O H C N Ar He
AR N2 HE H O
OH HO2 H2 H2O H2O2
O2 C CH CH2 CH2*
CH3 CH4 HCO CH2O CH3O
CH2OH CH3OH CO CO2 C2O
C2H C2H2 H2CC C2H3 C2H4
C2H5 C2H6 HCCO HCCOH CH2CO
CH3CO CH2CHO CH2OCH CH3CHO CH2OCH2
C3H3 pC3H4 aC3H4 cC3H4 aC3H5
CH3CCH2 CH3CHCH C3H6 nC3H7 iC3H7
C3H8 CH2CHCO C2H3CHO CH3CHOCH2 CH3CH2CHO
CH3COCH3 C4H2 nC4H3 iC4H3 C4H4
nC4H5 iC4H5 C4H5-2 c-C4H5 C4H6
C4H612 C4H6-2 C4H7 iC4H7 C4H81
C4H82 iC4H8 pC4H9 sC4H9 iC4H9
tC4H9 C4H10 iC4H10 H2C4O C4H4O
CH2CHCHCHO CH3CHCHCO C2H3CHOCH2 C4H6O23 CH3CHCHCHO
C4H6O25 C5H4O C5H5O(1,3) C5H5O(2,4) C5H4OH
C5H5OH C5H5 C5H6 lC5H7 cC5H9
cC5H8 C6H2 C6H3 l-C6H4 o-C6H4
C6H5 C6H6 C6H5CH2 C6H5CH3 C6H5C2H
C6H5O C6H5OH C6H4O2 C6H5CO C6H5CHO
C6H5CH2OH OC6H4CH3 HOC6H4CH3 C6H4CH3 NC12H26
NC10H22 NC9H20 NC8H18 NC7H16 NC6H14
C6H12 NC5H12 C5H10 NO HNO
NO2
HONO NH3 NH2 NH NNH
N2O N HCN H2CN CN
NCO HOCN HNCO CH3CN
300.0
101325.0
Ar:1
120186
2.500000000E+00, 0.000000000E+00, 0.000000000E+00, 0.000000000E+00,
0.000000000E+00, -7.453750000E+02, 4.366000000E+00
2.500000000E+00, 0.000000000E+00, 0.000000000E+00, 0.000000000E+00,
0.000000000E+00, -7.453750000E+02, 4.366000000E+00
atom
136.500
3.330
0.000
0.000
0.000
N:2
121286
3.298677000E+00, 1.408240400E-03, -3.963222000E-06, 5.641515000E-09,
-2.444854000E-12, -1.020899900E+03, 3.950372000E+00
2.926640000E+00, 1.487976800E-03, -5.684760000E-07, 1.009703800E-10,
-6.753351000E-15, -9.227977000E+02, 5.980528000E+00
linear
97.530
3.621
0.000
1.760
4.000
He:1
L10/90
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
H:1
L7/88
2.500000000E+00, 7.053328190E-13, -1.995919640E-15, 2.300816320E-18,
-9.277323320E-22, 2.547365990E+04, -4.466828530E-01
2.500000010E+00, -2.308429730E-11, 1.615619480E-14, -4.735152350E-18,
4.981973570E-22, 2.547365990E+04, -4.466829140E-01
atom
145.000
2.050
0.000
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
2.569420780E+00, -8.597411370E-05, 4.194845890E-08, -1.001777990E-11,
1.228336910E-15, 2.921757910E+04, 4.784338640E+00
atom
80.000
2.750
0.000
0.000
0.000
H:1 O:1
S9/01
4.125305610E+00, -3.225449390E-03, 6.527646910E-06, -5.798536430E-09,
2.062373790E-12, 3.381538120E+03, -6.904329600E-01
2.864728860E+00, 1.056504480E-03, -2.590827580E-07, 3.052186740E-11,
-1.331958760E-15, 3.718857740E+03, 5.701640730E+00
linear
80.000
2.750
0.000
0.000
0.000
H:1 O:2
L5/89
4.301798010E+00, -4.749120510E-03, 2.115828910E-05, -2.427638940E-08,
9.292251240E-12, 2.948080400E+02, 3.716662450E+00
4.017210900E+00, 2.239820130E-03, -6.336581500E-07, 1.142463700E-10,
-1.079085350E-14, 1.118567130E+02, 3.785102150E+00
nonlinear
107.400
3.458
0.000
0.000
1.000
H:2
TPIS78
2.344331120E+00, 7.980520750E-03, -1.947815100E-05, 2.015720940E-08,
-7.376117610E-12, -9.179351730E+02, 6.830102380E-01
3.337279200E+00, -4.940247310E-05, 4.994567780E-07, -1.795663940E-10,
2.002553760E-14, -9.501589220E+02, -3.205023310E+00
linear
38.000
2.920
0.000
0.790
280.000
H:2 O:1
L8/89
4.198640560E+00, -2.036434100E-03, 6.520402110E-06, -5.487970620E-09,
1.771978170E-12, -3.029372670E+04, -8.490322080E-01
3.033992490E+00, 2.176918040E-03, -1.640725180E-07, -9.704198700E-11,
1.682009920E-14, -3.000429710E+04, 4.966770100E+00
nonlinear
572.400
2.605
1.844
0.000
4.000
H:2 O:2
L7/88
4.276112690E+00, -5.428224170E-04, 1.673357010E-05, -2.157708130E-08,
8.624543630E-12, -1.770258210E+04, 3.435050740E+00
4.165002850E+00, 4.908316940E-03, -1.901392250E-06, 3.711859860E-10,
-2.879083050E-14, -1.786178770E+04, 2.916156620E+00
nonlinear
107.400
3.458
0.000
0.000
3.800
O:2
TPIS89
3.782456360E+00, -2.996734160E-03, 9.847302010E-06, -9.681295090E-09,
3.243728370E-12, -1.063943560E+03, 3.657675730E+00
3.282537840E+00, 1.483087540E-03, -7.579666690E-07, 2.094705550E-10,
-2.167177940E-14, -1.088457720E+03, 5.453231290E+00
linear
107.400
3.458
0.000
1.600
3.800
C:1
L11/88
2.554239550E+00, -3.215377240E-04, 7.337922450E-07, -7.322348890E-10,
2.665214460E-13, 8.544388320E+04, 4.531308480E+00
2.492668880E+00, 4.798892840E-05, -7.243350200E-08, 3.742910290E-11,
-4.872778930E-15, 8.545129530E+04, 4.801503730E+00
atom
71.400
3.298
0.000
0.000
0.000
H:1 C:1
TPIS79
3.489816650E+00, 3.238355410E-04, -1.688990650E-06, 3.162173270E-09,
-1.406090670E-12, 7.079729340E+04, 2.084011080E+00
2.878464730E+00, 9.709136810E-04, 1.444456550E-07, -1.306878490E-10,
1.760793830E-14, 7.101243640E+04, 5.484979990E+00
linear
80.000
2.750
0.000
0.000
0.000
H:2 C:1
LS/93
3.762678670E+00, 9.688721430E-04, 2.794898410E-06, -3.850911530E-09,
1.687417190E-12, 4.600404010E+04, 1.562531850E+00
2.874101130E+00, 3.656392920E-03, -1.408945970E-06, 2.601795490E-10,
-1.877275670E-14, 4.626360400E+04, 6.171193240E+00
linear
144.000
3.800
0.000
0.000
0.000
H:2 C:1
LS/93
4.198604110E+00, -2.366614190E-03, 8.232962200E-06, -6.688159810E-09,
1.943147370E-12, 5.049681630E+04, -7.691189670E-01
2.292038420E+00, 4.655886370E-03, -2.011919470E-06, 4.179060000E-10,
-3.397163650E-14, 5.092599970E+04, 8.626501690E+00
linear
144.000
3.800
0.000
0.000
0.000
H:3 C:1
L11/89
3.673590400E+00, 2.010951750E-03, 5.730218560E-06, -6.871174250E-09,
2.543857340E-12, 1.644499880E+04, 1.604564330E+00
2.285717720E+00, 7.239900370E-03, -2.987143480E-06, 5.956846440E-10,
-4.671543940E-14, 1.677558430E+04, 8.480071790E+00
linear
144.000
3.800
0.000
0.000
0.000
H:4 C:1
L8/88
5.149876130E+00, -1.367097880E-02, 4.918005990E-05, -4.847430260E-08,
1.666939560E-11, -1.024664760E+04, -4.641303760E+00
7.485149500E-02, 1.339094670E-02, -5.732858090E-06, 1.222925350E-09,
-1.018152300E-13, -9.468344590E+03, 1.843731800E+01
nonlinear
141.400
3.746
0.000
2.600
13.000
H:1 C:1 O:1
L12/89
4.221185840E+00, -3.243925320E-03, 1.377994460E-05, -1.331440930E-08,
4.337688650E-12, 3.839564960E+03, 3.394372430E+00
2.772174380E+00, 4.956955260E-03, -2.484456130E-06, 5.891617780E-10,
-5.335087110E-14, 4.011918150E+03, 9.798344920E+00
nonlinear
498.000
3.590
0.000
0.000
0.000
H:2 C:1 O:1
L8/88
4.793723150E+00, -9.908333690E-03, 3.732200080E-05, -3.792852610E-08,
1.317726520E-11, -1.430895670E+04, 6.028129000E-01
1.760690080E+00, 9.200000820E-03, -4.422588130E-06, 1.006412120E-09,
-8.838556400E-14, -1.399583230E+04, 1.365632300E+01
nonlinear
498.000
3.590
0.000
0.000
2.000
H:3 C:1 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
H:3 C:1 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
H:4 C:1 O:1
L8/88
5.715395820E+00, -1.523091290E-02, 6.524411550E-05, -7.108068890E-08,
2.613526980E-11, -2.564276560E+04, -1.504098230E+00
1.789707910E+00, 1.409382920E-02, -6.365008350E-06, 1.381710850E-09,
-1.170602200E-13, -2.537487470E+04, 1.450236230E+01
nonlinear
481.800
3.626
0.000
0.000
1.000
C:1 O:1
TPIS79
3.579533470E+00, -6.103536800E-04, 1.016814330E-06, 9.070058840E-10,
-9.044244990E-13, -1.434408600E+04, 3.508409280E+00
2.715185610E+00, 2.062527430E-03, -9.988257710E-07, 2.300530080E-10,
-2.036477160E-14, -1.415187240E+04, 7.818687720E+00
linear
98.100
3.650
0.000
1.950
1.800
C:1 O:2
L7/88
2.356773520E+00, 8.984596770E-03, -7.123562690E-06, 2.459190220E-09,
-1.436995480E-13, -4.837196970E+04, 9.901052220E+00
3.857460290E+00, 4.414370260E-03, -2.214814040E-06, 5.234901880E-10,
-4.720841640E-14, -4.875916600E+04, 2.271638060E+00
linear
244.000
3.763
0.000
2.650
2.100
C:2 O:1
RUS79
2.864861000E+00, 1.199021600E-02, -1.836244800E-05, 1.576973900E-08,
-5.389745200E-12, 3.374993200E+04, 8.886777200E+00
5.151272200E+00, 2.372672200E-03, -7.613597100E-07, 1.170641500E-10,
-7.025780400E-15, 3.324188800E+04, -2.218313500E+00
linear
232.400
3.828
0.000
0.000
1.000
H:1 C:2
L1/91
2.889657330E+00, 1.340996110E-02, -2.847695010E-05, 2.947910450E-08,
-1.093315110E-11, 6.683939320E+04, 6.222964380E+00
3.167806520E+00, 4.752219020E-03, -1.837870770E-06, 3.041902520E-10,
-1.772327700E-14, 6.712106500E+04, 6.635894750E+00
linear
209.000
4.100
0.000
0.000
2.500
H:2 C:2
L1/91
8.086810940E-01, 2.336156290E-02, -3.551718150E-05, 2.801524370E-08,
-8.500729740E-12, 2.642898070E+04, 1.393970510E+01
4.147569640E+00, 5.961666640E-03, -2.372948520E-06, 4.674121710E-10,
-3.612352130E-14, 2.593599920E+04, -1.230281210E+00
linear
209.000
4.100
0.000
0.000
2.500
H:2 C:2
L12/89
3.281548300E+00, 6.976479100E-03, -2.385524400E-06, -1.210443200E-09,
9.818954500E-13, 4.862179400E+04, 5.920391000E+00
4.278034000E+00, 4.756280400E-03, -1.630100900E-06, 2.546280600E-10,
-1.488637900E-14, 4.831668800E+04, 6.402370100E-01
nonlinear
209.000
4.100
0.000
0.000
2.500
H:3 C:2
L2/92
3.212466450E+00, 1.514791620E-03, 2.592094120E-05, -3.576578470E-08,
1.471508730E-11, 3.485984680E+04, 8.510540250E+00
3.016724000E+00, 1.033022920E-02, -4.680823490E-06, 1.017632880E-09,
-8.626070410E-14, 3.461287390E+04, 7.787323780E+00
nonlinear
209.000
4.100
0.000
0.000
1.000
H:4 C:2
L1/91
3.959201480E+00, -7.570522470E-03, 5.709902920E-05, -6.915887530E-08,
2.698843730E-11, 5.089775930E+03, 4.097330960E+00
2.036111160E+00, 1.464541510E-02, -6.710779150E-06, 1.472229230E-09,
-1.257060610E-13, 4.939886140E+03, 1.030536930E+01
nonlinear
280.800
3.971
0.000
0.000
1.500
H:5 C:2
L12/92
4.306465680E+00, -4.186588920E-03, 4.971428070E-05, -5.991266060E-08,
2.305090040E-11, 1.284162650E+04, 4.707209240E+00
1.954656420E+00, 1.739727220E-02, -7.982066680E-06, 1.752176890E-09,
-1.496415760E-13, 1.285752000E+04, 1.346243430E+01
nonlinear
