 NC7H15:1.0 H2O:1 NC7H16 + HO2 =] NC7H15 + H2O2 6.000000E+09 0.0 19534.197000 NC7H16:1.0 HO2:1 NC7H15:1.0 H2O2:1 NC7H15 + O2 =] NC7H15OO 9.000000E+09 0.0 0.000000 NC7H15:1.0 O2:1 NC7H15OO:1.0 NC7H15OO =] NC7H15 + O2 1.250000E+15 0.0 33510.800000 NC7H15OO:1.0 NC7H15:1.0 O2:1 NC7H15OO [=] NC7H14OOH 1.200000E+11 0.0 21350.315000 NC7H15OO:1.0 NC7H14OOH:1.0 NC7H14OOH + O2 =] OONC7H14OOH 1.000000E+10 0.0 0.000000 NC7H14OOH:1.0 O2:1 OONC7H14OOH:1.0 OONC7H14OOH =] NC7H14OOH + O2 4.440000E+10 0.0 22957.798000 OONC7H14OOH:1.0 NC7H14OOH:1.0 O2:1 OONC7H14OOH =] NC7KET + OH 2.000000E+11 0.0 18345.971000 OONC7H14OOH:1.0 NC7KET:1.0 OH:1 NC7KET =] OH + CH2O + NC5H11CO 4.000000E+15 0.0 39000.000000 NC7KET:1.0 OH:1.0 CH2O:1 NC5H11CO:1 NC5H11CO + O2 =] IC3H7 + C2H3 + CO + HO2 3.160000E+10 0.0 10000.000000 NC5H11CO:1.0 O2:1 IC3H7:1.0 C2H3:1 CO:1 HO2:1 NC7H15OO [=] NC7H14 + HO2 2.800000E+12 0.0 28000.000000 NC7H15OO:1.0 NC7H14:1.0 HO2:1 NC7H14 + O2 =] C3H6 + C2H5 + CH2O + HCO 3.160000E+10 0.0 10000.000000 NC7H14:1.0 O2:1 C3H6:1.0 C2H5:1 CH2O:1 HCO:1 NC7H15 =] C3H6 + C2H5 + C2H4 5.000000E+08 0.0 10000.000000 NC7H15:1.0 C3H6:1.0 C2H5:1 C2H4:1 IC8H18 + HO2 =] C8H17 + H2O2 5.000000E+10 0.0 18740.000000 IC8H18:1.0 HO2:1 C8H17:1.0 H2O2:1 C8H17 + H2O2 =] IC8H18 + HO2 5.000000E+09 0.0 10400.000000 C8H17:1.0 H2O2:1 IC8H18:1.0 HO2:1 IC8H18 + O2 =] C8H17 + HO2 1.000000E+11 0.0 50271.000000 IC8H18:1.0 O2:1 C8H17:1.0 HO2:1 C8H17 + HO2 =] IC8H18 + O2 2.000000E+09 0.0 1475.000000 C8H17:1.0 HO2:1 IC8H18:1.0 O2:1 IC8H18 + OH =] C8H17 + H2O 1.460000E+05 2.03 0.000000 IC8H18:1.0 OH:1 C8H17:1.0 H2O:1 C8H17 + H2O =] IC8H18 + OH 5.000000E+12 0.0 25650.000000 C8H17:1.0 H2O:1 IC8H18:1.0 OH:1 C8H17 =] IC3H7 + C3H6 + C2H4 3.000000E+13 -1.27 10000.000000 C8H17:1.0 IC3H7:1.0 C3H6:1 C2H4:1 C8H17 + O2 =] C8H17O2 2.500000E+09 0.0 465.000000 C8H17:1.0 O2:1 C8H17O2:1.0 C8H17O2 =] C8H17 + O2 2.500000E+15 0.0 31300.000000 C8H17O2:1.0 C8H17:1.0 O2:1 C8H17O2 =] C8H16OOH 2.860000E+10 1.23 22000.000000 C8H17O2:1.0 C8H16OOH:1.0 C8H16OOH =] C8H17O2 1.372338E+08 1.2849540893983 6835.560580 C8H16OOH:1.0 C8H17O2:1.0 C8H17O2 [=] C8H16 + HO2 2.000000E+14 0.0 26056.000000