252.300
4.302
0.000
0.000
1.500
H:6 C:2
L8/88
4.291424920E+00, -5.501542700E-03, 5.994382880E-05, -7.084662850E-08,
2.686857710E-11, -1.152220550E+04, 2.666823160E+00
1.071881500E+00, 2.168526770E-02, -1.002560670E-05, 2.214120010E-09,
-1.900028900E-13, -1.142639320E+04, 1.511561070E+01
nonlinear
252.300
4.302
0.000
0.000
1.500
H:1 C:2 O:1
SRIC91
2.251721400E+00, 1.765502100E-02, -2.372910100E-05, 1.727575900E-08,
-5.066481100E-12, 2.005944900E+04, 1.249041700E+01
5.628205800E+00, 4.085340100E-03, -1.593454700E-06, 2.862605200E-10,
-1.940783200E-14, 1.932721500E+04, -3.930259500E+00
nonlinear
150.000
2.500
0.000
0.000
1.000
H:2 C:2 O:1
SRI91
1.242373300E+00, 3.107220100E-02, -5.086686400E-05, 4.313713100E-08,
-1.401459400E-11, 8.031614300E+03, 1.387431900E+01
5.923829100E+00, 6.792360000E-03, -2.565856400E-06, 4.498784100E-10,
-2.994010100E-14, 7.264626000E+03, -7.601774200E+00
nonlinear
436.000
3.970
0.000
0.000
2.000
H:2 C:2 O:1
D05/90
2.135836300E+00, 1.811887210E-02, -1.739474740E-05, 9.343975680E-09,
-2.014576150E-12, -7.270000000E+03, 1.221564800E+01
4.511297320E+00, 9.003597450E-03, -4.169396350E-06, 9.233458820E-10,
-7.948382010E-14, -7.778500000E+03, 6.322472050E-01
nonlinear
436.000
3.970
0.000
0.000
2.000
H:3 C:2 O:1
T9/92
4.163425700E+00, -2.326161000E-04, 3.426782000E-05, -4.410522700E-08,
1.727561200E-11, -2.657452900E+03, 7.346828000E+00
5.944773100E+00, 7.866720500E-03, -2.886588200E-06, 4.727087500E-10,
-2.859986100E-14, -3.787307500E+03, -5.013675100E+00
nonlinear
436.000
3.970
0.000
0.000
2.000
H:3 C:2 O:1
D05/83
3.409062400E+00, 1.073857400E-02, 1.891492500E-06, -7.158583100E-09,
2.867385100E-12, 6.200000000E+01, 9.571453500E+00
5.975669900E+00, 8.130591400E-03, -2.743624500E-06, 4.070304100E-10,
-2.176017100E-14, -9.695000000E+02, -5.032087900E+00
nonlinear
436.000
3.970
0.000
0.000
2.000
H:3 C:2 O:1
A12/04
-3.839608400E-01, 2.387903800E-02, -1.246758700E-05, -1.768641100E-09,
2.814243800E-12, 1.883620300E+04, 2.574174500E+01
4.499405400E+00, 1.155262500E-02, -4.814412900E-06, 8.923491900E-10,
-5.687058500E-14, 1.747396300E+04, 3.392551500E-01
linear
252.000
4.760
0.000
0.000
1.000
H:4 C:2 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
H:4 C:2 O:1
T6/92
3.759053200E+00, -9.441218000E-03, 8.030972100E-05, -1.008078800E-07,
4.003992100E-11, -7.560814300E+03, 7.849747500E+00
5.488764100E+00, 1.204619000E-02, -4.333693100E-06, 7.002831100E-10,
-4.194908800E-14, -9.180425100E+03, -7.079960500E+00
linear
252.000
4.760
0.000
0.000
1.000
H:3 C:3
T5/97
1.351109270E+00, 3.274112230E-02, -4.738271350E-05, 3.763098080E-08,
-1.185409230E-11, 4.010577830E+04, 1.520589240E+01
7.142218800E+00, 7.619020050E-03, -2.674599500E-06, 4.249148010E-10,
-2.514754150E-14, 3.890874270E+04, -1.258484360E+01
nonlinear
252.000
4.760
0.000
0.000
1.000
H:4 C:3
T2/90
2.680386900E+00, 1.579965100E-02, 2.507059600E-06, -1.365762300E-08,
6.615428500E-12, 2.080237400E+04, 9.876935100E+00
6.025240000E+00, 1.133654200E-02, -4.022339100E-06, 6.437606300E-10,
-3.829963500E-14, 1.962094200E+04, -8.604378500E+00
linear
252.000
4.760
0.000
0.000
1.000
H:4 C:3
L8/89
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
252.000
4.760
0.000
0.000
1.000
H:4 C:3
T12/81
-2.462104700E-02, 2.319721500E-02, -1.847435700E-06, -1.592759300E-08,
8.684615500E-12, 3.233413700E+04, 2.272976200E+01
6.699993100E+00, 1.035737200E-02, -3.455116700E-06, 5.065294900E-10,
-2.668227600E-14, 3.019905100E+04, -1.337877000E+01
linear
252.000
4.760
0.000
0.000
1.000
H:5 C:3
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
266.800
4.982
0.000
0.000
1.000
H:5 C:3
PD5/98
1.732920900E+00, 2.239462000E-02, -5.149061100E-06, -6.759646600E-09,
3.825321100E-12, 2.904049800E+04, 1.656887800E+01
5.425552800E+00, 1.551107200E-02, -5.667835000E-06, 7.922438800E-10,
-1.687803400E-14, 2.784302700E+04, -3.352718400E+00
nonlinear
266.800
4.982
0.000
0.000
1.000
H:5 C:3
PD5/98
9.137293100E-01, 2.643234300E-02, -1.175895000E-05, -2.303567800E-09,
2.771548800E-12, 3.091686700E+04, 1.998926900E+01
5.372528100E+00, 1.578050900E-02, -5.992285000E-06, 9.308966400E-10,
-3.655096600E-14, 2.961476000E+04, -3.418647800E+00
nonlinear
266.800
4.982
0.000
0.000
1.000
H:6 C:3
120186
1.493307000E+00, 2.092518000E-02, 4.486794000E-06, -1.668912000E-08,
7.158146000E-12, 1.074826000E+03, 1.614534000E+01
6.732257000E+00, 1.490834000E-02, -4.949899000E-06, 7.212022000E-10,
-3.766204000E-14, -9.235703000E+02, -1.331335000E+01
nonlinear
266.800
4.982
0.000
0.000
1.000
H:7 C:3
P11/94
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
266.800
4.982
0.000
0.000
1.000
H:7 C:3
P11/94
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
266.800
4.982
0.000
0.000
1.000
H:8 C:3
P11/94
9.285109300E-01, 2.646056600E-02, 6.033244600E-06, -2.191495300E-08,
9.496154400E-12, -1.405790700E+04, 1.922553800E+01
7.524415200E+00, 1.889828200E-02, -6.292104100E-06, 9.216145700E-10,
-4.868447800E-14, -1.656439400E+04, -1.783837500E+01
nonlinear
266.800
4.982
0.000
0.000
1.000
H:3 C:3 O:1
T05/99
3.211694670E+00, 1.184221050E-02, 1.674625820E-05, -3.069471760E-08,
1.330488160E-11, 7.128157500E+03, 1.008816630E+01
6.958422270E+00, 1.071932110E-02, -3.852184940E-06, 6.220090640E-10,
-3.724016400E-14, 5.648264980E+03, -1.147457860E+01
linear
357.000
5.180
0.000
0.000
1.000
H:4 C:3 O:1
USC/07
1.271349800E+00, 2.623105400E-02, -9.291230500E-06, -4.783727200E-09,
3.348054300E-12, -9.335734400E+03, 1.949807700E+01
5.811186800E+00, 1.711425600E-02, -7.483416100E-06, 1.425224900E-09,
-9.174684100E-14, -1.078405400E+04, -4.858800400E+00
nonlinear
357.000
5.176
0.000
0.000
1.000
H:6 C:3 O:1
T6/92
4.873383600E-01, 2.851969000E-02, 3.009616200E-06, -2.265264200E-08,
1.070672800E-11, -1.255643400E+04, 2.260527000E+01
8.690055800E+00, 1.602098700E-02, -5.397175300E-06, 7.994154200E-10,
-4.265636600E-14, -1.542069100E+04, -2.248501600E+01
nonlinear
357.000
5.180
0.000
0.000
1.000
H:6 C:3 O:1
USC/07
2.725567600E+00, 2.323600500E-02, 2.974065600E-06, -1.661341500E-08,
7.425010300E-12, -2.455671100E+04, 1.416627700E+01
6.263741000E+00, 1.997626000E-02, -7.619514700E-06, 1.168711800E-09,
-4.195999300E-14, -2.588595300E+04, -5.778649800E+00
linear
252.000
4.760
0.000
0.000
1.000
H:6 C:3 O:1
T5/92
5.555794300E+00, -2.836542800E-03, 7.056894500E-05, -8.781048800E-08,
3.402826600E-11, -2.811333700E+04, 2.322660000E+00
7.297599100E+00, 1.756620700E-02, -6.317045600E-06, 1.020308600E-09,
-6.109401600E-14, -2.981768000E+04, -1.275698100E+01
nonlinear
357.000
5.176
0.000
0.000
1.000
H:2 C:4
D11/99
1.054397800E+00, 4.162696000E-02, -6.587178400E-05, 5.325707500E-08,
-1.668316200E-11, 5.418521100E+04, 1.486659100E+01
9.157632800E+00, 5.543051800E-03, -1.359160400E-06, 1.878007500E-11,
2.318953600E-14, 5.258803900E+04, -2.371146000E+01
linear
357.000
5.180
0.000
0.000
1.000
H:3 C:4
USC/07
8.166768600E-01, 3.871620100E-02, -4.804565100E-05, 3.206680800E-08,
-8.562821500E-12, 6.445575400E+04, 1.974050300E+01
7.804571600E+00, 1.071236400E-02, -4.193912400E-06, 7.044627700E-10,
-3.627132600E-14, 6.298780500E+04, -1.412974100E+01
nonlinear
357.000
5.180
0.000
0.000
1.000
H:3 C:4
USC/07
3.722148200E+00, 2.595754300E-02, -2.635634300E-05, 1.550892000E-08,
-3.804056500E-12, 5.883712100E+04, 7.563724500E+00
7.653854800E+00, 1.120405500E-02, -4.640134200E-06, 8.678663900E-10,
-5.743056200E-14, 5.795436300E+04, -1.175647600E+01
nonlinear
357.000
5.180
0.000
0.000
1.000
H:4 C:4
USC/07
5.885704800E-01, 3.654668500E-02, -3.410696800E-05, 1.665261900E-08,
-3.006462300E-12, 3.335949200E+04, 2.065788100E+01
7.253960100E+00, 1.391409400E-02, -5.293221400E-06, 8.348045000E-10,
-3.519788200E-14, 3.176601600E+04, -1.262952100E+01
nonlinear
357.000
5.180
0.000
0.000
1.000
H:5 C:4
USC/07
2.261129000E-01, 3.674237100E-02, -2.212047400E-05, 1.439013800E-09,
2.643580900E-12, 4.242841000E+04, 2.406640100E+01
7.408729100E+00, 1.775274800E-02, -7.560150600E-06, 1.420379500E-09,
-9.110018200E-14, 4.043876200E+04, -1.315002700E+01
nonlinear
357.000
5.180
0.000
0.000
1.000
H:5 C:4
USC/07
1.130810500E-01, 4.095061500E-02, -3.541358100E-05, 1.553096900E-08,
-2.335512200E-12, 3.638337100E+04, 2.369245700E+01
6.964602900E+00, 1.827433300E-02, -7.813373500E-06, 1.529215400E-09,
-1.092049300E-13, 3.472509800E+04, -1.064932100E+01
nonlinear
357.000
5.180
0.000
0.000
1.000
H:5 C:4
H6W/94
2.969628000E+00, 2.444224500E-02, -9.125142400E-06, -4.246687100E-18,
1.630472800E-21, 3.550331600E+04, 1.203605100E+01
1.453817100E+01, -8.567705600E-03, 2.355952400E-05, -1.367637900E-08,
2.443692700E-12, 3.325909500E+04, -4.536949700E+01
nonlinear
357.000
5.180
0.000
0.000
1.000
H:5 C:4
PUPM3
-2.639759300E+00, 4.154915700E-02, -2.192095400E-05, -4.655901400E-09,
6.134889000E-12, 3.537382800E+04, 3.570179700E+01
6.746715500E+00, 1.728300000E-02, -6.516857900E-06, 9.891757400E-10,
-3.460490800E-14, 3.280835900E+04, -1.291288000E+01
nonlinear
329.000
5.100
0.000
0.000
1.000
H:6 C:4
H6W/94
1.128446500E-01, 3.436902200E-02, -1.110739200E-05, -9.210666000E-09,
6.206517900E-12, 1.180227000E+04, 2.308999600E+01
8.867313400E+00, 1.491867000E-02, -3.154871600E-06, -4.184133000E-10,
1.576125800E-13, 9.133851600E+03, -2.332817100E+01
nonlinear
357.000
5.180
0.000
0.000
1.000
H:6 C:4
A8/83
1.023467000E+00, 3.495919000E-02, -2.200905000E-05, 6.942272000E-09,
-7.879187000E-13, 1.811799000E+04, 1.975066000E+01
1.781557000E+01, -4.257502000E-03, 1.051185000E-05, -4.473844000E-09,
5.848138000E-13, 1.267342000E+04, -6.982662000E+01
nonlinear
357.000
5.180
0.000
0.000
1.000
H:6 C:4
A8/83
2.137333800E+00, 2.648622900E-02, -9.056871100E-06, -5.538639700E-19,
2.128188400E-22, 1.571090200E+04, 1.352942600E+01
9.033813300E+00, 8.212451000E-03, 7.175395200E-06, -5.883433400E-09,
1.034391500E-12, 1.433506800E+04, -2.098576200E+01
nonlinear
357.000
5.180
0.000
0.000
1.000
H:7 C:4
USC/07
7.444943200E-01, 3.967885700E-02, -2.289808600E-05, 2.135297300E-09,
2.309637500E-12, 2.265332800E+04, 2.343787800E+01
7.013483500E+00, 2.263455800E-02, -9.254547000E-06, 1.680792700E-09,
-1.040861700E-13, 2.095500800E+04, -8.889308000E+00
nonlinear
357.000
5.176
0.000
0.000
1.000
H:7 C:4
USC/07
-1.037589000E+00, 4.556666700E-02, -3.047623100E-05, 7.110256800E-09,
9.968572200E-13, 1.489645800E+04, 2.986366300E+01
7.148593900E+00, 2.218967100E-02, -8.440017200E-06, 1.313335300E-09,
-5.161792700E-14, 1.271229400E+04, -1.213118300E+01
nonlinear
357.000
5.176
0.000
0.000
1.000
H:8 C:4
T6/83
1.181138000E+00, 3.085338000E-02, 5.086524700E-06, -2.465488800E-08,
1.111019300E-11, -1.790400400E+03, 2.106246900E+01
2.053584100E+00, 3.435050700E-02, -1.588319700E-05, 3.308966200E-09,
-2.536104500E-13, -2.139723100E+03, 1.554320100E+01
nonlinear
357.000
5.176
0.000
0.000
1.000
H:8 C:4
T6/83
1.259425200E+00, 2.780842400E-02, 8.701393200E-06, -2.440220500E-08,
9.897771000E-12, -2.964774200E+03, 2.050112900E+01
8.279767600E-01, 3.586453900E-02, -1.663449800E-05, 3.473275900E-09,
-2.665739800E-13, -3.052103300E+03, 2.134254500E+01
nonlinear
357.000
5.176
0.000
0.000
1.000
H:8 C:4
T6/83
2.647140500E+00, 2.590295700E-02, 8.198535400E-06, -2.219325900E-08,
8.895858000E-12, -4.037306900E+03, 1.267638800E+01
4.460947000E+00, 2.961148700E-02, -1.307712900E-05, 2.657193400E-09,
-2.013471300E-13, -5.006675800E+03, 1.067154900E+00
nonlinear
357.000
5.176
0.000
0.000
1.000
H:9 C:4
USC/07
1.208704200E+00, 3.829749700E-02, -7.266050900E-06, -1.542854700E-08,
8.685943500E-12, 7.322104000E+03, 2.216926800E+01
8.682239500E+00, 2.369107100E-02, -7.594886500E-06, 6.642713600E-10,
5.484513600E-14, 4.964405800E+03, -1.789174700E+01
nonlinear
357.000
5.176
0.000
0.000
1.000
H:9 C:4
P11/94
6.942842300E-01, 3.311334600E-02, 6.294257700E-06, -2.702527400E-08,
1.198931500E-11, 6.417565400E+03, 2.627978900E+01
9.426383900E+00, 2.191899800E-02, -7.286837500E-06, 1.063033400E-09,
-5.564946400E-14, 3.196587400E+03, -2.240605100E+01
nonlinear
357.000
5.176
0.000
0.000
1.000
H:9 C:4
USC/07
9.752786200E-01, 4.161379900E-02, -1.446733100E-05, -9.385239300E-09,
6.879737700E-12, 6.668826700E+03, 2.127758200E+01
8.498172800E+00, 2.468953800E-02, -8.648758900E-06, 1.077932500E-09,
-6.434057000E-16, 4.428817400E+03, -1.844139700E+01
nonlinear
357.000
5.176
0.000
0.000
1.000
H:9 C:4
P11/94
9.616755300E-01, 2.573585600E-02, 1.560903300E-05, -2.665651900E-08,
8.941801000E-12, 4.656441200E+03, 2.480536600E+01
7.660726100E+00, 2.387941400E-02, -8.089035300E-06, 1.205752100E-09,
-6.500981400E-14, 1.620762300E+03, -1.480028100E+01
nonlinear
357.000
5.176
0.000
0.000
1.000
H:10 C:4
P11/94
1.568541900E+00, 3.465227800E-02, 6.816812900E-06, -2.799509700E-08,
1.230774200E-11, -1.712997700E+04, 1.790804500E+01
1.052677400E+01, 2.359073800E-02, -7.852248000E-06, 1.144840800E-09,
-5.982770300E-14, -2.047922300E+04, -3.219857900E+01
nonlinear
357.000
5.176
0.000
0.000
1.000
H:10 C:4
P11/94
5.410948900E-01, 3.786030100E-02, 5.545980400E-06, -3.050011000E-08,
1.403335700E-11, -1.797764400E+04, 2.115093500E+01
1.084616900E+01, 2.333838900E-02, -7.783396200E-06, 1.139380700E-09,
-5.991828900E-14, -2.166985400E+04, -3.587057300E+01
nonlinear
357.000
5.176
0.000
0.000
1.000
H:2 C:4 O:1
USC/07
3.181190000E+00, 2.984075200E-02, -3.283240900E-05, 2.063181300E-08,
-5.420059800E-12, 2.412557600E+04, 9.421010000E+00
8.429218300E+00, 1.050270100E-02, -4.206683600E-06, 7.118490200E-10,
-3.579660200E-14, 2.290780700E+04, -1.651199700E+01
nonlinear
357.000
5.180
0.000
0.000
1.000
H:4 C:4 O:1
T03/97
8.474694630E-01, 1.317737960E-02, 5.997359010E-05, -9.715629040E-08,
4.227337960E-11, -5.367854450E+03, 2.149451720E+01
9.389350030E+00, 1.402912410E-02, -5.077551100E-06, 8.241373320E-10,
-4.953199630E-14, -8.682418140E+03, -2.791629200E+01
linear
357.000
5.180
0.000
0.000
1.000
H:5 C:4 O:1
USC/07
1.210867300E+00, 3.520587800E-02, -1.093909000E-05, -1.172064200E-08,
7.617490800E-12, 2.266570300E+03, 2.061354400E+01
8.301060700E+00, 1.994533100E-02, -8.290377100E-06, 1.510075300E-09,
-9.158115500E-14, 1.578838700E+02, -1.691056600E+01
linear
357.000
5.180
0.000
0.000
1.000
H:5 C:4 O:1
USC/07
5.305346000E+00, 1.574937300E-02, 2.162391300E-05, -3.660776900E-08,
1.493248900E-11, 5.758863300E+03, 4.204353300E+00
7.760820400E+00, 2.003180400E-02, -8.063101600E-06, 1.336139200E-09,
-6.230840800E-14, 4.570829100E+03, -1.109563800E+01
linear
357.000
5.180
0.000
0.000
1.000
H:6 C:4 O:1
A8/83
7.979854400E-01, 3.440343200E-02, -1.245985100E-05, -5.180627900E-18,
1.993595400E-21, -6.489275400E+02, 2.188969800E+01
-4.720933600E+00, 3.914137800E-02, -6.528726500E-06, -7.682095000E-09,
2.514733100E-12, 1.753522520E+03, 5.171904200E+01
linear
357.000
5.180
0.000
0.000
1.000
H:6 C:4 O:1
T3/97
2.670534630E+00, 4.925864200E-03, 8.869674060E-05, -1.262191940E-07,
5.239913210E-11, -1.027878720E+04, 1.457223950E+01
8.606582420E+00, 2.083100510E-02, -8.422294810E-06, 1.567176400E-09,
-1.093912020E-13, -1.323928150E+04, -2.324647500E+01
linear
357.000
5.180
0.000
0.000
1.000
H:6 C:4 O:1
T5/92
-1.555776600E+00, 4.096406300E-02, -1.698688100E-05, -6.009281400E-18,
2.313685300E-21, -1.413949200E+04, 3.747075800E+01
1.987945400E+01, -2.091305500E-02, 4.453605080E-05, -2.603748700E-08,
4.868361200E-12, -1.952787680E+04, -6.872003200E+01
linear
357.000
5.180
0.000
0.000
1.000
H:6 C:4 O:1
T3/97
2.670534630E+00, 4.925864200E-03, 8.869674060E-05, -1.262191940E-07,
5.239913210E-11, -1.465724720E+04, 1.457223950E+01
8.606582420E+00, 2.083100510E-02, -8.422294810E-06, 1.567176400E-09,
-1.093912020E-13, -1.761774150E+04, -2.324647500E+01
linear
357.000
5.180
0.000
0.000
1.000
H:4 C:5 O:1
T8/99
2.645764970E-01, 3.348738270E-02, 1.677384700E-06, -2.962074550E-08,
1.544314760E-11, 5.111592870E+03, 2.354095130E+01
1.008068240E+01, 1.611434650E-02, -5.833145090E-06, 9.467593200E-10,
-5.689722060E-14, 1.943647710E+03, -2.945216230E+01
nonlinear
464.800
5.290
0.000
10.320
0.000
H:5 C:5 O:1
DU0997
-2.956698400E+00, 5.585189200E-02, -3.724163600E-05, 4.162435700E-09,
3.927201000E-12, 4.857319300E+03, 3.867668200E+01
9.243144000E+00, 2.220125700E-02, -9.310594600E-06, 1.715522200E-09,
-1.061396900E-13, 1.590839400E+03, -2.408773800E+01
nonlinear
494.000
5.200
1.600
0.000
1.000
H:5 C:5 O:1
D9/97
-3.077760000E+00, 5.258167900E-02, -2.885651300E-05, -3.388547900E-09,
6.336139900E-12, 2.551045500E+04, 3.959152200E+01
8.540531200E+00, 2.298951000E-02, -9.543756300E-06, 1.706161200E-09,
-9.745936000E-14, 2.226369900E+04, -2.081882500E+01
nonlinear
494.000
5.200
1.600
0.000
1.000
H:5 C:5 O:1
T8/99
-1.283980540E+00, 4.902985110E-02, -1.358444140E-05, -2.929837430E-08,
1.908206190E-11, 6.373648030E+03, 3.080735910E+01
1.337412480E+01, 1.519964690E-02, -5.456850460E-06, 8.809448660E-10,
-5.274932580E-14, 2.203580270E+03, -4.595690690E+01
nonlinear
464.800
5.290
0.000
10.320
0.000
H:6 C:5 O:1
HWZD99
-5.043016900E+00, 7.125347900E-02, -7.091817700E-05, 3.868022000E-08,
-8.788826400E-12, -6.416778800E+03, 4.861710000E+01
3.489397000E+00, 3.805260000E-02, -2.165452700E-05, 5.923857400E-09,
-6.276346100E-13, -8.213102500E+03, 7.124805500E+00
nonlinear
464.800
5.290
0.000
10.320
0.000
H:5 C:5
T12/89
9.834982200E-01, 3.365147600E-02, -1.105418100E-07, -3.674339400E-08,
2.314118400E-11, 2.962600000E+04, 1.658551900E+01
7.474393800E+00, 1.601273300E-02, -6.482314800E-09, -3.581970300E-09,
9.236507100E-13, 2.808600000E+04, -1.613300000E+01
linear
357.000
5.180
0.000
0.000
1.000
H:6 C:5
T1/90
8.610895700E-01, 1.480403100E-02, 7.210889500E-05, -1.133805500E-07,
4.868997200E-11, 1.480175500E+04, 2.135345300E+01
9.975784800E+00, 1.890554300E-02, -6.841146100E-06, 1.109934000E-09,
-6.668023600E-14, 1.108169300E+04, -3.220945400E+01
linear
357.000
5.180
0.000
0.000
1.000
H:7 C:5
HWZD99
-4.097430700E+00, 6.183204400E-02, -4.877078000E-05, 1.669641800E-08,
-7.533489900E-13, 2.368364600E+04, 4.514810900E+01
2.224648000E+00, 3.960129600E-02, -2.234561700E-05, 6.064967600E-09,
-6.384004700E-13, 2.230342800E+04, 1.400995100E+01
linear
357.000
5.180
0.000
0.000
1.000
H:9 C:5
T03/97
2.942712800E-01, 1.382337400E-02, 9.084765300E-05, -1.300869400E-07,
5.305181100E-11, 1.256571200E+04, 2.738977300E+01
1.140680200E+01, 2.256398800E-02, -7.023559500E-06, 1.132196800E-09,
-7.343820400E-14, 7.526876900E+03, -3.963628000E+01
nonlinear
357.000
5.180
0.000
0.000
1.000
H:8 C:5
T03/97
2.689814000E+00, 2.095455000E-03, 1.130368700E-04, -1.540807000E-07,
6.276365800E-11, 2.313966300E+03, 1.529405600E+01
7.724479200E+00, 2.832231600E-02, -1.154523600E-05, 2.154081500E-09,