10.0

2.500000E+14 0.0 26056.000000

20.0

3.500000E+14 0.0 26056.000000

40.0

C8H17O2:1.0 C8H16:1.0 HO2:1 C8H16OOH + O2 =] C8H16OOH-O2 3.000000E+11 0.0 0.000000 C8H16OOH:1.0 O2:1 C8H16OOH-O2:1.0 C8H16OOH-O2 =] C8H16OOH + O2 2.000000E+15 0.0 33900.000000 C8H16OOH-O2:1.0 C8H16OOH:1.0 O2:1 C8H16OOH-O2 [=] IC8KET + OH 2.530000E+12 0.0 26000.000000 C8H16OOH-O2:1.0 IC8KET:1.0 OH:1 C8H16 + O2 =] IC3H7 + CH4 + C2H2 + CH2O + HCO 3.160000E+10 0.0 10000.000000 C8H16:1.0 O2:1 IC3H7:1.0 CH4:1 C2H2:1 CH2O:1 HCO:1 IC8KET =] CH2O + CH3 + OH + C4H8-1 + CH2CO 1.000000E+16 0.0 41600.000000 IC8KET:1.0 CH2O:1.0 CH3:1 OH:1 C4H8-1:1 CH2CO:1 H2 + M [=] H + H + M 4.577000E+16 -1.4 104400.000000 CH4:2.0 CO:1.9 CO2:3.8 H2:2.5 H2O:12.0 H2:1.0 H:2.0 H2 + O [=] H + OH 5.080000E+01 2.67 6292.000000 H2:1.0 O:1 H:1.0 OH:1 H2 + OH [=] H + H2O 4.380000E+10 0.0 6990.000000 H2:1.0 OH:1 H:1.0 H2O:1 O + O + M [=] O2 + M 6.165000E+09 -0.5 0.000000 CH4:2.0 CO:1.9 CO2:3.8 H2:2.5 H2O:12.0 O:2.0 O2:1.0 O2 + H [=] O + OH 1.040000E+11 0.0 15286.000000 O2:1.0 H:1 O:1.0 OH:1 H + OH + M [=] H2O + M 3.500000E+16 -2.0 0.000000 CH4:2.0 H2:0.73 H2O:3.65 H:1.0 OH:1 H2O:1.0 O + H2O [=] OH + OH 6.700000E+04 1.704 14986.800000 O:1.0 H2O:1 OH:2.0 O + H + M [=] OH + M 4.714000E+12 -1.0 0.000000 CH4:2.0 CO:1.5 CO2:2.0 H2:2.5 H2O:12.0 O:1.0 H:1 OH:1.0 H2O2 (+ M) [=] OH + OH (+ M) 2.000000E+12 0.9 48749.000000 2.490000E+21 -2.3 48749.000000 CO:2.8 CO2:1.6 H2:3.7 H2O:7.65 H2O2:7.7 O2:1.2 0.43 1e-30 1e+30 H2O2:1.0 OH:2.0 H2O2 + H [=] H2O + OH 2.410000E+10 0.0 3970.000000 H2O2:1.0 H:1 H2O:1.0 OH:1 H2O2 + H [=] H2 + HO2 2.150000E+07 1.0 6000.000000 H2O2:1.0 H:1 H2:1.0 HO2:1 H2O2 + O [=] OH + HO2 9.550000E+03 2.0 3970.000000 H2O2:1.0 O:1 OH:1.0 HO2:1 H2O2 + OH [=] H2O + HO2 1.740000E+09 0.0 318.000000 H2O2:1.0 OH:1 H2O:1.0 HO2:1 H2O2 + OH [=] H2O + HO2 7.590000E+10 0.0 7269.000000 H2O2:1.0 OH:1 H2O:1.0 HO2:1 HO2 + H [=] OH + OH 7.079000E+10 0.0 295.000000 HO2:1.0 H:1 OH:2.0 HO2 + H [=] H2 + O2 1.140200E+07 1.0827 553.780000 HO2:1.0 H:1 H2:1.0 O2:1 HO2 + O [=] OH + O2 3.250000E+10 0.0 0.000000 HO2:1.0 O:1 OH:1.0 O2:1 OH + HO2 [=] H2O + O2 7.000000E+09 0.0 -1092.960000 OH:1.0 HO2:1 H2O:1.0 O2:1 OH + HO2 [=] H2O + O2 4.500000E+11 0.0 10929.600000 OH:1.0 HO2:1 H2O:1.0 O2:1 HO2 + HO2 [=] H2O2 + O2 1.000000E+11 0.0 11040.883200 HO2:2.0 H2O2:1.0 O2:1 HO2 + HO2 [=] H2O2 + O2 1.900000E+08 0.0 -1408.924800 HO2:2.0 H2O2:1.0 O2:1 H + O2 (+ M) [=] HO2 (+ M) 4.650000E+09 0.44 0.000000 1.737000E+13 -1.23 0.000000 CH4:2.0 CO:1.9 CO2:3.8 H2:1.3 H2O:10.0 0.67 1e-30 1e+30 1e+30 H:1.0 O2:1 HO2:1.0 CO + O (+ M) [=] CO2 (+ M) 1.362000E+07 0.0 2384.000000 1.173000E+18 -2.79 4191.000000 CO:1.75 CO2:3.6 H2:2.0 H2O:12.0 CO:1.0 O:1 CO2:1.0 CO + OH [=] CO2 + H 7.015000E+01 2.053 -355.700000 CO:1.0 OH:1 CO2:1.0 H:1 CO + OH [=] CO2 + H 5.757000E+09 -0.664 331.800000 CO:1.0 OH:1 CO2:1.0 H:1 CO + HO2 [=] CO2 + OH 1.570000E+02 2.18 17940.000000 CO:1.0 HO2:1 CO2:1.0 OH:1 CO + O2 [=] CO2 + O 1.119000E+09 0.0 47700.000000 CO:1.0 O2:1 CO2:1.0 O:1 CH3 + H (+ M) [=] CH4 (+ M) 1.270000E+13 -0.63 383.000000 2.477000E+27 -4.76 2440.000000 CH4:2.0 CO:1.5 CO2:2.0 H2:2.0 H2O:6.0 0.783 74 2941 6964 CH3:1.0 H:1 CH4:1.0 CH4 + H [=] CH3 + H2 6.140000E+02 2.5 9587.000000 CH4:1.0 H:1 CH3:1.0 H2:1 CH4 + O [=] CH3 + OH 1.020000E+06 1.5 8600.000000 CH4:1.0 O:1 CH3:1.0 OH:1 CH4 + OH [=] CH3 + H2O 5.830000E+01 2.6 2190.000000 CH4:1.0 OH:1 CH3:1.0 H2O:1 CH4 + HO2 [=] CH3 + H2O2 1.130000E-02 3.74 21010.000000 CH4:1.0 HO2:1 CH3:1.0 H2O2:1 CH3 + HO2 [=] CH4 + O2 1.160000E+02 2.23 -3022.000000 CH3:1.0 HO2:1 CH4:1.0 O2:1 CH4 + CH2 [=] CH3 + CH3 2.460000E+03 2.0 8270.000000 CH4:1.0 CH2:1 CH3:2.0 CH2 + H (+ M) [=] CH3 (+ M) 2.500000E+13 -0.8 0.000000 3.200000E+21 -3.14 1230.000000 CH4:2.0 CO:1.5 CO2:2.0 H2:2.0 H2O:6.0 0.68 78 1995 5590 CH2:1.0 H:1 CH3:1.0 CH2 + O2 [=] HCO + OH 1.060000E+10 0.0 1500.000000 CH2:1.0 O2:1 HCO:1.0 OH:1 CH2 + O2 =] CO2 + H + H 2.640000E+09 0.0 1500.000000 CH2:1.0 O2:1 CO2:1.0 H:2 CH2 + O =] CO + H + H 5.000000E+10 0.0 0.000000 CH2:1.0 O:1 CO:1.0 H:2 CH2 + H [=] CH + H2 3.000000E+10 0.0 0.000000 CH2:1.0 H:1 CH:1.0 H2:1 CH2 + OH [=] CH + H2O 1.130000E+04 2.0 3000.000000 CH2:1.0 OH:1 CH:1.0 H2O:1 CH + O2 [=] HCO + O 3.300000E+10 0.0 0.000000 CH:1.0 O2:1 HCO:1.0 O:1 CH + O [=] CO + H 5.700000E+10 0.0 0.000000 CH:1.0 O:1 CO:1.0 H:1 CH + OH [=] HCO + H 3.000000E+10 0.0 0.000000 CH:1.0 OH:1 HCO:1.0 H:1 CH + H2O [=] H + CH2O 1.774000E+13 -1.22 23.800000 CH:1.0 H2O:1 H:1.0 CH2O:1 CH + CO2 [=] HCO + CO 1.700000E+09 0.0 685.000000 CH:1.0 CO2:1 HCO:1.0 CO:1 CH3 + O2 (+ M) [=] CH3O2 (+ M) 7.812000E+06 0.9 0.000000 6.850000E+18 -3.0 0.000000 0.6 1000 70 1700 CH3:1.0 O2:1 CH3O2:1.0 CH3 + O2 [=] CH3O + O 7.546000E+09 0.0 28320.000000 CH3:1.0 O2:1 CH3O:1.0 O:1 CH3 + O2 [=] CH2O + OH 2.641000E-03 3.283 8105.000000 CH3:1.0 O2:1 CH2O:1.0 OH:1 CH3 + O [=] CH2O + H 5.540000E+10 0.05 -136.000000 CH3:1.0 O:1 CH2O:1.0 H:1 CH3 + OH [=] CH2O + H2 3.502000E+02 1.441 -3244.000000