-1.505417800E-13, -7.826157300E+02, -1.976969800E+01
nonlinear
357.000
5.180
0.000
0.000
1.000
H:2 C:6
D11/99
4.509997400E-01, 6.747519200E-02, -1.180992500E-04, 1.036763200E-07,
-3.485103900E-11, 8.217306200E+04, 1.770412400E+01
1.289391800E+01, 7.914506800E-03, -2.402724000E-06, 2.434014900E-10,
3.138324600E-15, 7.983240600E+04, -4.077199600E+01
linear
357.000
5.180
0.000
0.000
1.000
H:3 C:6
H6W/94
1.179061900E+00, 5.554736000E-02, -7.307616800E-05, 5.207673600E-08,
-1.504696400E-11, 8.564731200E+04, 1.917919900E+01
5.818834300E+00, 2.793340800E-02, -1.782542700E-05, 5.370253600E-09,
-6.170762700E-13, 8.518825000E+04, -9.214782700E-01
nonlinear
357.000
5.180
0.000
0.000
1.000
H:4 C:6
H6W/94
2.959022500E-01, 5.805331800E-02, -6.776675600E-05, 4.337676200E-08,
-1.141886400E-11, 6.000137100E+04, 2.231897000E+01
1.271518200E+01, 1.383966200E-02, -4.376544000E-06, 3.154163600E-10,
4.661902600E-14, 5.703114800E+04, -3.946460000E+01
nonlinear
412.300
5.349
0.000
0.000
1.000
H:4 C:6
D11/99
-3.845418900E+00, 5.839156400E-02, -4.864475000E-05, 1.677032000E-08,
-7.858068000E-13, 5.259250000E+04, 4.058713200E+01
8.843296100E+00, 2.030147400E-02, -8.867426900E-06, 1.726429200E-09,
-1.178604700E-13, 4.931711300E+04, -2.401430100E+01
nonlinear
464.800
5.290
0.000
10.320
0.000
H:5 C:6
D11/99
-3.693145300E+00, 5.217896800E-02, -2.555842700E-05, -7.066112100E-09,
7.583397500E-12, 3.977959000E+04, 4.133253500E+01
8.597311000E+00, 2.224163000E-02, -8.719997800E-06, 1.378878500E-09,
-5.314605600E-14, 3.626104700E+04, -2.295464300E+01
nonlinear
464.800
5.290
0.000
10.320
0.000
H:6 C:6
D11/99
-4.843773400E+00, 5.842761300E-02, -2.948585500E-05, -6.939044000E-09,
8.212525300E-12, 9.181777300E+03, 4.388983200E+01
9.138124500E+00, 2.385443300E-02, -8.812772600E-06, 1.209902100E-09,
-1.822150300E-14, 5.204346200E+03, -2.911566500E+01
nonlinear
464.800
5.290
0.000
10.320
0.000
H:7 C:7
T08/90
4.811154000E-01, 3.851283200E-02, 3.286149200E-05, -7.697272100E-08,
3.542306800E-11, 2.330702700E+04, 2.354882000E+01
1.404398000E+01, 2.349387300E-02, -8.537536700E-06, 1.389084100E-09,
-8.361442000E-14, 1.856420300E+04, -5.166558900E+01
nonlinear
495.300
5.680
0.430
12.300
1.000
H:8 C:7
L6/87
1.615266300E+00, 2.109943800E-02, 8.536601800E-05, -1.326106600E-07,
5.595660400E-11, 4.075630000E+03, 2.028221000E+01
1.294003400E+01, 2.669128700E-02, -9.683850500E-06, 1.573862900E-09,
-9.466360100E-14, -6.976490800E+02, -4.672878500E+01
nonlinear
495.300
5.680
0.430
12.300
1.000
H:6 C:8
H6W/94
-5.264501600E+00, 8.451104200E-02, -7.659784800E-05, 3.321697800E-08,
-4.767306300E-12, 3.556624200E+04, 4.637881500E+01
2.409075900E+01, 7.823240000E-04, 1.145396400E-05, -6.162050400E-09,
9.334668500E-13, 2.742944500E+04, -1.049963100E+02
nonlinear
535.600
5.720
0.770
12.000
1.000
H:5 C:6 O:1
T05/02
-4.662044550E-01, 4.134439750E-02, 1.324129910E-05, -5.728727690E-08,
2.897637070E-11, 4.778583910E+03, 2.769902740E+01
1.372217200E+01, 1.746887710E-02, -6.355045200E-06, 1.034923080E-09,
-6.234105040E-14, 2.872747510E+02, -4.881816800E+01
nonlinear
464.800
5.290
0.000
10.320
0.000
H:6 C:6 O:1
L4/84
-1.695653900E+00, 5.227129900E-02, -7.202405000E-06, -3.585960300E-08,
2.044907300E-11, -1.328412100E+04, 3.254216000E+01
1.491207300E+01, 1.837813500E-02, -6.198312800E-06, 9.198322100E-10,
-4.920956500E-14, -1.837519900E+04, -5.592410300E+01
nonlinear
464.800
5.290
0.000
10.320
0.000
H:4 C:6 O:2
PUML96
-9.519300500E-01, 5.784244500E-02, -3.821443900E-05, 4.631265600E-09,
3.629665100E-12, -1.761104700E+04, 2.923951300E+01
1.173084000E+01, 2.361499500E-02, -1.023457600E-05, 1.953217400E-09,
-1.274602200E-13, -2.108577000E+04, -3.630045300E+01
nonlinear
485.000
5.425
0.400
0.000
1.000
H:5 C:7 O:1
EST/BURP1/93
-2.025115500E+00, 6.151254100E-02, -3.160365300E-05, -6.972459900E-09,
7.983514900E-12, 1.125580300E+04, 3.577817500E+01
1.337440900E+01, 2.399928900E-02, -1.046572400E-05, 2.166913100E-09,
-1.800704500E-13, 6.914783700E+03, -4.465921800E+01
nonlinear
593.000
5.500
2.800
0.000
1.000
H:6 C:7 O:1
L3/86
-3.162733400E+00, 6.636924500E-02, -3.481635300E-05, -6.299937700E-09,
8.580710100E-12, -6.116934900E+03, 4.023173500E+01
1.365073700E+01, 2.568041900E-02, -1.046672900E-05, 1.941343000E-09,
-1.348379200E-13, -1.101974400E+04, -4.796579600E+01
nonlinear
593.000
5.470
2.800
0.000
1.000
H:8 C:7 O:1
L7/87
2.064202100E+00, 2.277514000E-02, 9.597205300E-05, -1.508511000E-07,
6.417583200E-11, -1.428502100E+04, 1.814831200E+01
1.528115400E+01, 2.720850100E-02, -9.858466000E-06, 1.601218300E-09,
-9.627805700E-14, -1.970047100E+04, -5.941867300E+01
nonlinear
572.000
5.820
1.700
0.000
1.000
H:7 C:7 O:1
EST/BURP1/93
-2.885577700E-01, 4.800353600E-02, 1.803299300E-05, -6.174148800E-08,
2.885258700E-11, -6.894558100E+02, 2.672006800E+01
2.260937100E+01, 7.564615000E-03, 6.596089400E-06, -4.715086500E-09,
8.040906300E-13, -8.202524400E+03, -9.729251100E+01
nonlinear
567.000
5.600
1.600
0.000
1.000
H:8 C:7 O:1
AVGCRESOL6/87
4.225826700E-01, 4.555163600E-02, 3.201251300E-05, -8.112195900E-08,
3.766565800E-11, -1.820262100E+04, 2.603290300E+01
1.593298700E+01, 2.701116000E-02, -9.944872200E-06, 1.629668900E-09,
-9.851329800E-14, -2.359206500E+04, -5.973284100E+01
nonlinear
567.000
5.600
1.600
0.000
1.000
H:7 C:7
P1/93
-3.141594200E+00, 5.672307700E-02, -8.688511100E-06, -3.424961600E-08,
1.926690200E-11, 3.573854700E+04, 3.974284000E+01
1.161549800E+01, 2.743183800E-02, -1.089934500E-05, 1.864183000E-09,
-1.019160700E-13, 3.120933400E+04, -3.899463700E+01
nonlinear
495.300
5.680
0.430
12.300
1.000
H:26 C:12
1/2/7THERM
-2.621815940E+00, 1.472377110E-01, -9.439702710E-05, 3.074412680E-08,
-4.036022300E-12, -4.006542530E+04, 5.009946260E+01
3.850950370E+01, 5.635500480E-02, -1.914932000E-05, 2.960248620E-09,
-1.712441500E-13, -5.488434650E+04, -1.726709220E+02
nonlinear
789.980
7.047
0.000
0.000
1.000
H:22 C:10
1/2/7THERM
-2.084169690E+00, 1.225350120E-01, -7.768157390E-05, 2.498348770E-08,
-3.235480380E-12, -3.430218630E+04, 4.422601400E+01
3.198822390E+01, 4.772449220E-02, -1.622763910E-05, 2.509632590E-09,
-1.452157720E-13, -4.663928400E+04, -1.405041210E+02
nonlinear
704.917
6.675
0.000
0.000
1.000
H:20 C:9
1/2/7THERM
-1.813904580E+00, 1.101766440E-01, -6.931244630E-05, 2.209576010E-08,
-2.833557150E-12, -3.142077160E+04, 4.128272200E+01
2.872896000E+01, 4.340745760E-02, -1.476609850E-05, 2.284209870E-09,
-1.321947960E-13, -4.251744790E+04, -1.244287510E+02
nonlinear
660.032
6.467
0.000
0.000
1.000
H:18 C:8
1/2/7THERM
-1.542184060E+00, 9.781120630E-02, -6.093183580E-05, 1.920055910E-08,
-2.429962500E-12, -2.853956410E+04, 3.833279780E+01
2.547101940E+01, 3.908870370E-02, -1.330387770E-05, 2.058675270E-09,
-1.191671740E-13, -3.839627550E+04, -1.083610940E+02
nonlinear
613.127
6.250
0.000
0.000
1.000
H:16 C:7
1/2/7THERM
-1.268361870E+00, 8.543558200E-02, -5.253467860E-05, 1.629457210E-08,
-2.023949250E-12, -2.565865650E+04, 3.537329120E+01
2.221489690E+01, 3.476757500E-02, -1.184071290E-05, 1.832984780E-09,
-1.061302660E-13, -3.427600810E+04, -9.230401960E+01
nonlinear
564.030
6.004
0.000
0.000
1.000
H:14 C:6
1/2/7THERM
-9.696061840E-01, 7.290856080E-02, -4.388539190E-05, 1.323128070E-08,
-1.584374230E-12, -2.278038620E+04, 3.230697980E+01
1.896341170E+01, 3.044802040E-02, -1.037948290E-05, 1.607754570E-09,
-9.312697280E-14, -3.016287390E+04, -7.628393550E+01
nonlinear
512.225
5.742
0.000
0.000
1.000
H:12 C:6
1/22/7THERM
-1.352752050E+00, 6.986554260E-02, -4.594080220E-05, 1.569673430E-08,
-2.212961750E-12, -7.343686170E+03, 3.531206910E+01
1.783375290E+01, 2.673776580E-02, -9.100367730E-06, 1.408197680E-09,
-8.151242440E-14, -1.420628600E+04, -6.838188510E+01
nonlinear
504.629
5.628
0.000
0.000
1.000
H:12 C:5
1/2/7THERM
-7.367661220E-01, 6.072009730E-02, -3.575927610E-05, 1.049070420E-08,
-1.214873150E-12, -1.989349340E+04, 2.953582870E+01
1.572576030E+01, 2.610860450E-02, -8.909709960E-06, 1.381022480E-09,
-8.002965360E-14, -2.605195430E+04, -6.033654570E+01
nonlinear
458.182
5.445
0.000
0.000
1.000
H:10 C:5
1/2/7THERM
-1.062234810E+00, 5.742182940E-02, -3.744868900E-05, 1.273649890E-08,
-1.796097890E-12, -4.465466660E+03, 3.227397900E+01
1.458515390E+01, 2.240724710E-02, -7.633480250E-06, 1.181889660E-09,
-6.843851390E-14, -1.008982050E+04, -5.236839360E+01
nonlinear
448.508
5.342
0.000
0.000
1.000
O:1 N:1
RUS78
4.218476300E+00, -4.638976000E-03, 1.104102200E-05, -9.336135400E-09,
2.803577000E-12, 9.844623000E+03, 2.280846400E+00
3.260605600E+00, 1.191104300E-03, -4.291704800E-07, 6.945766900E-11,
-4.033609900E-15, 9.920974600E+03, 6.369302700E+00
linear
97.530
3.621
0.000
1.760
4.000
H:1 O:1 N:1
And93
4.533491600E+00, -5.669617100E-03, 1.847320700E-05, -1.713709400E-08,
5.545457300E-12, 1.154829700E+04, 1.749841700E+00
2.979250900E+00, 3.494405900E-03, -7.854977800E-07, 5.747959400E-11,
-1.933591600E-16, 1.175058200E+04, 8.606372800E+00
nonlinear
116.700
3.492
0.000
0.000
1.000
O:2 N:1
L7/88
3.944031200E+00, -1.585429000E-03, 1.665781200E-05, -2.047542600E-08,
7.835056400E-12, 2.896617900E+03, 6.311991700E+00
4.884754200E+00, 2.172395600E-03, -8.280690600E-07, 1.574751000E-10,
-1.051089500E-14, 2.316498300E+03, -1.174169500E-01
nonlinear
200.000
3.500
0.000
0.000
1.000
H:1 O:2 N:1
2.290413000E+00, 1.409922000E-02, -1.367872000E-05, 7.498780000E-09,
-1.876905000E-12, -1.043195000E+04, 1.328077000E+01
5.486893000E+00, 4.218065000E-03, -1.649143000E-06, 2.971877000E-10,
-2.021148000E-14, -1.126865000E+04, -2.997002000E+00
nonlinear
146.000
4.680
0.000
0.000
1.000
H:3 N:1
J6/77
4.286027400E+00, -4.660523000E-03, 2.171851300E-05, -2.280888700E-08,
8.263804600E-12, -6.741728500E+03, -6.253727700E-01
2.634452100E+00, 5.666256000E-03, -1.727867600E-06, 2.386716100E-10,
-1.257878600E-14, -6.544695800E+03, 6.566292800E+00
nonlinear
481.000
2.920
1.470
0.000
10.000
H:2 N:1
And89
4.204002900E+00, -2.106138500E-03, 7.106834800E-06, -5.611519700E-09,
1.644071700E-12, 2.188591000E+04, -1.418424800E-01
2.834742100E+00, 3.207308200E-03, -9.339080400E-07, 1.370295300E-10,
-7.920614400E-15, 2.217195700E+04, 6.520416300E+00
nonlinear
80.000
2.650
0.000
2.260
4.000
H:1 N:1
And94
3.492908500E+00, 3.117919800E-04, -1.489048400E-06, 2.481644200E-09,
-1.035696700E-12, 4.188062900E+04, 1.848327800E+00
2.783692800E+00, 1.329843000E-03, -4.247804700E-07, 7.834850100E-11,
-5.504447000E-15, 4.212084800E+04, 5.740779900E+00
linear
80.000
2.650
0.000
0.000
4.000
H:1 N:2
T07/93
4.344692700E+00, -4.849707200E-03, 2.005945900E-05, -2.172646400E-08,
7.946953900E-12, 2.879197300E+04, 2.977941000E+00
3.766754400E+00, 2.891508200E-03, -1.041662000E-06, 1.684259400E-10,
-1.009189600E-14, 2.865069700E+04, 4.470506700E+00
nonlinear
71.400
3.798
0.000
0.000
1.000
O:1 N:2
L7/88
2.257150200E+00, 1.130472800E-02, -1.367131900E-05, 9.681980600E-09,
-2.930718200E-12, 8.741774400E+03, 1.075799200E+01
4.823072900E+00, 2.627025100E-03, -9.585087400E-07, 1.600071200E-10,
-9.775230300E-15, 8.073404800E+03, -2.201720700E+00
linear
232.400
3.828
0.000
0.000
1.000
N:1
L6/88
2.500000000E+00, 0.000000000E+00, 0.000000000E+00, 0.000000000E+00,
0.000000000E+00, 5.610463700E+04, 4.193908700E+00
2.415942900E+00, 1.748906500E-04, -1.190236900E-07, 3.022624500E-11,
-2.036098200E-15, 5.613377300E+04, 4.649609600E+00
atom
71.400
3.298
0.000
0.000
0.000
H:1 C:1 N:1
GRI/98
2.258988600E+00, 1.005117000E-02, -1.335176300E-05, 1.009234900E-08,
-3.008902800E-12, 1.471263300E+04, 8.916441900E+00
3.802239200E+00, 3.146422800E-03, -1.063218500E-06, 1.661975700E-10,
-9.799757000E-15, 1.440729200E+04, 1.575460100E+00
linear
569.000
3.630
0.000
0.000
1.000
H:2 C:1 N:1
41687
2.851661000E+00, 5.695233100E-03, 1.071140000E-06, -1.622612000E-09,
-2.351108100E-13, 2.863782000E+04, 8.992751100E+00
5.209703000E+00, 2.969291100E-03, -2.855589100E-07, -1.635550000E-10,
3.043258900E-14, 2.767710900E+04, -4.444478000E+00
linear
569.000
3.630
0.000
0.000
1.000
C:1 N:1
HBH92
3.612935100E+00, -9.555132700E-04, 2.144297700E-06, -3.151632300E-10,
-4.643035600E-13, 5.170834000E+04, 3.980499500E+00
3.745980500E+00, 4.345077500E-05, 2.970598400E-07, -6.865180600E-11,
4.413417300E-15, 5.153618800E+04, 2.786760100E+00
linear
75.000
3.856
0.000
0.000
1.000
C:1 O:1 N:1
EA93
2.826930800E+00, 8.805168800E-03, -8.386613400E-06, 4.801696400E-09,
-1.331359500E-12, 1.468247700E+04, 9.550464600E+00
5.152184500E+00, 2.305176100E-03, -8.803315300E-07, 1.478909800E-10,
-9.097799600E-15, 1.400412300E+04, -2.544266000E+00
linear
232.400
3.828
0.000
0.000
1.000
H:1 C:1 O:1 N:1
BDEA94
3.786049520E+00, 6.886679220E-03, -3.214878640E-06, 5.171957670E-10,
1.193607880E-14, -2.826984000E+03, 5.632921620E+00
5.897848850E+00, 3.167893930E-03, -1.118010640E-06, 1.772431440E-10,
-1.043391770E-14, -3.706533310E+03, -6.181678250E+00
nonlinear
232.400
3.828
0.000
0.000
1.000
H:1 C:1 O:1 N:1
BDEA94
3.630963170E+00, 7.302823570E-03, -2.280500030E-06, -6.612712980E-10,
3.622357520E-13, -1.558736360E+04, 6.194577270E+00
6.223951340E+00, 3.178640040E-03, -1.093787550E-06, 1.707351630E-10,
-9.950219550E-15, -1.665993440E+04, -8.382247410E+00
nonlinear
232.400
3.828
0.000
0.000
1.000
H:3 C:2 N:1
2.519753100E+00, 1.356752300E-02, -2.576407700E-06, -3.089396700E-09,
1.428869200E-12, 8.553376200E+03, 1.092086800E+01
2.392404600E+00, 1.561887300E-02, -7.912049700E-06, 1.937233300E-09,
-1.861195600E-13, 8.499937700E+03, 1.114523600E+01
linear
360.000
3.700
0.000
0.000
1.000
H + O2 [=] O + OH
2.644000E+13
-0.6707
17041.000000
H:1.0 O2:1
O:1.0 OH:1
O + H2 [=] H + OH
4.589000E+01
2.7
6260.000000
H2:1 O:1.0
H:1.0 OH:1
OH + H2 [=] H + H2O
1.734000E+05
1.51
3430.000000
H2:1 OH:1.0
H:1.0 H2O:1
OH + OH [=] O + H2O
3.973000E+01
2.4
-2110.000000
OH:2.0
H2O:1 O:1.0
H + H + M [=] H2 + M
1.780000E+12
-1.0
0.000000
H2:0.0 H2O:0.0 CO2:0.0 AR:0.63
H:2.0
H2:1.0
H + H + H2 [=] H2 + H2
9.000000E+10
-0.6
0.000000
H2:1 H:2.0
H2:2.0
H + H + H2O [=] H2 + H2O
5.624000E+13
-1.25
0.000000
H:2.0 H2O:1
H2:1.0 H2O:1
H + H + CO2 [=] H2 + CO2
5.500000E+14
-2.0
0.000000
H:2.0 CO2:1
H2:1.0 CO2:1
H + OH + M [=] H2O + M
4.400000E+16
-2.0
0.000000
H2:2.0 H2O:6.3 CO2:3.6 CO:1.75 AR:0.38
H:1.0 OH:1
H2O:1.0
O + H + M [=] OH + M
9.428000E+12
-1.0
0.000000
H2:2.0 H2O:12.0 CO2:3.6 CO:1.75 AR:0.7
H:1 O:1.0
OH:1.0
O + O + M [=] O2 + M
1.200000E+11
-1.0
0.000000
H2:2.4 H2O:15.4 CO2:3.6 CO:1.75 AR:0.83
O:2.0
O2:1.0
H + O2 (+ M) [=] HO2 (+ M)
5.116000E+09
0.44
0.000000
6.328000E+13
-1.4
0.000000
H2O:11.89 CO2:2.18 CO:1.09 O2:0.85 AR:0.4
0.5 1e-30 1e+30
H:1.0 O2:1
HO2:1.0
H2 + O2 [=] HO2 + H
5.916000E+02
2.433
53502.000000
H2:1.0 O2:1
H:1 HO2:1.0
OH + OH (+ M) [=] H2O2 (+ M)
1.110000E+11
-0.37
0.000000
2.010000E+11
-0.584
-2293.000000
H2:2.0 H2O:6.0 CO2:3.6 CO:1.75 AR:0.7
0.7346 94 1756 5182
OH:2.0
H2O2:1.0
HO2 + H [=] O + H2O
3.970000E+09
0.0
671.000000
H:1 HO2:1.0
H2O:1 O:1.0
HO2 + H [=] OH + OH
7.485000E+10
0.0
295.000000
H:1 HO2:1.0
OH:2.0
HO2 + O [=] OH + O2
4.000000E+10
0.0
0.000000
HO2:1.0 O:1
O2:1 OH:1.0
HO2 + HO2 [=] O2 + H2O2
1.300000E+08
0.0
-1630.000000
HO2:2.0
O2:1.0 H2O2:1
HO2 + HO2 [=] O2 + H2O2
3.658000E+11
0.0
12000.000000
HO2:2.0
O2:1.0 H2O2:1
OH + HO2 [=] H2O + O2
1.410000E+15
-1.76
60.000000
HO2:1 OH:1.0
H2O:1.0 O2:1
OH + HO2 [=] H2O + O2
1.120000E+82
-22.3
26900.000000
HO2:1 OH:1.0
H2O:1.0 O2:1
OH + HO2 [=] H2O + O2
5.370000E+67
-16.72
32900.000000
HO2:1 OH:1.0
H2O:1.0 O2:1
OH + HO2 [=] H2O + O2
2.510000E+09
2.0
40000.000000
HO2:1 OH:1.0
H2O:1.0 O2:1
OH + HO2 [=] H2O + O2
1.000000E+133
-40.0
34800.000000
HO2:1 OH:1.0
H2O:1.0 O2:1
H2O2 + H [=] HO2 + H2
6.050000E+03
2.0
5200.000000
H:1 H2O2:1.0
H2:1 HO2:1.0
H2O2 + H [=] OH + H2O
2.410000E+10
0.0
3970.000000
H:1 H2O2:1.0
H2O:1 OH:1.0
H2O2 + O [=] OH + HO2
9.630000E+03
2.0
3970.000000
H2O2:1.0 O:1
HO2:1 OH:1.0
H2O2 + OH [=] HO2 + H2O
2.000000E+09
0.0
427.000000
H2O2:1.0 OH:1
H2O:1 HO2:1.0
H2O2 + OH [=] HO2 + H2O
2.670000E+38
-7.0
37600.000000
H2O2:1.0 OH:1
H2O:1 HO2:1.0
CO + O (+ M) [=] CO2 (+ M)
1.362000E+07
0.0
2384.000000
1.173000E+18
-2.79
4191.000000
H2:2.0 H2O:12.0 CO2:3.6 CO:1.75 AR:0.7
CO:1.0 O:1
CO2:1.0
CO + OH [=] CO2 + H
7.046000E+01
2.053
-355.670000
CO:1.0 OH:1
H:1 CO2:1.0
CO + OH [=] CO2 + H
5.757000E+09
-0.664
331.830000
CO:1.0 OH:1
H:1 CO2:1.0
CO + O2 [=] CO2 + O
1.119000E+09
0.0
47700.000000
CO:1.0 O2:1
CO2:1.0 O:1
CO + HO2 [=] CO2 + OH
1.570000E+02
2.18
17942.610000
HO2:1 CO:1.0
CO2:1.0 OH:1
HCO + H [=] CO + H2
1.200000E+11
0.0
0.000000
H:1 HCO:1.0
H2:1 CO:1.0
HCO + O [=] CO + OH
3.000000E+10
0.0
0.000000
HCO:1.0 O:1
CO:1.0 OH:1
HCO + O [=] CO2 + H
3.000000E+10
0.0
0.000000
HCO:1.0 O:1
H:1 CO2:1.0
HCO + OH [=] CO + H2O
3.020000E+10
0.0
0.000000
HCO:1.0 OH:1
H2O:1 CO:1.0
HCO + M [=] CO + H + M
1.870000E+14
-1.0
17000.000000
H2:2.0 H2O:0.0 CO2:3.6 CO:1.75
HCO:1.0
H:1 CO:1.0
HCO + H2O [=] CO + H + H2O
2.244000E+15
-1.0
17000.000000
H2O:1 HCO:1.0
H:1 H2O:1 CO:1.0
HCO + O2 [=] CO + HO2
1.204000E+07
0.807
-727.000000
HCO:1.0 O2:1
HO2:1 CO:1.0
CO + H2 (+ M) [=] CH2O (+ M)
4.300000E+04
1.5
79600.000000
5.070000E+21
-3.42
84350.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.932 197 1540 10300
H2:1 CO:1.0
CH2O:1.0
C + OH [=] CO + H
5.000000E+10
0.0
0.000000
C:1.0 OH:1
H:1 CO:1.0
C + O2 [=] CO + O
5.800000E+10
0.0
576.000000
C:1.0 O2:1
CO:1.0 O:1
CH + H [=] C + H2
1.100000E+11
0.0
0.000000
H:1 CH:1.0
H2:1 C:1.0
CH + O [=] CO + H
5.700000E+10
0.0
0.000000
CH:1.0 O:1
H:1 CO:1.0
CH + OH [=] HCO + H
3.000000E+10
0.0
0.000000
CH:1.0 OH:1
H:1 HCO:1.0
CH + H2 [=] CH2 + H
1.107000E+05
1.79
1670.000000
H2:1 CH:1.0
H:1 CH2:1.0
CH + H2O [=] CH2O + H
5.710000E+09
0.0
-755.000000
H2O:1 CH:1.0
CH2O:1.0 H:1
CH + O2 [=] HCO + O
3.300000E+10
0.0
0.000000
CH:1.0 O2:1
HCO:1.0 O:1
CH + CO (+ M) [=] HCCO (+ M)
5.000000E+10
0.0
0.000000
2.690000E+22
-3.74
1936.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.5757 237 1652 5069
CH:1.0 CO:1
HCCO:1.0
CH + CO2 [=] HCO + CO
3.400000E+09
0.0
690.000000
CH:1.0 CO2:1
CO:1 HCO:1.0
HCO + H (+ M) [=] CH2O (+ M)
1.090000E+09
0.48
-260.000000
1.350000E+18
-2.57
1425.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.7824 271 2755 6570
H:1 HCO:1.0
CH2O:1.0
CH2 + H (+ M) [=] CH3 (+ M)
2.500000E+13
-0.8
0.000000
3.200000E+21
-3.14
1230.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.68 78 1995 5590
H:1 CH2:1.0
CH3:1.0
CH2 + O [=] HCO + H
8.000000E+10
0.0
0.000000
CH2:1.0 O:1
H:1 HCO:1.0
CH2 + OH [=] CH2O + H
2.000000E+10
0.0
0.000000
CH2:1.0 OH:1
CH2O:1.0 H:1
CH2 + OH [=] CH + H2O
1.130000E+04
2.0
3000.000000
CH2:1.0 OH:1
H2O:1 CH:1.0
CH2 + H2 [=] H + CH3