0.01

8.854000E+02 1.327 -2975.000000

0.1

1.650000E+04 0.973 -2010.000000

1.0

5.374000E+06 0.287 280.000000

10.0

9.494000E+15 -2.199 9769.000000

100.0

CH3:1.0 OH:1 CH2O:1.0 H2:1 CH3 + OH [=] CH2OH + H 1.621000E+07 0.965 3214.000000

0.01

1.807000E+07 0.95 3247.000000

0.1

4.686000E+07 0.833 3566.000000

1.0

1.525000E+10 0.134 5641.000000

10.0

3.590000E+11 -0.186 8601.000000

100.0

CH3:1.0 OH:1 CH2OH:1.0 H:1 CH3 + OH [=] H + CH3O 1.186000E+06 1.016 11940.000000

0.01

1.188000E+06 1.016 11940.000000

0.1

1.230000E+06 1.011 11950.000000

1.0

1.798000E+06 0.965 12060.000000

10.0

5.242000E+07 0.551 13070.000000

100.0

CH3:1.0 OH:1 H:1.0 CH3O:1 CH3 + OH [=] CH2 + H2O 4.293000E+01 2.568 3997.800000 CH3:1.0 OH:1 CH2:1.0 H2O:1 CH3 + HO2 [=] CH3O + OH 1.000000E+09 0.269 -687.500000 CH3:1.0 HO2:1 CH3O:1.0 OH:1 CH3O2 + O [=] CH3O + O2 3.600000E+10 0.0 0.000000 CH3O2:1.0 O:1 CH3O:1.0 O2:1 CH3O2 + H [=] CH3O + OH 9.600000E+10 0.0 0.000000 CH3O2:1.0 H:1 CH3O:1.0 OH:1 CH3O2 + OH [=] CH3OH + O2 6.000000E+10 0.0 0.000000 CH3O2:1.0 OH:1 CH3OH:1.0 O2:1 CH3O2 + CH3 [=] CH3O + CH3O 5.080000E+09 0.0 -1411.000000 CH3O2:1.0 CH3:1 CH3O:2.0 CH3O2 + CH3O2 =] CH2O + CH3OH + O2 3.110000E+11 -1.61 -1051.000000 CH3O2:2.0 CH2O:1.0 CH3OH:1 O2:1 CH3O2 + CH3O2 =] O2 + CH3O + CH3O 1.400000E+13 -1.61 1860.000000 CH3O2:2.0 O2:1.0 CH3O:2 CH3OH (+ M) [=] CH3 + OH (+ M) 2.084000E+18 -0.615 92540.600000 1.500000E+40 -6.995 97992.200000 -0.4748 35580 1116 9023 CH3OH:1.0 CH3:1.0 OH:1 CH3OH (+ M) [=] CH2OH + H (+ M) 7.896000E-03 5.038 84467.400000 3.390000E+39 -7.244 105230.300000 -73.91 37050 41500 5220 CH3OH:1.0 CH2OH:1.0 H:1 CH3OH + H [=] CH3O + H2 1.990000E+02 2.56 10300.000000 CH3OH:1.0 H:1 CH3O:1.0 H2:1 CH3OH + H [=] CH2OH + H2 3.070000E+02 2.55 5440.000000 CH3OH:1.0 H:1 CH2OH:1.0 H2:1 CH3OH + O [=] CH3O + OH 3.880000E+01 2.5 3080.000000 CH3OH:1.0 O:1 CH3O:1.0 OH:1 CH3OH + O [=] CH2OH + OH 3.880000E+02 2.5 3080.000000 CH3OH:1.0 O:1 CH2OH:1.0 OH:1 CH3OH + OH [=] CH3O + H2O 1.500000E-01 3.03 -763.000000 CH3OH:1.0 OH:1 CH3O:1.0 H2O:1 CH3OH + OH [=] CH2OH + H2O 3.080000E+01 2.65 -806.700000 CH3OH:1.0 OH:1 CH2OH:1.0 H2O:1 CH3OH + O2 [=] CH3O + HO2 3.580000E+01 2.27 42764.500000 CH3OH:1.0 O2:1 CH3O:1.0 HO2:1 CH3OH + O2 [=] CH2OH + HO2 3.580000E+02 2.27 42764.500000 CH3OH:1.0 O2:1 CH2OH:1.0 HO2:1 CH3OH + HO2 [=] CH3O + H2O2 1.220000E+09 0.0 20070.700000 CH3OH:1.0 HO2:1 CH3O:1.0 H2O2:1 CH3OH + HO2 [=] CH2OH + H2O2 3.260000E+10 0.0 18782.200000 CH3OH:1.0 HO2:1 CH2OH:1.0 H2O2:1 CH3OH + CH3 [=] CH2OH + CH4 2.130000E-04 3.953 7055.100000 CH3OH:1.0 CH3:1 CH2OH:1.0 CH4:1 CH3OH + CH3 [=] CH3O + CH4 3.220000E+00 2.425 8579.500000 CH3OH:1.0 CH3:1 CH3O:1.0 CH4:1 CH3OH + HCO [=] CH2OH + CH2O 9.630000E+00 2.9 13110.000000 CH3OH:1.0 HCO:1 CH2OH:1.0 CH2O:1 CH3OH + CH3O [=] CH2OH + CH3OH 3.000000E+08 0.0 4074.000000 CH3OH:1.0 CH3O:1 CH2OH:1.0 CH3OH:1 CH2OH + O2 [=] CH2O + HO2 1.510000E+12 -1.0 0.000000 CH2OH:1.0 O2:1 CH2O:1.0 HO2:1 CH2OH + O2 [=] CH2O + HO2 2.410000E+11 0.0 5017.000000 CH2OH:1.0 O2:1 CH2O:1.0 HO2:1 CH2OH + H [=] CH2O + H2 6.000000E+09 0.0 0.000000 CH2OH:1.0 H:1 CH2O:1.0 H2:1 CH2OH + HO2 [=] CH2O + H2O2 1.200000E+10 0.0 0.000000 CH2OH:1.0 HO2:1 CH2O:1.0 H2O2:1 CH2OH + HCO [=] CH2O + CH2O 1.800000E+11 0.0 0.000000 CH2OH:1.0 HCO:1 CH2O:2.0 CH2OH + HCO [=] CH3OH + CO 1.000000E+10 0.0 0.000000 CH2OH:1.0 HCO:1 CH3OH:1.0 CO:1 CH2OH + CH3O [=] CH2O + CH3OH 2.400000E+10 0.0 0.000000 CH2OH:1.0 CH3O:1 CH2O:1.0 CH3OH:1 CH2OH + OH [=] H2O + CH2O 2.400000E+10 0.0 0.000000 CH2OH:1.0 OH:1 H2O:1.0 CH2O:1 CH2OH + O [=] OH + CH2O 4.200000E+10 0.0 0.000000 CH2OH:1.0 O:1 OH:1.0 CH2O:1 CH2OH + CH2OH [=] CH2O + CH3OH 3.000000E+09 0.0 0.000000 CH2OH:2.0 CH2O:1.0 CH3OH:1 CH3O + O2 [=] CH2O + HO2 4.380000E-22 9.5 -5501.000000 CH3O:1.0 O2:1 CH2O:1.0 HO2:1 CH3O + H [=] CH2O + H2 2.000000E+10 0.0 0.000000 CH3O:1.0 H:1 CH2O:1.0 H2:1 CH3O + HO2 [=] CH2O + H2O2 3.010000E+08 0.0 0.000000 CH3O:1.0 HO2:1 CH2O:1.0 H2O2:1 CH3O + CH3 [=] CH2O + CH4 1.200000E+10 0.0 0.000000 CH3O:1.0 CH3:1 CH2O:1.0 CH4:1 CH3O + CH3O [=] CH3OH + CH2O 6.030000E+10 0.0 0.000000 CH3O:2.0 CH3OH:1.0 CH2O:1 HCO + H (+ M) [=] CH2O (+ M) 1.090000E+09 0.48 -260.000000 1.350000E+18 -2.57 1425.000000 CH4:2.0 CO:1.5 CO2:2.0 H2:2.0 H2O:6.0 0.7824 271 2755 6570 HCO:1.0 H:1 CH2O:1.0 CO + H2 (+ M) [=] CH2O (+ M) 4.300000E+04 1.5 79600.000000 5.070000E+21 -3.42 84348.000000 CH4:2.0 CO:1.5 CO2:2.0 H2:2.0 H2O:6.0 0.932 197 1540 10300 CO:1.0 H2:1 CH2O:1.0 CH2O + O2 [=] HCO + HO2 8.070000E+12 0.0 53420.000000 CH2O:1.0 O2:1 HCO:1.0 HO2:1 CH2O + O [=] HCO + OH 6.260000E+06 1.15 2260.000000 CH2O:1.0 O:1 HCO:1.0 OH:1 CH2O + H [=] HCO + H2 5.740000E+04 1.9 2740.000000 CH2O:1.0 H:1 HCO:1.0 H2:1 CH2O + OH [=] HCO + H2O 7.820000E+01 1.63 -1055.000000 CH2O:1.0 OH:1 HCO:1.0 H2O:1 CH2O + HO2 [=] HCO + H2O2 1.880000E+01 2.7 11520.000000 CH2O:1.0 HO2:1 HCO:1.0 H2O2:1 CH2O + CH3 [=] HCO + CH4 3.830000E-02 3.36 4312.000000 CH2O:1.0 CH3:1 HCO:1.0 CH4:1 CH2O + CH3O [=] HCO + CH3OH 6.620000E+08 0.0 2294.000000 CH2O:1.0 CH3O:1 HCO:1.0 CH3OH:1 HCO + M [=] H + CO + M 5.700000E+08 0.66 14870.000000 CH4:2.0 CO:1.5 CO2:2.0 H2:2.0 H2O:6.0 HCO:1.0 H:1.0 CO:1 HCO + O2 [=] CO + HO2 7.580000E+09 0.0 410.000000 HCO:1.0 O2:1 CO:1.0 HO2:1 HCO + O [=] CO + OH 3.020000E+10 0.0 0.000000 HCO:1.0 O:1 CO:1.0 OH:1 HCO + H [=] CO + H2 7.340000E+10 0.0 0.000000 HCO:1.0 H:1 CO:1.0 H2:1 HCO + OH [=] CO + H2O 3.011000E+10 0.0 0.000000 HCO:1.0 OH:1 CO:1.0 H2O:1 HCO + CH3 [=] CH4 + CO 2.650000E+10 0.0 0.000000 HCO:1.0 CH3:1 CH4:1.0 CO:1 HCO + HCO [=] CH2O + CO 1.800000E+10 0.0 0.000000 HCO:2.0 CH2O:1.0 CO:1 HCO + O [=] CO2 + H 3.000000E+10 0.0 0.000000 HCO:1.0 O:1 CO2:1.0 H:1 HCO + HO2 =] CO2 + H + OH 3.000000E+10 0.0 0.000000 HCO:1.0 HO2:1 CO2:1.0 H:1 OH:1 HCO + HCO =] H2 + CO + CO 3.000000E+09 0.0 0.000000 HCO:2.0 H2:1.0 CO:2 CH2O + H (+ M) [=] CH2OH (+ M) 5.400000E+08 0.454 3600.000000 1.270000E+26 -4.82 6530.000000 CH4:2.0 CO:1.5 CO2:2.0 H2:2.0 H2O:6.0 0.7187 103 1291 4160 CH2O:1.0 H:1 CH2OH:1.0 CH3O (+ M) [=] CH2O + H (+ M) 6.800000E+13 0.0 26170.000000 1.867000E+22 -3.0 24307.000000 CH4:2.0 CO:1.5 CO2:2.0 H2:2.0 H2O:6.0 0.9 2500 1300 1e+99 CH3O:1.0 CH2O:1.0 H:1 C2H4 + H (+ M) [=] C2H5 (+ M) 9.569000E+05 1.463 1355.000000 1.419000E+33 -6.642 5769.000000 CH4:2.0 CO:1.5 CO2:2.0 H2:2.0 H2O:6.0 -0.569 299 -9147 152.4 C2H4:1.0 H:1 C2H5:1.0 C2H5 + H [=] C2H4 + H2 2.000000E+09 0.0 0.000000 C2H5:1.0 H:1 C2H4:1.0 H2:1 C2H4 + C2H4 [=] C2H5 + C2H3 4.820000E+11 0.0 71530.000000 C2H4:2.0 C2H5:1.0 C2H3:1 C2H5 + CH3 [=] CH4 + C2H4 1.180000E+01 2.45 -2921.000000 C2H5:1.0 CH3:1 CH4:1.0 C2H4:1 CH3 + CH3 [=] H + C2H5 4.740000E+09 0.105 10664.300000

0.01

2.570000E+10 -0.096 11406.100000

0.1

3.100000E+11 -0.362 13372.500000

1.0

2.150000E+07 0.885 13532.500000

10.0

1.032000E-01 3.23 11236.100000

100.0

CH3:2.0 H:1.0 C2H5:1 C2H5 + O2 [=] C2H4 + HO2 2.094000E+06 0.49 -391.400000

0.04

1.843000E+04 1.13 -720.600000

1.0

7.561000E+11 -1.01 4749.000000

10.0

C2H5:1.0 O2:1 C2H4:1.0 HO2:1 C2H3 + H (+ M) [=] C2H4 (+ M) 6.080000E+09 0.27 280.000000 1.400000E+24 -3.86 3320.000000 CH4:2.0 CO:1.5 CO2:2.0 H2:2.0 H2O:6.0 0.782 207.5 2663 6095 C2H3:1.0 H:1 C2H4:1.0 C2H4 + O2 [=] C2H3 + HO2 4.220000E+10 0.0 57623.100000 C2H4:1.0 O2:1 C2H3:1.0 HO2:1 C2H4 + H [=] C2H3 + H2 5.070000E+04 1.93 12950.000000 C2H4:1.0 H:1 C2H3:1.0 H2:1 C2H4 + OH [=] C2H3 + H2O 6.690000E+01 2.745 2215.500000 C2H4:1.0 OH:1 C2H3:1.0 H2O:1 C2H4 + CH3O [=] C2H3 + CH3OH 1.200000E+08 0.0 6750.000000 C2H4:1.0 CH3O:1 C2H3:1.0 CH3OH:1 C2H4 + CH3 [=] C2H3 + CH4 9.760000E-01 2.947 15148.000000 C2H4:1.0 CH3:1 C2H3:1.0 CH4:1 C2H4 + CH3 [=] C2H3 + CH4 8.130000E-08 4.417 8835.800000 C2H4:1.0 CH3:1 C2H3:1.0 CH4:1 C2H4 + O [=] CH3 + HCO 7.453000E+03 1.88 183.000000 C2H4:1.0 O:1 CH3:1.0 HCO:1 CH + CH4 [=] C2H4 + H 6.000000E+10 0.0 0.000000 CH:1.0 CH4:1 C2H4:1.0 H:1 C2H4 + OH [=] CH3 + CH2O 5.350000E-03 2.92 -1732.700000