5.000000E+02
2.0
7230.000000
H2:1 CH2:1.0
H:1.0 CH3:1
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
H:2 CO2:1.0
CH2 + HO2 [=] CH2O + OH
2.000000E+10
0.0
0.000000
CH2:1.0 HO2:1
CH2O:1.0 OH:1
CH2 + C [=] C2H + H
5.000000E+10
0.0
0.000000
CH2:1.0 C:1
H:1 C2H:1.0
CH2 + CO (+ M) [=] CH2CO (+ M)
8.100000E+08
0.5
4510.000000
2.690000E+27
-5.11
7095.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.5907 275 1226 5185
CH2:1.0 CO:1
CH2CO:1.0
CH2 + CH [=] C2H2 + H
4.000000E+10
0.0
0.000000
CH2:1.0 CH:1
H:1 C2H2:1.0
CH2 + CH2 [=] C2H2 + H2
3.200000E+10
0.0
0.000000
CH2:2.0
H2:1 C2H2:1.0
CH2* + N2 [=] CH2 + N2
1.500000E+10
0.0
600.000000
N2:1 CH2*:1.0
CH2:1.0 N2:1
CH2* + AR [=] CH2 + AR
9.000000E+09
0.0
600.000000
AR:1 CH2*:1.0
CH2:1.0 AR:1
CH2* + H [=] CH + H2
3.000000E+10
0.0
0.000000
H:1 CH2*:1.0
H2:1 CH:1.0
CH2* + O [=] CO + H2
1.500000E+10
0.0
0.000000
CH2*:1.0 O:1
H2:1 CO:1.0
CH2* + O [=] HCO + H
1.500000E+10
0.0
0.000000
CH2*:1.0 O:1
H:1 HCO:1.0
CH2* + OH [=] CH2O + H
3.000000E+10
0.0
0.000000
CH2*:1.0 OH:1
CH2O:1.0 H:1
CH2* + H2 [=] CH3 + H
7.000000E+10
0.0
0.000000
H2:1 CH2*:1.0
H:1 CH3:1.0
CH2* + O2 [=] H + OH + CO
2.800000E+10
0.0
0.000000
CH2*:1.0 O2:1
H:1.0 CO:1 OH:1
CH2* + O2 [=] CO + H2O
1.200000E+10
0.0
0.000000
CH2*:1.0 O2:1
H2O:1 CO:1.0
CH2* + H2O (+ M) [=] CH3OH (+ M)
2.000000E+10
0.0
0.000000
2.700000E+32
-6.3
3100.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 CH4:2.0 C2H6:3.0
0.1507 134 2383 7265
H2O:1 CH2*:1.0
CH3OH:1.0
CH2* + H2O [=] CH2 + H2O
3.000000E+10
0.0
0.000000
H2O:1 CH2*:1.0
CH2:1.0 H2O:1
CH2* + CO [=] CH2 + CO
9.000000E+09
0.0
0.000000
CO:1 CH2*:1.0
CH2:1.0 CO:1
CH2* + CO2 [=] CH2 + CO2
7.000000E+09
0.0
0.000000
CO2:1 CH2*:1.0
CH2:1.0 CO2:1
CH2* + CO2 [=] CH2O + CO
1.400000E+10
0.0
0.000000
CO2:1 CH2*:1.0
CH2O:1.0 CO:1
CH2O + H (+ M) [=] CH2OH (+ M)
5.400000E+08
0.454
3600.000000
1.270000E+26
-4.82
6530.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 CH4:2.0 C2H6:3.0
0.7187 103 1291 4160
CH2O:1.0 H:1
CH2OH:1.0
CH2O + H (+ M) [=] CH3O (+ M)
5.400000E+08
0.454
2600.000000
2.200000E+24
-4.8
5560.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 CH4:2.0 C2H6:3.0
0.758 94 1555 4200
CH2O:1.0 H:1
CH3O:1.0
CH2O + H [=] HCO + H2
2.300000E+07
1.05
3275.000000
CH2O:1.0 H:1
H2:1 HCO:1.0
CH2O + O [=] HCO + OH
3.900000E+10
0.0
3540.000000
CH2O:1.0 O:1
HCO:1.0 OH:1
CH2O + OH [=] HCO + H2O
3.430000E+06
1.18
-447.000000
CH2O:1.0 OH:1
H2O:1 HCO:1.0
CH2O + O2 [=] HCO + HO2
1.000000E+11
0.0
40000.000000
CH2O:1.0 O2:1
HO2:1 HCO:1.0
CH2O + HO2 [=] HCO + H2O2
1.000000E+09
0.0
8000.000000
CH2O:1.0 HO2:1
HCO:1.0 H2O2:1
CH2O + CH [=] CH2CO + H
9.460000E+10
0.0
-515.000000
CH2O:1.0 CH:1
H:1 CH2CO:1.0
CH3 + H (+ M) [=] CH4 (+ M)
1.270000E+13
-0.63
383.000000
2.477000E+27
-4.76
2440.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.783 74 2941 6964
H:1 CH3:1.0
CH4:1.0
CH3 + O [=] CH2O + H
8.430000E+10
0.0
0.000000
CH3:1.0 O:1
CH2O:1.0 H:1
CH3 + OH (+ M) [=] CH3OH (+ M)
6.300000E+10
0.0
0.000000
2.700000E+32
-6.3
3100.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 CH4:2.0 C2H6:3.0
0.2105 83.5 5398 8370
CH3:1.0 OH:1
CH3OH:1.0
CH3 + OH [=] CH2 + H2O
5.600000E+04
1.6
5420.000000
CH3:1.0 OH:1
CH2:1.0 H2O:1
CH3 + OH [=] CH2* + H2O
2.501000E+10
0.0
0.000000
CH3:1.0 OH:1
H2O:1 CH2*:1.0
CH3 + O2 [=] O + CH3O
3.083000E+10
0.0
28800.000000
CH3:1.0 O2:1
CH3O:1 O:1.0
CH3 + O2 [=] OH + CH2O
3.600000E+07
0.0
8940.000000
CH3:1.0 O2:1
CH2O:1 OH:1.0
CH3 + HO2 [=] CH4 + O2
1.000000E+09
0.0
0.000000
CH3:1.0 HO2:1
CH4:1.0 O2:1
CH3 + HO2 [=] CH3O + OH
1.340000E+10
0.0
0.000000
CH3:1.0 HO2:1
CH3O:1.0 OH:1
CH3 + H2O2 [=] CH4 + HO2
2.450000E+01
2.47
5180.000000
CH3:1.0 H2O2:1
HO2:1 CH4:1.0
CH3 + C [=] C2H2 + H
5.000000E+10
0.0
0.000000
C:1 CH3:1.0
H:1 C2H2:1.0
CH3 + CH [=] C2H3 + H
3.000000E+10
0.0
0.000000
CH:1 CH3:1.0
H:1 C2H3:1.0
CH3 + HCO [=] CH4 + CO
8.480000E+09
0.0
0.000000
CH3:1.0 HCO:1
CO:1 CH4:1.0
CH3 + CH2O [=] CH4 + HCO
3.320000E+00
2.81
5860.000000
CH2O:1 CH3:1.0
CH4:1.0 HCO:1
CH3 + CH2 [=] C2H4 + H
4.000000E+10
0.0
0.000000
CH2:1 CH3:1.0
H:1 C2H4:1.0
CH3 + CH2* [=] C2H4 + H
1.200000E+10
0.0
-570.000000
CH3:1.0 CH2*:1
H:1 C2H4:1.0
CH3 + CH3 (+ M) [=] C2H6 (+ M)
2.120000E+13
-0.97
620.000000
1.770000E+44
-9.67
6220.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.5325 151 1038 4970
CH3:2.0
C2H6:1.0
CH3 + CH3 [=] H + C2H5
4.990000E+09
0.1
10600.000000
CH3:2.0
H:1.0 C2H5:1
CH3 + HCCO [=] C2H4 + CO
5.000000E+10
0.0
0.000000
CH3:1.0 HCCO:1
C2H4:1.0 CO:1
CH3 + C2H [=] C3H3 + H
2.410000E+10
0.0
0.000000
C2H:1 CH3:1.0
H:1 C3H3:1.0
CH3O + H (+ M) [=] CH3OH (+ M)
5.000000E+10
0.0
0.000000
8.600000E+22
-4.0
3025.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 CH4:2.0 C2H6:3.0
0.8902 144 2838 45569
H:1 CH3O:1.0
CH3OH:1.0
CH3O + H [=] CH2OH + H
3.400000E+03
1.6
0.000000
H:1 CH3O:1.0
CH2OH:1.0 H:1
CH3O + H [=] CH2O + H2
2.000000E+10
0.0
0.000000
H:1 CH3O:1.0
CH2O:1.0 H2:1
CH3O + H [=] CH3 + OH
3.200000E+10
0.0
0.000000
H:1 CH3O:1.0
CH3:1.0 OH:1
CH3O + H [=] CH2* + H2O
1.600000E+10
0.0
0.000000
H:1 CH3O:1.0
H2O:1 CH2*:1.0
CH3O + O [=] CH2O + OH
1.000000E+10
0.0
0.000000
CH3O:1.0 O:1
CH2O:1.0 OH:1
CH3O + OH [=] CH2O + H2O
5.000000E+09
0.0
0.000000
CH3O:1.0 OH:1
CH2O:1.0 H2O:1
CH3O + O2 [=] CH2O + HO2
4.280000E-16
7.6
-3530.000000
CH3O:1.0 O2:1
CH2O:1.0 HO2:1
CH2OH + H (+ M) [=] CH3OH (+ M)
1.800000E+10
0.0
0.000000
3.000000E+25
-4.8
3300.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 CH4:2.0 C2H6:3.0
0.7679 338 1812 5081
CH2OH:1.0 H:1
CH3OH:1.0
CH2OH + H [=] CH2O + H2
2.000000E+10
0.0
0.000000
CH2OH:1.0 H:1
CH2O:1.0 H2:1
CH2OH + H [=] CH3 + OH
1.200000E+10
0.0
0.000000
CH2OH:1.0 H:1
CH3:1.0 OH:1
CH2OH + H [=] CH2* + H2O
6.000000E+09
0.0
0.000000
CH2OH:1.0 H:1
H2O:1 CH2*:1.0
CH2OH + O [=] CH2O + OH
1.000000E+10
0.0
0.000000
CH2OH:1.0 O:1
CH2O:1.0 OH:1
CH2OH + OH [=] CH2O + H2O
5.000000E+09
0.0
0.000000
CH2OH:1.0 OH:1
CH2O:1.0 H2O:1
CH2OH + O2 [=] CH2O + HO2
1.800000E+10
0.0
900.000000
CH2OH:1.0 O2:1
CH2O:1.0 HO2:1
CH4 + H [=] CH3 + H2
6.600000E+05
1.62
10840.000000
H:1 CH4:1.0
H2:1 CH3:1.0
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
1.000000E+05
1.6
3120.000000
CH4:1.0 OH:1
H2O:1 CH3:1.0
CH4 + CH [=] C2H4 + H
6.000000E+10
0.0
0.000000
CH:1 CH4:1.0
H:1 C2H4:1.0
CH4 + CH2 [=] CH3 + CH3
2.460000E+03
2.0
8270.000000
CH2:1 CH4:1.0
CH3:2.0
CH4 + CH2* [=] CH3 + CH3
1.600000E+10
0.0
-570.000000
CH4:1.0 CH2*:1
CH3:2.0
CH4 + C2H [=] C2H2 + CH3
1.810000E+09
0.0
500.000000
C2H:1 CH4:1.0
CH3:1 C2H2:1.0
CH3OH + H [=] CH2OH + H2
1.700000E+04
2.1
4870.000000
CH3OH:1.0 H:1
H2:1 CH2OH:1.0
CH3OH + H [=] CH3O + H2
4.200000E+03
2.1
4870.000000
CH3OH:1.0 H:1
H2:1 CH3O:1.0
CH3OH + O [=] CH2OH + OH
3.880000E+02
2.5
3100.000000
CH3OH:1.0 O:1
CH2OH:1.0 OH:1
CH3OH + O [=] CH3O + OH
1.300000E+02
2.5
5000.000000
CH3OH:1.0 O:1
CH3O:1.0 OH:1
CH3OH + OH [=] CH2OH + H2O
1.440000E+03
2.0
-840.000000
CH3OH:1.0 OH:1
CH2OH:1.0 H2O:1
CH3OH + OH [=] CH3O + H2O
6.300000E+03
2.0
1500.000000
CH3OH:1.0 OH:1
H2O:1 CH3O:1.0
CH3OH + CH3 [=] CH2OH + CH4
3.000000E+04
1.5
9940.000000
CH3OH:1.0 CH3:1
CH2OH:1.0 CH4:1
CH3OH + CH3 [=] CH3O + CH4
1.000000E+04
1.5
9940.000000
CH3OH:1.0 CH3:1
CH3O:1.0 CH4:1
C2H + H (+ M) [=] C2H2 (+ M)
1.000000E+14
-1.0
0.000000
3.750000E+27
-4.8
1900.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.6464 132 1315 5566
H:1 C2H:1.0
C2H2:1.0
C2H + O [=] CH + CO
5.000000E+10
0.0
0.000000
C2H:1.0 O:1
CH:1.0 CO:1
C2H + OH [=] H + HCCO
2.000000E+10
0.0
0.000000
C2H:1.0 OH:1
H:1.0 HCCO:1
C2H + O2 [=] HCO + CO
5.000000E+10
0.0
1500.000000
C2H:1.0 O2:1
CO:1 HCO:1.0
C2H + H2 [=] H + C2H2
4.900000E+02
2.5
560.000000
H2:1 C2H:1.0
H:1.0 C2H2:1
C2O + H [=] CH + CO
5.000000E+10
0.0
0.000000
H:1 C2O:1.0
CH:1.0 CO:1
C2O + O [=] CO + CO
5.000000E+10
0.0
0.000000
C2O:1.0 O:1
CO:2.0
C2O + OH [=] CO + CO + H
2.000000E+10
0.0
0.000000
C2O:1.0 OH:1
H:1 CO:2.0
C2O + O2 [=] CO + CO + O
2.000000E+10
0.0
0.000000
C2O:1.0 O2:1
CO:2.0 O:1
HCCO + H [=] CH2* + CO
1.000000E+11
0.0
0.000000
H:1 HCCO:1.0
CO:1 CH2*:1.0
HCCO + O [=] H + CO + CO
1.000000E+11
0.0
0.000000
HCCO:1.0 O:1
H:1.0 CO:2
HCCO + O2 [=] OH + 2 CO
1.600000E+09
0.0
854.000000
HCCO:1.0 O2:1
CO:2.0 OH:1.0
HCCO + CH [=] C2H2 + CO
5.000000E+10
0.0
0.000000
CH:1 HCCO:1.0
CO:1 C2H2:1.0
HCCO + CH2 [=] C2H3 + CO
3.000000E+10
0.0
0.000000
CH2:1 HCCO:1.0
CO:1 C2H3:1.0
HCCO + HCCO [=] C2H2 + CO + CO
1.000000E+10
0.0
0.000000
HCCO:2.0
CO:2 C2H2:1.0
HCCO + OH [=] C2O + H2O
3.000000E+10
0.0
0.000000
HCCO:1.0 OH:1
H2O:1 C2O:1.0
C2H2 (+ M) [=] H2CC (+ M)
8.000000E+14
-0.52
50750.000000
2.450000E+12
-0.64
49700.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 CH4:2.0 C2H6:3.0 C2H4:2.5 C2H2:2.5
C2H2:1.0
H2CC:1.0
C2H3 (+ M) [=] C2H2 + H (+ M)
3.860000E+08
1.62
37048.200000
2.565000E+24
-3.4
35798.720000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0 C2H4:3.0 C2H2:3.0
1.9816 5383.7 4.2932 -0.0795
C2H3:1.0
H:1 C2H2:1.0
C2H2 + O [=] C2H + OH
4.600000E+16
-1.41
28950.000000
C2H2:1.0 O:1
C2H:1.0 OH:1
C2H2 + O [=] CH2 + CO
4.080000E+03
2.0
1900.000000
C2H2:1.0 O:1
CH2:1.0 CO:1
C2H2 + O [=] HCCO + H
1.632000E+04
2.0
1900.000000
C2H2:1.0 O:1
H:1 HCCO:1.0
C2H2 + OH [=] CH2CO + H
2.180000E-07
4.5
-1000.000000
C2H2:1.0 OH:1
H:1 CH2CO:1.0
C2H2 + OH [=] HCCOH + H
5.040000E+02
2.3
13500.000000
C2H2:1.0 OH:1
H:1 HCCOH:1.0
C2H2 + OH [=] C2H + H2O
3.370000E+04
2.0
14000.000000
C2H2:1.0 OH:1
C2H:1.0 H2O:1
C2H2 + OH [=] CH3 + CO
4.830000E-07
4.0
-2000.000000
C2H2:1.0 OH:1
CH3:1.0 CO:1
C2H2 + HCO [=] C2H3 + CO
1.000000E+04
2.0
6000.000000
C2H2:1.0 HCO:1
CO:1 C2H3:1.0
C2H2 + CH2 [=] C3H3 + H
1.200000E+10
0.0
6620.000000
CH2:1 C2H2:1.0
H:1 C3H3:1.0
C2H2 + CH2* [=] C3H3 + H
2.000000E+10
0.0
0.000000
C2H2:1.0 CH2*:1
H:1 C3H3:1.0
C2H2 + C2H [=] C4H2 + H
9.600000E+10
0.0
0.000000
C2H:1 C2H2:1.0
H:1 C4H2:1.0
C2H2 + C2H (+ M) [=] nC4H3 (+ M)
8.300000E+07
0.899
-363.000000
1.240000E+25
-4.718
1871.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 CH4:2.0 C2H6:3.0 C2H4:2.5 C2H2:2.5
1 100 5613 13387
C2H:1 C2H2:1.0
nC4H3:1.0
C2H2 + C2H (+ M) [=] iC4H3 (+ M)
8.300000E+07
0.899
-363.000000
1.240000E+25
-4.718
1871.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 CH4:2.0 C2H6:3.0 C2H4:2.5 C2H2:2.5
1 100 5613 13387
C2H:1 C2H2:1.0
iC4H3:1.0
C2H2 + HCCO [=] C3H3 + CO
1.000000E+08
0.0
3000.000000
C2H2:1.0 HCCO:1
CO:1 C3H3:1.0
C2H2 + CH3 [=] pC3H4 + H
2.560000E+06
1.1
13644.000000
CH3:1 C2H2:1.0
H:1 pC3H4:1.0
C2H2 + CH3 [=] aC3H4 + H
5.140000E+06
0.86
22153.000000
CH3:1 C2H2:1.0
H:1 aC3H4:1.0
C2H2 + CH3 [=] CH3CCH2
4.990000E+19
-4.39
18850.000000
CH3:1 C2H2:1.0
CH3CCH2:1.0
C2H2 + CH3 [=] CH3CHCH
3.200000E+32
-7.76
13300.000000
CH3:1 C2H2:1.0
CH3CHCH:1.0
C2H2 + CH3 [=] aC3H5
2.680000E+50
-12.82
35730.000000
CH3:1 C2H2:1.0
aC3H5:1.0
H2CC + H [=] C2H2 + H
1.000000E+11
0.0
0.000000
H2CC:1.0 H:1
H:1 C2H2:1.0
H2CC + OH [=] CH2CO + H
2.000000E+10
0.0
0.000000
H2CC:1.0 OH:1
H:1 CH2CO:1.0
H2CC + O2 [=] HCO + HCO
1.000000E+10
0.0
0.000000
H2CC:1.0 O2:1
HCO:2.0
H2CC + C2H2 (+ M) [=] C4H4 (+ M)
3.500000E+02
2.055
-2400.000000
1.400000E+54
-12.599
7417.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 CH4:2.0 C2H6:3.0 C2H4:3.0 C2H2:3.0
0.98 56 580 4164
H2CC:1.0 C2H2:1
C4H4:1.0
H2CC + C2H4 [=] C4H6
1.000000E+09
0.0
0.000000
H2CC:1.0 C2H4:1
C4H6:1.0
CH2CO + H (+ M) [=] CH2CHO (+ M)
3.300000E+11
-0.06
8500.000000
3.800000E+35
-7.64
11900.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0 C2H4:3.0 C2H2:3.0
0.337 1707 3200 4131
H:1 CH2CO:1.0
CH2CHO:1.0
CH2CO + H [=] HCCO + H2
5.000000E+10
0.0
8000.000000
H:1 CH2CO:1.0
H2:1 HCCO:1.0
CH2CO + H [=] CH3 + CO
1.500000E+06
1.43
2690.000000
H:1 CH2CO:1.0
CH3:1.0 CO:1
CH2CO + O [=] HCCO + OH
1.000000E+10
0.0
8000.000000
CH2CO:1.0 O:1
HCCO:1.0 OH:1
CH2CO + O [=] CH2 + CO2
1.750000E+09
0.0
1350.000000
CH2CO:1.0 O:1
CH2:1.0 CO2:1
CH2CO + OH [=] HCCO + H2O
7.500000E+09
0.0
2000.000000
CH2CO:1.0 OH:1
H2O:1 HCCO:1.0
HCCOH + H [=] CH2CO + H
1.000000E+10
0.0
0.000000
H:1 HCCOH:1.0
H:1 CH2CO:1.0
C2H3 + H (+ M) [=] C2H4 (+ M)
6.080000E+09
0.27
280.000000
1.400000E+24
-3.86
3320.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0 C2H4:3.0 C2H2:3.0
0.782 207.5 2663 6095
H:1 C2H3:1.0
C2H4:1.0
C2H3 + H [=] C2H2 + H2
9.000000E+10
0.0
0.000000
H:1 C2H3:1.0
H2:1 C2H2:1.0
C2H3 + H [=] H2CC + H2
6.000000E+10
0.0
0.000000
H:1 C2H3:1.0
H2CC:1.0 H2:1
C2H3 + O [=] CH2CO + H
4.800000E+10
0.0
0.000000
C2H3:1.0 O:1
H:1 CH2CO:1.0
C2H3 + O [=] CH3 + CO
4.800000E+10
0.0
0.000000
C2H3:1.0 O:1
CH3:1.0 CO:1
C2H3 + OH [=] C2H2 + H2O
3.011000E+10
0.0
0.000000
C2H3:1.0 OH:1
H2O:1 C2H2:1.0
C2H3 + O2 [=] C2H2 + HO2
1.340000E+03
1.61
-383.400000
C2H3:1.0 O2:1
HO2:1 C2H2:1.0
C2H3 + O2 [=] CH2CHO + O
3.000000E+08
0.29
11.000000
C2H3:1.0 O2:1
CH2CHO:1.0 O:1
C2H3 + O2 [=] HCO + CH2O
4.600000E+13
-1.39
1010.000000
C2H3:1.0 O2:1
CH2O:1 HCO:1.0
C2H3 + HO2 [=] CH2CHO + OH
1.000000E+10
0.0
0.000000
HO2:1 C2H3:1.0
CH2CHO:1.0 OH:1
C2H3 + H2O2 [=] C2H4 + HO2
1.210000E+07
0.0
-596.000000
C2H3:1.0 H2O2:1
C2H4:1.0 HO2:1
C2H3 + HCO [=] C2H4 + CO
9.033000E+10
0.0
0.000000
C2H3:1.0 HCO:1
C2H4:1.0 CO:1
C2H3 + HCO [=] C2H3CHO
1.800000E+10
0.0
0.000000
C2H3:1.0 HCO:1
C2H3CHO:1.0
C2H3 + CH3 [=] C2H2 + CH4
3.920000E+08
0.0
0.000000
CH3:1 C2H3:1.0
CH4:1 C2H2:1.0
C2H3 + CH3 (+ M) [=] C3H6 (+ M)
2.500000E+10
0.0
0.000000
4.270000E+52
-11.94
9769.800000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0 C2H4:3.0 C2H2:3.0
0.175 1340.6 60000 10139.8
CH3:1 C2H3:1.0
C3H6:1.0
C2H3 + CH3 [=] aC3H5 + H
1.500000E+21
-2.83
18618.000000
CH3:1 C2H3:1.0
H:1 aC3H5:1.0
C2H3 + C2H2 [=] C4H4 + H
2.000000E+15
-1.68
10600.000000
C2H3:1.0 C2H2:1
H:1 C4H4:1.0
C2H3 + C2H2 [=] nC4H5
9.300000E+35
-8.76
12000.000000
C2H3:1.0 C2H2:1
nC4H5:1.0
C2H3 + C2H2 [=] iC4H5
1.600000E+43
-10.98
18600.000000
C2H3:1.0 C2H2:1
iC4H5:1.0
C2H3 + C2H3 [=] C4H6
1.500000E+39
-8.84
12483.000000
C2H3:2.0
C4H6:1.0
C2H3 + C2H3 [=] iC4H5 + H
1.200000E+19
-2.44
13654.000000
C2H3:2.0
H:1 iC4H5:1.0
C2H3 + C2H3 [=] nC4H5 + H
2.400000E+17
-2.04
15361.000000
C2H3:2.0
H:1 nC4H5:1.0
C2H3 + C2H3 [=] C2H2 + C2H4
9.600000E+08
0.0
0.000000
C2H3:2.0
C2H4:1 C2H2:1.0
CH2CHO [=] CH3 + CO
7.800000E+41
-9.147
46900.000000
CH2CHO:1.0
CH3:1.0 CO:1
CH2CHO + H (+ M) [=] CH3CHO (+ M)
1.000000E+11
0.0
0.000000
5.200000E+33
-7.297
4700.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 CH4:2.0 C2H6:3.0 C2H4:3.0 C2H2:3.0
0.55 8900 4350 7244
CH2CHO:1.0 H:1
CH3CHO:1.0
CH2CHO + H [=] CH3CO + H
5.000000E+09
0.0
0.000000
CH2CHO:1.0 H:1
H:1 CH3CO:1.0
CH2CHO + H [=] CH3 + HCO
9.000000E+10
0.0
0.000000
CH2CHO:1.0 H:1
CH3:1.0 HCO:1
CH2CHO + H [=] CH2CO + H2
2.000000E+10
0.0
4000.000000
CH2CHO:1.0 H:1
H2:1 CH2CO:1.0
CH2CHO + O [=] CH2CO + OH
2.000000E+10
0.0
4000.000000
CH2CHO:1.0 O:1
CH2CO:1.0 OH:1
CH2CHO + OH [=] CH2CO + H2O
1.000000E+10
0.0
2000.000000
CH2CHO:1.0 OH:1
CH2CO:1.0 H2O:1
CH2CHO + O2 [=] CH2CO + HO2
1.400000E+08
0.0
0.000000
CH2CHO:1.0 O2:1
CH2CO:1.0 HO2:1
CH2CHO + O2 [=] CH2O + CO + OH
1.800000E+07
0.0
0.000000
CH2CHO:1.0 O2:1
CH2O:1.0 CO:1 OH:1
CH3 + CO (+ M) [=] CH3CO (+ M)
4.850000E+04
1.65
6150.000000
7.800000E+24
-5.395
8600.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0 C2H4:3.0 C2H2:3.0
0.258 598 21002 1773
CH3:1.0 CO:1
CH3CO:1.0
CH3CO + H (+ M) [=] CH3CHO (+ M)
9.600000E+10
0.0
0.000000
3.850000E+38
-8.569
5500.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 CH4:2.0 C2H6:3.0 C2H4:3.0 C2H2:3.0
1 2900 2900 5132
H:1 CH3CO:1.0
CH3CHO:1.0
CH3CO + H [=] CH3 + HCO
9.600000E+10
0.0
0.000000
H:1 CH3CO:1.0
CH3:1.0 HCO:1
CH3CO + O [=] CH2CO + OH
3.900000E+10
0.0
0.000000
CH3CO:1.0 O:1
CH2CO:1.0 OH:1
CH3CO + O [=] CH3 + CO2
1.500000E+11
0.0
0.000000
CH3CO:1.0 O:1
CH3:1.0 CO2:1
CH3CO + OH [=] CH2CO + H2O
1.200000E+10
0.0
0.000000
CH3CO:1.0 OH:1
CH2CO:1.0 H2O:1
CH3CO + OH [=] CH3 + CO + OH
3.000000E+10
0.0
0.000000
CH3CO:1.0 OH:1
CH3:1.0 CO:1 OH:1
CH3CO + HO2 [=] CH3 + CO2 + OH
3.000000E+10
0.0
0.000000
CH3CO:1.0 HO2:1
CH3:1.0 CO2:1 OH:1
CH3CO + H2O2 [=] CH3CHO + HO2
1.800000E+08
0.0
8226.000000
CH3CO:1.0 H2O2:1
CH3CHO:1.0 HO2:1
CH3 + HCO (+ M) [=] CH3CHO (+ M)
1.800000E+10
0.0
0.000000
2.200000E+42
-9.588
5100.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 CH4:2.0 C2H6:3.0 C2H4:3.0 C2H2:3.0
0.6173 13.076 2078 5093
CH3:1.0 HCO:1
CH3CHO:1.0
CH3CHO + H [=] CH3CO + H2
4.100000E+06
1.16
2400.000000
H:1 CH3CHO:1.0
H2:1 CH3CO:1.0
CH3CHO + H [=] CH4 + HCO
5.000000E+07
0.0
0.000000
H:1 CH3CHO:1.0
CH4:1.0 HCO:1
CH3CHO + O [=] CH3CO + OH
5.800000E+09
0.0
1800.000000
CH3CHO:1.0 O:1
CH3CO:1.0 OH:1
CH3CHO + OH [=] CH3CO + H2O
2.350000E+07
0.73
-1110.000000
CH3CHO:1.0 OH:1
H2O:1 CH3CO:1.0
CH3CHO + CH3 [=] CH3CO + CH4
2.000000E-09
5.6
2460.000000
CH3CHO:1.0 CH3:1
CH3CO:1.0 CH4:1
CH3CHO + HCO [=] CO + HCO + CH4
8.000000E+09
0.0
10400.000000
CH3CHO:1.0 HCO:1
CH4:1 CO:1.0 HCO:1
CH3CHO + O2 [=] CH3CO + HO2
3.000000E+10
0.0
39100.000000
CH3CHO:1.0 O2:1
CH3CO:1.0 HO2:1
CH2OCH2 [=] CH3 + HCO
3.630000E+13
0.0
57200.000000
CH2OCH2:1.0
CH3:1.0 HCO:1
CH2OCH2 [=] CH3CHO
7.260000E+13
0.0
57200.000000
CH2OCH2:1.0
CH3CHO:1.0
CH2OCH2 [=] CH4 + CO
1.210000E+13
0.0
57200.000000
CH2OCH2:1.0
CO:1 CH4:1.0
CH2OCH2 + H [=] CH2OCH + H2
2.000000E+10
0.0
8300.000000
H:1 CH2OCH2:1.0
H2:1 CH2OCH:1.0
CH2OCH2 + H [=] C2H3 + H2O
5.000000E+06
0.0
5000.000000
H:1 CH2OCH2:1.0
H2O:1 C2H3:1.0
CH2OCH2 + H [=] C2H4 + OH
9.510000E+07
0.0
5000.000000
H:1 CH2OCH2:1.0
C2H4:1.0 OH:1
CH2OCH2 + O [=] CH2OCH + OH
1.910000E+09
0.0
5250.000000
CH2OCH2:1.0 O:1
CH2OCH:1.0 OH:1
CH2OCH2 + OH [=] CH2OCH + H2O
1.780000E+10
0.0
3610.000000
CH2OCH2:1.0 OH:1
H2O:1 CH2OCH:1.0
CH2OCH2 + CH3 [=] CH2OCH + CH4
1.070000E+09
0.0
11830.000000
CH2OCH2:1.0 CH3:1
CH2OCH:1.0 CH4:1
CH2OCH + M [=] CH3 + CO + M
3.160000E+11
0.0
12000.000000
CH2OCH:1.0
CH3:1.0 CO:1
CH2OCH + M [=] CH2CHO + M
5.000000E+06
0.0
0.000000
CH2OCH:1.0
CH2CHO:1.0
CH2OCH + M [=] CH2CO + H + M
3.000000E+10
0.0
8000.000000
CH2OCH:1.0
H:1 CH2CO:1.0
C2H4 (+ M) [=] H2 + H2CC (+ M)
8.000000E+12
0.44
88770.000000
7.000000E+47
-9.31
99860.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.7345 180 1035 5417
C2H4:1.0
H2:1.0 H2CC:1
C2H4 + H (+ M) [=] C2H5 (+ M)
1.367000E+06
1.463
1355.000000
2.027000E+33
-6.642
5769.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
-0.569 299 9147 -152.4
H:1 C2H4:1.0
C2H5:1.0
C2H4 + H [=] C2H3 + H2
5.070000E+04
1.9
12950.000000
H:1 C2H4:1.0
H2:1 C2H3:1.0
C2H4 + O [=] C2H3 + OH
1.510000E+04
1.9
3740.000000
C2H4:1.0 O:1
C2H3:1.0 OH:1
C2H4 + O [=] CH3 + HCO
1.920000E+04
1.83
220.000000
C2H4:1.0 O:1
CH3:1.0 HCO:1
C2H4 + O [=] CH2 + CH2O