0.01

3.190000E-02 2.71 -1172.300000

0.025

5.550000E-01 2.36 -180.800000

0.1

1.780000E+02 1.68 2060.500000

1.0

2.370000E+06 0.56 6006.700000

10.0

2.760000E+10 -0.5 11455.100000

100.0

C2H4:1.0 OH:1 CH3:1.0 CH2O:1 C2H2 + H (+ M) [=] C2H3 (+ M) 1.710000E+07 1.266 2709.000000 6.346000E+25 -4.664 3780.000000 CH4:2.0 CO:1.5 CO2:2.0 H2:2.0 H2O:6.0 0.788 -10200 1e-30 C2H2:1.0 H:1 C2H3:1.0 C2H3 + O2 [=] C2H2 + HO2 1.080000E+04 1.28 3322.000000

0.01

7.750000E+03 1.33 3216.000000

0.1

1.210000E+04 1.27 3311.000000

0.316

2.150000E+04 1.19 3367.000000

1.0

1.130000E+05 1.0 3695.000000

3.16

1.310000E+08 0.12 5872.000000

10.0

1.190000E+06 0.82 5617.000000

31.6

1.060000E+14 -1.45 12230.000000

100.0

C2H3:1.0 O2:1 C2H2:1.0 HO2:1 C2H3 + O2 [=] C2H2 + HO2 4.760000E-02 2.75 -796.400000

0.01

5.160000E-02 2.73 -768.300000

0.1

5.550000E-02 2.73 -658.500000

0.316

4.600000E-02 2.76 -492.800000

1.0

3.750000E-03 3.07 -601.000000

3.16

5.480000E-03 3.07 85.700000

10.0

4.470000E+05 0.0 955.000000

31.6

2.020000E-02 2.94 1847.000000

100.0

C2H3:1.0 O2:1 C2H2:1.0 HO2:1 C2H3 + O2 [=] CH2CO + OH 8.660000E-01 2.41 6061.000000

0.01

8.910000E-01 2.41 6078.000000

0.1

9.430000E-01 2.4 6112.000000

0.316

1.060000E+00 2.39 6180.000000

1.0

1.090000E+00 2.38 6179.000000

3.16

1.390000E+00 2.36 6074.000000

10.0

2.490000E+03 1.42 8480.000000

31.6

1.660000E+07 0.36 12010.000000

100.0

C2H3:1.0 O2:1 CH2CO:1.0 OH:1 C2H3 + O2 [=] CH2CO + OH 1.820000E-04 3.12 1331.000000

0.01

2.070000E-04 3.11 1383.000000

0.1

2.710000E-04 3.08 1496.000000

0.316

5.260000E-04 3.01 1777.000000

1.0

1.370000E-03 2.9 2225.000000

3.16

4.190000E-04 2.93 2052.000000

10.0

1.190000E-07 4.21 2043.000000

31.6

1.300000E-06 3.97 3414.000000

100.0

C2H3:1.0 O2:1 CH2CO:1.0 OH:1 C2H3 + O2 [=] CH2O + HCO 2.490000E+33 -7.6 12640.000000

0.01

2.430000E+33 -7.6 12610.000000

0.1

1.950000E+33 -7.57 12490.000000

0.316

2.730000E+32 -7.32 11820.000000

1.0

1.430000E+33 -7.47 12460.000000

3.16

5.180000E+32 -7.2 13430.000000

10.0

3.190000E+17 -2.57 5578.000000

31.6

2.730000E+30 -6.28 16000.000000

100.0

C2H3:1.0 O2:1 CH2O:1.0 HCO:1 C2H3 + O2 [=] CH2O + HCO 4.540000E+12 -1.28 515.300000

0.01

4.590000E+12 -1.28 513.000000

0.1

4.810000E+12 -1.29 520.600000

0.316

6.080000E+12 -1.31 645.700000

1.0

9.450000E+12 -1.36 1066.000000

3.16

2.560000E+12 -1.18 1429.000000

10.0

1.030000E+66 -19.23 14760.000000

31.6

4.210000E+07 0.19 830.600000

100.0

C2H3:1.0 O2:1 CH2O:1.0 HCO:1 C2H3 + O2 =] CH2O + H + CO 5.820000E+33 -7.6 12640.000000

0.01

5.660000E+33 -7.6 12610.000000

0.1

4.550000E+33 -7.57 12490.000000

0.316

6.360000E+32 -7.32 11820.000000

1.0

3.350000E+33 -7.47 12460.000000

3.16

1.210000E+33 -7.2 13430.000000

10.0

7.430000E+17 -2.57 5578.000000

31.6

6.360000E+30 -6.28 16000.000000

100.0

C2H3:1.0 O2:1 CH2O:1.0 H:1 CO:1 C2H3 + O2 =] CH2O + H + CO 1.060000E+13 -1.28 515.300000

0.01

1.070000E+13 -1.28 513.000000

0.1

1.130000E+13 -1.29 520.600000

0.316

1.420000E+13 -1.31 645.700000

1.0

2.200000E+13 -1.36 1066.000000

3.16

5.980000E+12 -1.18 1429.000000

10.0

2.390000E+66 -19.23 14760.000000

31.6

9.810000E+07 0.19 830.600000

100.0

C2H3:1.0 O2:1 CH2O:1.0 H:1 CO:1 C2H3 + O2 [=] CO + CH3O 8.190000E+15 -2.66 3201.000000

0.01

4.060000E+11 -1.32 885.800000

0.1

4.340000E+11 -1.33 900.600000

0.316

1.030000E+08 -0.33 -747.800000

1.0

1.890000E+09 -3.0 -8995.000000

3.16

1.930000E+21 -5.63 1.800000

10.0

1.100000E+15 -2.22 5178.000000

31.6

5.790000E+29 -6.45 16810.000000

100.0

C2H3:1.0 O2:1 CO:1.0 CH3O:1 C2H3 + O2 [=] CO + CH3O 1.290000E+06 0.18 -1717.000000

0.01

5.990000E+08 -2.93 -9564.000000

0.1

2.910000E+08 -2.93 -10120.000000

0.316

5.770000E+18 -3.54 4772.000000

1.0

4.990000E+12 -1.62 1849.000000

3.16

9.330000E+13 -1.96 3324.000000

10.0

1.020000E+69 -20.69 15860.000000

31.6

1.100000E+06 0.31 1024.000000

100.0

C2H3:1.0 O2:1 CO:1.0 CH3O:1 C2H3 + O2 [=] CO2 + CH3 2.370000E+32 -7.76 12630.000000

0.01

1.730000E+32 -7.72 12520.000000

0.1

4.470000E+31 -7.55 12140.000000

0.316

7.250000E+28 -6.7 10440.000000

1.0

3.630000E+32 -7.75 12830.000000

3.16

2.090000E+32 -7.53 14050.000000

10.0

3.840000E+15 -2.44 5408.000000

31.6

1.210000E+29 -6.32 16190.000000

100.0

C2H3:1.0 O2:1 CO2:1.0 CH3:1 C2H3 + O2 [=] CO2 + CH3 6.270000E+10 -1.16 406.300000

0.01

6.240000E+10 -1.16 401.400000

0.1

6.120000E+10 -1.16 397.000000

0.316

5.320000E+10 -1.14 446.700000

1.0

1.450000E+11 -1.26 987.700000

3.16

5.020000E+10 -1.11 1409.000000

10.0

1.400000E+67 -20.11 15430.000000

31.6

9.210000E+05 0.25 855.300000

100.0

C2H3:1.0 O2:1 CO2:1.0 CH3:1 C2H3 + H [=] C2H2 + H2 1.700000E+11 0.0 0.000000 C2H3:1.0 H:1 C2H2:1.0 H2:1 C2H3 + OH [=] C2H2 + H2O 3.011000E+10 0.0 0.000000 C2H3:1.0 OH:1 C2H2:1.0 H2O:1 C2H3 + CH3 [=] CH4 + C2H2 3.920000E+08 0.0 0.000000 C2H3:1.0 CH3:1 CH4:1.0 C2H2:1 C2H3 + C2H3 [=] C2H2 + C2H4 9.600000E+08 0.0 0.000000 C2H3:2.0 C2H2:1.0 C2H4:1 C2H2 + O [=] CH2 + CO 7.395000E+05 1.28 2472.000000 C2H2:1.0 O:1 CH2:1.0 CO:1 C2H2 + O [=] HCCO + H 2.958000E+06 1.28 2472.000000 C2H2:1.0 O:1 HCCO:1.0 H:1 C2H2 + HO2 [=] CH2CO + OH 6.030000E+06 0.0 7949.000000 C2H2:1.0 HO2:1 CH2CO:1.0 OH:1 C2H2 + HCO [=] C2H3 + CO 1.000000E+04 2.0 6000.000000 C2H2:1.0 HCO:1 C2H3:1.0 CO:1 C2H2 + OH [=] CH2CO + H 1.578000E+00 2.56 -844.500000

0.01

1.518000E+01 2.28 -292.100000

0.025

3.017000E+02 1.92 598.100000

0.1

7.528000E+03 1.55 2106.000000

1.0

5.101000E+03 1.65 3400.000000

10.0

1.457000E+01 2.45 4477.000000

100.0

C2H2:1.0 OH:1 CH2CO:1.0 H:1 C2H2 + OH [=] CH3 + CO 4.757000E+02 1.68 -329.800000

0.01

4.372000E+03 1.4 226.500000

0.025

7.648000E+04 1.05 1115.000000

0.1

1.277000E+06 0.73 2579.000000

1.0

4.312000E+05 0.92 3736.000000

10.0

8.250000E+02 1.77 4697.000000

100.0

C2H2:1.0 OH:1 CH3:1.0 CO:1 CH3CO (+ M) [=] CH3 + CO (+ M) 1.070000E+12 0.63 16900.000000 5.650000E+15 -0.97 14600.000000 0.629 8.73e+09 5.52 7.6e+07 CH3CO:1.0 CH3:1.0 CO:1 CH3CO (+ M) [=] CH2CO + H (+ M) 9.413000E+07 1.917 44987.200000 1.516000E+48 -10.27 55390.000000 0.6009 8.103e+09 667.7 5e+09 CH3CO:1.0 CH2CO:1.0 H:1 CH3CO + H [=] CH2CO + H2 2.000000E+10 0.0 0.000000 CH3CO:1.0 H:1 CH2CO:1.0 H2:1 CH3CO + O [=] CH2CO + OH 2.000000E+10 0.0 0.000000 CH3CO:1.0 O:1 CH2CO:1.0 OH:1 CH3CO + CH3 [=] CH2CO + CH4 5.000000E+10 0.0 0.000000 CH3CO:1.0 CH3:1 CH2CO:1.0 CH4:1 CH2 + CO (+ M) [=] CH2CO (+ M) 8.100000E+08 0.0 0.000000 2.690000E+27 -5.11 7095.000000 CH4:2.0 CO:1.5 CO2:2.0 H2:2.0 H2O:6.0 0.5907 275 1226 5185 CH2:1.0 CO:1 CH2CO:1.0 CH2CO + H [=] HCCO + H2 1.401000E+12 -0.171 8783.200000 CH2CO:1.0 H:1 HCCO:1.0 H2:1 CH2CO + O [=] HCCO + OH 1.000000E+10 0.0 8000.000000 CH2CO:1.0 O:1 HCCO:1.0 OH:1 CH2CO + OH [=] HCCO + H2O 1.000000E+10 0.0 2000.000000 CH2CO:1.0 OH:1 HCCO:1.0 H2O:1 CH2CO + H [=] CH3 + CO 7.704000E+10 -0.171 4183.200000 CH2CO:1.0 H:1 CH3:1.0 CO:1 CH + CH2O [=] H + CH2CO 9.460000E+10 0.0 -515.000000 CH:1.0 CH2O:1 H:1.0 CH2CO:1 CH2CO + O [=] CH2 + CO2 1.750000E+09 0.0 1350.000000 CH2CO:1.0 O:1 CH2:1.0 CO2:1 CH2CO + OH [=] CH2OH + CO 2.000000E+09 0.0 -1010.000000 CH2CO:1.0 OH:1 CH2OH:1.0 CO:1 CH2CO + CH3 [=] C2H5 + CO 4.769000E+01 2.312 9468.000000 CH2CO:1.0 CH3:1 C2H5:1.0 CO:1 HCCO + OH =] H2 + CO + CO 1.000000E+11 0.0 0.000000 HCCO:1.0 OH:1 H2:1.0 CO:2 HCCO + O =] H + CO + CO 8.000000E+10 0.0 0.000000 HCCO:1.0 O:1 H:1.0 CO:2 CH + CO + M [=] HCCO + M 7.570000E+16 -1.9 0.000000 CH:1.0 CO:1 HCCO:1.0 HCCO + O2 =] OH + CO + CO 1.910000E+08 -0.02 1020.000000 HCCO:1.0 O2:1 OH:1.0 CO:2 HCCO + O2 =] CO2 + CO + H 4.780000E+09 -0.142 1150.000000 HCCO:1.0 O2:1 CO2:1.0 CO:1 H:1 CH + HCCO [=] CO + C2H2 5.000000E+10 0.0 0.000000 CH:1.0 HCCO:1 CO:1.0 C2H2:1 CH3O + HCO [=] CH3OH + CO 9.000000E+10 0.0 0.000000 CH3O:1.0 HCO:1 CH3OH:1.0 CO:1 IC3H7 + H [=] C2H5 + CH3 2.000000E+10 0.0 0.000000 IC3H7:1.0 H:1 C2H5:1.0 CH3:1 IC3H7 + OH [=] C3H6 + H2O 2.410000E+10 0.0 0.000000 IC3H7:1.0 OH:1 C3H6:1.0 H2O:1 C2H3 + CH3 [=] C3H5-A + H 4.120000E+26 -4.95 8000.000000

0.01

4.860000E+27 -5.03 11300.000000

0.1

5.300000E+26 -4.57 14400.000000

1.0

1.320000E+27 -4.54 19300.000000

10.0

5.160000E+25 -4.03 23800.000000

100.0

C2H3:1.0 CH3:1 C3H5-A:1.0 H:1 C2H3 + CH3 [=] C3H5-A + H 5.730000E+12 -0.77 1195.900000

0.01

2.060000E+10 -0.074 1428.700000

0.1

4.480000E+07 0.6 1421.600000

1.0

4.100000E+03 1.71 1056.900000

10.0

1.370000E-04 3.91 -353.550000

100.0

C2H3:1.0 CH3:1 C3H5-A:1.0 H:1 C3H6 [=] C2H3 + CH3 1.880000E+78 -18.7 130000.000000

0.01

8.730000E+76 -17.9 132000.000000

0.1

5.800000E+75 -17.2 134000.000000

1.0

8.120000E+71 -15.8 136000.000000

10.0

2.150000E+64 -13.4 135000.000000

100.0

C3H6:1.0 C2H3:1.0 CH3:1 C3H6 [=] C3H5-A + H 9.160000E+74 -17.6 120000.000000

0.01

1.730000E+70 -16.0 120000.000000

0.1

1.080000E+71 -15.9 124860.000000

1.0

6.400000E+65 -14.2 125000.000000

10.0

8.050000E+56 -11.5 122000.000000

100.0

C3H6:1.0 C3H5-A:1.0 H:1 C3H6 [=] C3H5-A + H 2.980000E+54 -12.3 101200.000000

0.01

1.370000E+43 -8.87 96365.000000

0.1

6.280000E+42 -8.51 98004.000000

1.0

4.730000E+35 -6.26 95644.000000

10.0

4.340000E+28 -4.06 93114.000000

100.0

C3H6:1.0 C3H5-A:1.0 H:1 C3H6 + H [=] C3H5-A + H2 3.644000E+02 2.455 4361.200000 C3H6:1.0 H:1 C3H5-A:1.0 H2:1 C3H6 + O2 [=] C3H5-A + HO2 5.960000E+16 -1.67 46192.100000 C3H6:1.0 O2:1 C3H5-A:1.0 HO2:1 C3H6 + O [=] C3H5-A + OH 1.050000E+08 0.7 5884.000000 C3H6:1.0 O:1 C3H5-A:1.0 OH:1 C3H6 + OH [=] C3H5-A + H2O 7.430000E+02 2.072 1050.800000 C3H6:1.0 OH:1 C3H5-A:1.0 H2O:1 C3H6 + HO2 [=] C3H5-A + H2O2 3.070000E-05 4.403 13547.200000 C3H6:1.0 HO2:1 C3H5-A:1.0 H2O2:1 C3H6 + CH3 [=] C3H5-A + CH4 2.210000E-03 3.5 5675.000000 C3H6:1.0 CH3:1 C3H5-A:1.0 CH4:1 C3H6 + CH3O [=] C3H5-A + CH3OH 8.400000E+07 0.0 2600.000000 C3H6:1.0 CH3O:1 C3H5-A:1.0 CH3OH:1 C3H6 + H [=] C2H4 + CH3 1.540000E+06 1.35 2542.000000

0.0013

7.880000E+07 0.87 3599.600000

0.04

2.670000E+09 0.47 5431.100000

1.0

9.250000E+19 -2.6 12898.000000

10.0

1.320000E+20 -2.42 16500.000000

100.0

C3H6:1.0 H:1 C2H4:1.0 CH3:1 C3H6 + H [=] C2H4 + CH3 1.000000E-13 0.0 0.000000

0.0013

1.000000E-13 0.0 0.000000

0.04

1.000000E-13 0.0 0.000000

1.0

1.240000E+02 2.52 3679.100000

10.0

2.510000E+00 2.91 3980.900000

100.0

C3H6:1.0 H:1 C2H4:1.0 CH3:1 C3H6 + H [=] IC3H7 1.350000E+41 -10.68 8196.400000

0.0013

2.110000E+54 -14.23 15147.000000

0.04

3.260000E+58 -14.94 20161.000000

1.0

5.300000E+53 -13.12 20667.000000

10.0

1.110000E+47 -10.8 20202.000000

100.0

C3H6:1.0 H:1 IC3H7:1.0 C3H6 + H [=] IC3H7 2.170000E+127 -32.58 136140.000000

0.0013

2.250000E+26 -5.84 4241.900000

0.04

1.060000E+27 -5.63 5613.400000

1.0

6.110000E+23 -4.44 5182.300000

10.0

2.730000E+20 -3.26 4597.000000

100.0

C3H6:1.0 H:1 IC3H7:1.0 C3H6 + HO2 [=] IC3H7 + O2 1.020000E+04 1.16 10273.000000

0.013

1.310000E+17 -2.58 19078.000000

0.9869

4.140000E+25 -4.92 26212.000000

9.87

8.870000E+19 -3.09 26586.000000

98.69

C3H6:1.0 HO2:1 IC3H7:1.0 O2:1 C3H5-A + C2H5 [=] C2H4 + C3H6 4.000000E+08 0.0 0.000000 C3H5-A:1.0 C2H5:1 C2H4:1.0 C3H6:1 C3H5-A + HCO [=] C3H6 + CO 6.000000E+10 0.0 0.000000 C3H5-A:1.0 HCO:1 C3H6:1.0 CO:1 C3H5-A + O2 [=] CH3CO + CH2O 1.190000E+12 -1.01 20128.000000

1.0

7.140000E+12 -1.21 21046.000000

10.0

C3H5-A:1.0 O2:1 CH3CO:1.0 CH2O:1 C2H3 + CH2O [=] C2H4 + HCO 1.110000E+04 1.09 1807.200000

0.001

2.470000E+04 0.993 1994.900000

0.01

2.470000E+05 0.704 2596.200000

0.1

1.420000E+07 0.209 3934.200000

1.0

3.450000E+10 -0.726 6944.300000

10.0

3.310000E+11 -0.866 10965.700000

100.0

1.650000E-02 3.17 9399.800000

1000.0

C2H3:1.0 CH2O:1 C2H4:1.0 HCO:1 C2H2 + CH3 [=] C3H5-A 8.200000E+50 -13.32 33200.000000

0.1

2.680000E+50 -12.82 35730.000000

1.0

3.640000E+49 -12.46 36127.000000

2.0

1.040000E+48 -11.89 36476.000000

5.0

4.400000E+46 -11.4 36700.000000

10.0

3.800000E+41 -9.63 37600.000000

100.0

C2H2:1.0 CH3:1 C3H5-A:1.0 C3H5-A + CH3 (+ M) [=] C4H8-1 (+ M) 1.000000E+11 -0.32 -262.300000 3.910000E+54 -12.81 6250.000000 CH4:2.0 CO:1.5 CO2:2.0 H2:2.0 H2O:6.0 0.104 1606 60000 6118.4 C3H5-A:1.0 CH3:1 C4H8-1:1.0 C2H5 + C2H3 (+ M) [=] C4H8-1 (+ M) 1.500000E+10 0.0 0.000000 1.550000E+50 -11.79 8984.500000 CH4:2.0 CO:1.5 CO2:2.0 H2:2.0 H2O:6.0 0.198 2277.9 60000 5723.2 C2H5:1.0 C2H3:1 C4H8-1:1.0 C4H8-1 + H [=] C2H4 + C2H5 2.550000E+03 1.93 5564.000000

0.001

5.560000E+03 1.83 5802.000000

0.01

1.210000E+06 1.18 7472.000000

0.1

9.470000E+13 -1.03 13413.000000

1.0

4.500000E+25 -4.24 23618.000000

10.0

7.020000E+29 -5.22 31754.000000

100.0

C4H8-1:1.0 H:1 C2H4:1.0 C2H5:1 C4H8-1 + H [=] C2H4 + C2H5 3.450000E+04 1.81 2263.000000

0.001

8.060000E+04 1.71 2522.000000

0.01

1.180000E+07 1.1 4077.000000

0.1

6.020000E+12 -0.49 8452.000000

1.0

7.580000E+18 -2.14 14245.000000

10.0

2.290000E+18 -1.87 17243.000000

100.0

C4H8-1:1.0 H:1 C2H4:1.0 C2H5:1 C4H8-1 + H [=] C3H6 + CH3 7.830000E+06 1.17 1442.000000

0.001

3.390000E+07 1.0 1895.000000

0.01

3.700000E+10 0.14 4127.000000

0.1

4.570000E+16 -1.54 9061.000000

1.0

8.570000E+20 -2.66 14140.000000

10.0

1.320000E+17 -1.46 15383.000000

100.0

C4H8-1:1.0 H:1 C3H6:1.0 CH3:1 C4H8-1 + H [=] C3H6 + CH3 1.800000E+03 1.76 5900.000000

0.001

3.460000E+03 1.68 6100.000000

0.01

4.020000E+05 1.1 7574.000000

0.1

1.210000E+13 -0.99 13175.000000

1.0

7.140000E+24 -4.23 23319.000000

10.0

1.000000E+30 -5.49 31922.000000

100.0

C4H8-1:1.0 H:1 C3H6:1.0 CH3:1 C4H8-1 + O =] CH2CO + C2H5 + H 3.050000E+03 1.88 183.000000 C4H8-1:1.0 O:1 CH2CO:1.0 C2H5:1 H:1 C2H5 + O [=] CH3CHO + H 1.100000E+11 0.0 0.000000 C2H5:1.0 O:1 CH3CHO:1.0 H:1 C2H5 + O2 [=] CH3CHO + OH 4.908000E-09 4.76 254.300000

0.04

6.803000E-05 3.57 2643.000000

1.0

8.265000E-01 2.41 5285.000000

10.0

C2H5:1.0 O2:1 CH3CHO:1.0 OH:1 CH3CHO (+ M) [=] CH3 + HCO (+ M) 2.450000E+22 -1.74 86355.000000 1.030000E+56 -11.3 95912.500000 0.00249 718.1 6.089 3780 CH3CHO:1.0 CH3:1.0 HCO:1 CH3CHO (+ M) [=] CH4 + CO (+ M) 2.720000E+21 -1.74 86355.000000 1.144000E+55 -11.3 95912.500000 0.00249 718.1 6.089 3780 CH3CHO:1.0 CH4:1.0 CO:1 CH3CHO + H [=] CH3CO + H2 6.550000E+01 2.58 1220.000000 CH3CHO:1.0 H:1 CH3CO:1.0 H2:1 CH3CHO + O [=] CH3CO + OH 5.940000E+09 0.0 1868.000000 CH3CHO:1.0 O:1 CH3CO:1.0 OH:1 CH3CHO + OH [=] CH3CO + H2O 3.370000E+09 0.0 -619.000000 CH3CHO:1.0 OH:1 CH3CO:1.0 H2O:1 CH3CHO + O2 [=] CH3CO + HO2 3.010000E+10 0.0 39150.000000 CH3CHO:1.0 O2:1 CH3CO:1.0 HO2:1 CH3CHO + CH3 [=] CH3CO + CH4 7.080000E-07 4.58 1966.000000 CH3CHO:1.0 CH3:1 CH3CO:1.0 CH4:1 CH3CHO + HO2 [=] CH3CO + H2O2 3.010000E+09 0.0 11920.000000 CH3CHO:1.0 HO2:1 CH3CO:1.0 H2O2:1 C2H4 + OH [=] CH3CHO + H 2.370000E-10 5.3 -2050.600000

0.01

8.730000E-08 4.57 -618.000000

0.025

4.030000E-04 3.54 1881.700000

0.1

2.380000E-05 3.91 1722.700000

1.0

8.250000E+05 1.01 10507.300000

10.0

6.800000E+06 0.81 13867.300000

100.0

C2H4:1.0 OH:1 CH3CHO:1.0 H:1 C2H5OH [=] C2H4 + H2O 3.410000E+59 -14.2 83672.600000

0.001

2.620000E+57 -13.3 85262.200000

0.01

1.650000E+52 -11.5 84745.600000

0.1

5.230000E+43 -8.9 81506.700000

1.0

4.590000E+32 -5.6 76062.400000

10.0

3.840000E+20 -2.06 69465.500000

100.0

C2H5OH:1.0 C2H4:1.0 H2O:1 C2H5OH [=] C2H5 + OH 8.100000E+46 -11.3 111053.400000

0.001

1.860000E+56 -13.5 107238.400000

0.01

4.650000E+63 -15.0 109622.800000

0.1

4.460000E+65 -14.9 112345.000000

1.0

2.790000E+61 -13.4 113080.200000

10.0

6.170000E+51 -10.3 109940.700000

100.0

C2H5OH:1.0 C2H5:1.0 OH:1 C2H5OH + O2 [=] SC2H4OH + HO2 1.500000E+10 0.0 50150.000000 C2H5OH:1.0 O2:1 SC2H4OH:1.0 HO2:1 C2H5OH + H [=] SC2H4OH + H2 8.790000E+00 2.68 2910.000000 C2H5OH:1.0 H:1 SC2H4OH:1.0 H2:1 C2H5OH + OH [=] SC2H4OH + H2O 7.520000E+01 2.49 -1474.000000 C2H5OH:1.0 OH:1 SC2H4OH:1.0 H2O:1 C2H5OH + HO2 [=] SC2H4OH + H2O2 7.000000E-08 5.26 7475.100000 C2H5OH:1.0 HO2:1 SC2H4OH:1.0 H2O2:1 C2H5OH + O [=] SC2H4OH + OH 1.450000E+02 2.47 876.000000 C2H5OH:1.0 O:1 SC2H4OH:1.0 OH:1 C2H5OH + CH3 [=] SC2H4OH + CH4 1.993000E-02 3.37 7634.000000 C2H5OH:1.0 CH3:1 SC2H4OH:1.0 CH4:1 SC2H4OH [=] CH3CHO + H 5.690000E+52 -13.38 45049.000000

0.001

3.290000E+56 -14.12 48129.000000

0.01

8.580000E+57 -14.16 50743.000000

0.1

5.360000E+55 -13.15 51886.000000

1.0

1.660000E+48 -10.64 50297.000000

10.0

8.260000E+44 -9.59 49218.000000

20.0

1.010000E+40 -8.06 47439.000000

50.0

1.100000E+36 -6.84 45899.000000

100.0

SC2H4OH:1.0 CH3CHO:1.0 H:1 SC2H4OH + O2 [=] CH3CHO + HO2 5.260000E+14 -1.637 838.000000

0.01

5.260000E+14 -1.637 838.000000

0.1

5.280000E+14 -1.638 839.000000

1.0

1.540000E+15 -1.771 1120.000000

10.0

3.780000E+17 -2.429 3090.000000

100.0

SC2H4OH:1.0 O2:1 CH3CHO:1.0 HO2:1