3.840000E+02
1.83
220.000000
C2H4:1.0 O:1
CH2O:1 CH2:1.0
C2H4 + OH [=] C2H3 + H2O
3.600000E+03
2.0
2500.000000
C2H4:1.0 OH:1
H2O:1 C2H3:1.0
C2H4 + HCO [=] C2H5 + CO
1.000000E+04
2.0
8000.000000
C2H4:1.0 HCO:1
C2H5:1.0 CO:1
C2H4 + CH [=] aC3H4 + H
3.000000E+10
0.0
0.000000
CH:1 C2H4:1.0
H:1 aC3H4:1.0
C2H4 + CH [=] pC3H4 + H
3.000000E+10
0.0
0.000000
CH:1 C2H4:1.0
H:1 pC3H4:1.0
C2H4 + CH2 [=] aC3H5 + H
2.000000E+10
0.0
6000.000000
CH2:1 C2H4:1.0
H:1 aC3H5:1.0
C2H4 + CH2* [=] H2CC + CH4
5.000000E+10
0.0
0.000000
C2H4:1.0 CH2*:1
H2CC:1.0 CH4:1
C2H4 + CH2* [=] aC3H5 + H
5.000000E+10
0.0
0.000000
C2H4:1.0 CH2*:1
H:1 aC3H5:1.0
C2H4 + CH3 [=] C2H3 + CH4
2.270000E+02
2.0
9200.000000
CH3:1 C2H4:1.0
CH4:1 C2H3:1.0
C2H4 + CH3 [=] nC3H7
3.300000E+08
0.0
7700.000000
CH3:1 C2H4:1.0
nC3H7:1.0
C2H4 + C2H [=] C4H4 + H
1.200000E+10
0.0
0.000000
C2H:1 C2H4:1.0
H:1 C4H4:1.0
C2H4 + O2 [=] C2H3 + HO2
4.220000E+10
0.0
60800.000000
C2H4:1.0 O2:1
HO2:1 C2H3:1.0
C2H4 + C2H3 [=] C4H7
7.930000E+35
-8.47
14220.000000
C2H4:1.0 C2H3:1
C4H7:1.0
C2H4 + HO2 [=] CH2OCH2 + OH
2.820000E+09
0.0
17100.000000
C2H4:1.0 HO2:1
CH2OCH2:1.0 OH:1
C2H5 + H (+ M) [=] C2H6 (+ M)
5.210000E+14
-0.99
1580.000000
1.990000E+35
-7.08
6685.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.8422 125 2219 6882
H:1 C2H5:1.0
C2H6:1.0
C2H5 + H [=] C2H4 + H2
2.000000E+09
0.0
0.000000
H:1 C2H5:1.0
H2:1 C2H4:1.0
C2H5 + O [=] CH3 + CH2O
1.604000E+10
0.0
0.000000
C2H5:1.0 O:1
CH2O:1 CH3:1.0
C2H5 + O [=] CH3CHO + H
8.020000E+10
0.0
0.000000
C2H5:1.0 O:1
H:1 CH3CHO:1.0
C2H5 + O2 [=] C2H4 + HO2
2.000000E+07
0.0
0.000000
C2H5:1.0 O2:1
C2H4:1.0 HO2:1
C2H5 + HO2 [=] C2H6 + O2
3.000000E+08
0.0
0.000000
C2H5:1.0 HO2:1
C2H6:1.0 O2:1
C2H5 + HO2 [=] C2H4 + H2O2
3.000000E+08
0.0
0.000000
C2H5:1.0 HO2:1
C2H4:1.0 H2O2:1
C2H5 + HO2 [=] CH3 + CH2O + OH
2.400000E+10
0.0
0.000000
C2H5:1.0 HO2:1
CH2O:1 CH3:1.0 OH:1
C2H5 + H2O2 [=] C2H6 + HO2
8.700000E+06
0.0
974.000000
C2H5:1.0 H2O2:1
C2H6:1.0 HO2:1
C2H5 + CH3 (+ M) [=] C3H8 (+ M)
4.900000E+11
-0.5
0.000000
6.800000E+55
-13.42
6000.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
1 1000 1433.9 5328.8
C2H5:1.0 CH3:1
C3H8:1.0
C2H5 + C2H3 (+ M) [=] C4H81 (+ M)
1.500000E+10
0.0
0.000000
1.550000E+50
-11.79
8984.500000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.198 2277.9 60000 5723.2
C2H5:1.0 C2H3:1
C4H81:1.0
C2H5 + C2H3 [=] aC3H5 + CH3
3.900000E+29
-5.22
19747.000000
C2H5:1.0 C2H3:1
CH3:1 aC3H5:1.0
C2H6 + H [=] C2H5 + H2
1.150000E+05
1.9
7530.000000
C2H6:1.0 H:1
H2:1 C2H5:1.0
C2H6 + O [=] C2H5 + OH
8.980000E+04
1.92
5690.000000
C2H6:1.0 O:1
C2H5:1.0 OH:1
C2H6 + OH [=] C2H5 + H2O
3.540000E+03
2.12
870.000000
C2H6:1.0 OH:1
C2H5:1.0 H2O:1
C2H6 + CH2* [=] C2H5 + CH3
4.000000E+10
0.0
-550.000000
C2H6:1.0 CH2*:1
C2H5:1.0 CH3:1
C2H6 + CH3 [=] C2H5 + CH4
6.140000E+03
1.74
10450.000000
C2H6:1.0 CH3:1
C2H5:1.0 CH4:1
C3H3 + H [=] pC3H4
1.500000E+10
0.0
0.000000
H:1 C3H3:1.0
pC3H4:1.0
C3H3 + H [=] aC3H4
2.500000E+09
0.0
0.000000
H:1 C3H3:1.0
aC3H4:1.0
C3H3 + O [=] CH2O + C2H
2.000000E+10
0.0
0.000000
C3H3:1.0 O:1
CH2O:1.0 C2H:1
C3H3 + O2 [=] CH2CO + HCO
3.000000E+07
0.0
2868.000000
C3H3:1.0 O2:1
CH2CO:1.0 HCO:1
C3H3 + HO2 [=] OH + CO + C2H3
8.000000E+08
0.0
0.000000
HO2:1 C3H3:1.0
C2H3:1 CO:1 OH:1.0
C3H3 + HO2 [=] aC3H4 + O2
3.000000E+08
0.0
0.000000
HO2:1 C3H3:1.0
aC3H4:1.0 O2:1
C3H3 + HO2 [=] pC3H4 + O2
2.500000E+09
0.0
0.000000
HO2:1 C3H3:1.0
pC3H4:1.0 O2:1
C3H3 + HCO [=] aC3H4 + CO
2.500000E+10
0.0
0.000000
C3H3:1.0 HCO:1
aC3H4:1.0 CO:1
C3H3 + HCO [=] pC3H4 + CO
2.500000E+10
0.0
0.000000
C3H3:1.0 HCO:1
pC3H4:1.0 CO:1
C3H3 + HCCO [=] C4H4 + CO
2.500000E+10
0.0
0.000000
C3H3:1.0 HCCO:1
CO:1 C4H4:1.0
C3H3 + CH [=] iC4H3 + H
5.000000E+10
0.0
0.000000
CH:1 C3H3:1.0
H:1 iC4H3:1.0
C3H3 + CH2 [=] C4H4 + H
5.000000E+10
0.0
0.000000
CH2:1 C3H3:1.0
H:1 C4H4:1.0
C3H3 + CH3 (+ M) [=] C4H612 (+ M)
1.500000E+09
0.0
0.000000
2.600000E+51
-11.94
9770.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.175 1340.6 60000 9769.8
CH3:1 C3H3:1.0
C4H612:1.0
C3H3 + C2H2 [=] C5H5
6.870000E+52
-12.5
42025.000000
C3H3:1.0 C2H2:1
C5H5:1.0
C3H3 + C3H3 =] C6H5 + H
5.000000E+09
0.0
0.000000
C3H3:2.0
H:1 C6H5:1.0
C3H3 + C3H3 =] C6H6
2.000000E+09
0.0
0.000000
C3H3:2.0
C6H6:1.0
C3H3 + C4H4 [=] C6H5CH2
6.530000E+02
1.28
-4611.000000
C3H3:1.0 C4H4:1
C6H5CH2:1.0
C3H3 + C4H6 [=] C6H5CH3 + H
6.530000E+02
1.28
-4611.000000
C3H3:1.0 C4H6:1
C6H5CH3:1.0 H:1
aC3H4 + H [=] C3H3 + H2
1.300000E+03
2.0
5500.000000
H:1 aC3H4:1.0
H2:1 C3H3:1.0
aC3H4 + H [=] CH3CHCH
5.400000E+26
-6.09
16300.000000
H:1 aC3H4:1.0
CH3CHCH:1.0
aC3H4 + H [=] CH3CCH2
9.460000E+39
-9.43
11190.000000
H:1 aC3H4:1.0
CH3CCH2:1.0
aC3H4 + H [=] aC3H5
1.520000E+56
-13.54
26949.000000
H:1 aC3H4:1.0
aC3H5:1.0
aC3H4 + O [=] C2H4 + CO
2.000000E+04
1.8
1000.000000
aC3H4:1.0 O:1
C2H4:1.0 CO:1
aC3H4 + OH [=] C3H3 + H2O
5.300000E+03
2.0
2000.000000
aC3H4:1.0 OH:1
H2O:1 C3H3:1.0
aC3H4 + CH3 [=] C3H3 + CH4
1.300000E+09
0.0
7700.000000
aC3H4:1.0 CH3:1
CH4:1 C3H3:1.0
aC3H4 + CH3 [=] iC4H7
2.000000E+08
0.0
7500.000000
aC3H4:1.0 CH3:1
iC4H7:1.0
aC3H4 + C2H [=] C2H2 + C3H3
1.000000E+10
0.0
0.000000
aC3H4:1.0 C2H:1
C2H2:1.0 C3H3:1
pC3H4 [=] cC3H4
1.200000E+44
-9.92
69250.000000
pC3H4:1.0
cC3H4:1.0
pC3H4 [=] aC3H4
5.150000E+60
-13.93
91117.000000
pC3H4:1.0
aC3H4:1.0
pC3H4 + H [=] aC3H4 + H
6.270000E+14
-0.91
10079.000000
H:1 pC3H4:1.0
H:1 aC3H4:1.0
pC3H4 + H [=] CH3CCH2
1.660000E+44
-10.58
13690.000000
H:1 pC3H4:1.0
CH3CCH2:1.0
pC3H4 + H [=] CH3CHCH
5.500000E+25
-5.74
4300.000000
H:1 pC3H4:1.0
CH3CHCH:1.0
pC3H4 + H [=] aC3H5
4.910000E+57
-14.37
31644.000000
H:1 pC3H4:1.0
aC3H5:1.0
pC3H4 + H [=] C3H3 + H2
1.300000E+03
2.0
5500.000000
H:1 pC3H4:1.0
H2:1 C3H3:1.0
pC3H4 + C3H3 [=] aC3H4 + C3H3
6.140000E+03
1.74
10450.000000
pC3H4:1.0 C3H3:1
aC3H4:1.0 C3H3:1
pC3H4 + O [=] HCCO + CH3
7.300000E+09
0.0
2250.000000
pC3H4:1.0 O:1
CH3:1 HCCO:1.0
pC3H4 + O [=] C2H4 + CO
1.000000E+10
0.0
2250.000000
pC3H4:1.0 O:1
C2H4:1.0 CO:1
pC3H4 + OH [=] C3H3 + H2O
1.000000E+03
2.0
100.000000
pC3H4:1.0 OH:1
H2O:1 C3H3:1.0
pC3H4 + C2H [=] C2H2 + C3H3
1.000000E+10
0.0
0.000000
C2H:1 pC3H4:1.0
C2H2:1.0 C3H3:1
pC3H4 + CH3 [=] C3H3 + CH4
1.800000E+09
0.0
7700.000000
CH3:1 pC3H4:1.0
CH4:1 C3H3:1.0
cC3H4 [=] aC3H4
4.890000E+41
-9.17
49594.000000
cC3H4:1.0
aC3H4:1.0
aC3H5 + H (+ M) [=] C3H6 (+ M)
2.000000E+11
0.0
0.000000
1.330000E+54
-12.0
5967.800000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.02 1096.6 1096.6 6859.5
H:1 aC3H5:1.0
C3H6:1.0
aC3H5 + H [=] aC3H4 + H2
1.800000E+10
0.0
0.000000
H:1 aC3H5:1.0
H2:1 aC3H4:1.0
aC3H5 + O [=] C2H3CHO + H
6.000000E+10
0.0
0.000000
aC3H5:1.0 O:1
H:1 C2H3CHO:1.0
aC3H5 + OH [=] C2H3CHO + H + H
4.200000E+29
-5.16
30126.000000
aC3H5:1.0 OH:1
H:2 C2H3CHO:1.0
aC3H5 + OH [=] aC3H4 + H2O
6.000000E+09
0.0
0.000000
aC3H5:1.0 OH:1
aC3H4:1.0 H2O:1
aC3H5 + O2 [=] aC3H4 + HO2
4.990000E+12
-1.4
22428.000000
aC3H5:1.0 O2:1
aC3H4:1.0 HO2:1
aC3H5 + O2 [=] CH3CO + CH2O
1.190000E+12
-1.01
20128.000000
aC3H5:1.0 O2:1
CH2O:1 CH3CO:1.0
aC3H5 + O2 [=] C2H3CHO + OH
1.820000E+10
-0.41
22859.000000
aC3H5:1.0 O2:1
C2H3CHO:1.0 OH:1
aC3H5 + HO2 [=] C3H6 + O2
2.660000E+09
0.0
0.000000
aC3H5:1.0 HO2:1
C3H6:1.0 O2:1
aC3H5 + HO2 [=] OH + C2H3 + CH2O
6.600000E+09
0.0
0.000000
aC3H5:1.0 HO2:1
CH2O:1 C2H3:1 OH:1.0
aC3H5 + HCO [=] C3H6 + CO
6.000000E+10
0.0
0.000000
aC3H5:1.0 HCO:1
C3H6:1.0 CO:1
aC3H5 + CH3 (+ M) [=] C4H81 (+ M)
1.000000E+11
-0.32
-262.300000
3.910000E+54
-12.81
6250.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.104 1606 60000 6118.4
CH3:1 aC3H5:1.0
C4H81:1.0
aC3H5 + CH3 [=] aC3H4 + CH4
3.000000E+09
-0.32
-131.000000
CH3:1 aC3H5:1.0
aC3H4:1.0 CH4:1
aC3H5 [=] CH3CCH2
7.060000E+56
-14.08
75868.000000
aC3H5:1.0
CH3CCH2:1.0
aC3H5 [=] CH3CHCH
5.000000E+51
-13.02
73300.000000
aC3H5:1.0
CH3CHCH:1.0
aC3H5 + C2H2 [=] lC5H7
8.380000E+27
-6.242
12824.000000
aC3H5:1.0 C2H2:1
lC5H7:1.0
CH3CCH2 [=] CH3CHCH
1.500000E+48
-12.71
53900.000000
CH3CCH2:1.0
CH3CHCH:1.0
CH3CCH2 + H [=] pC3H4 + H2
3.340000E+09
0.0
0.000000
H:1 CH3CCH2:1.0
H2:1 pC3H4:1.0
CH3CCH2 + O [=] CH3 + CH2CO
6.000000E+10
0.0
0.000000
O:1 CH3CCH2:1.0
CH2CO:1 CH3:1.0
CH3CCH2 + OH [=] CH3 + CH2CO + H
5.000000E+09
0.0
0.000000
OH:1 CH3CCH2:1.0
H:1 CH2CO:1 CH3:1.0
CH3CCH2 + O2 [=] CH3CO + CH2O
1.000000E+08
0.0
0.000000
O2:1 CH3CCH2:1.0
CH2O:1 CH3CO:1.0
CH3CCH2 + HO2 [=] CH3 + CH2CO + OH
2.000000E+10
0.0
0.000000
HO2:1 CH3CCH2:1.0
CH2CO:1 CH3:1.0 OH:1
CH3CCH2 + HCO [=] C3H6 + CO
9.000000E+10
0.0
0.000000
HCO:1 CH3CCH2:1.0
C3H6:1.0 CO:1
CH3CCH2 + CH3 [=] pC3H4 + CH4
1.000000E+08
0.0
0.000000
CH3:1 CH3CCH2:1.0
pC3H4:1.0 CH4:1
CH3CCH2 + CH3 [=] iC4H8
2.000000E+10
0.0
0.000000
CH3:1 CH3CCH2:1.0
iC4H8:1.0
CH3CHCH + H [=] pC3H4 + H2
3.340000E+09
0.0
0.000000
H:1 CH3CHCH:1.0
H2:1 pC3H4:1.0
CH3CHCH + O [=] C2H4 + HCO
6.000000E+10
0.0
0.000000
O:1 CH3CHCH:1.0
C2H4:1.0 HCO:1
CH3CHCH + OH [=] C2H4 + HCO + H
5.000000E+09
0.0
0.000000
OH:1 CH3CHCH:1.0
H:1 C2H4:1.0 HCO:1
CH3CHCH + O2 [=] CH3CHO + HCO
1.000000E+08
0.0
0.000000
O2:1 CH3CHCH:1.0
CH3CHO:1.0 HCO:1
CH3CHCH + HO2 [=] C2H4 + HCO + OH
2.000000E+10
0.0
0.000000
HO2:1 CH3CHCH:1.0
C2H4:1.0 HCO:1 OH:1
CH3CHCH + HCO [=] C3H6 + CO
9.000000E+10
0.0
0.000000
HCO:1 CH3CHCH:1.0
C3H6:1.0 CO:1
CH3CHCH + CH3 [=] pC3H4 + CH4
1.000000E+08
0.0
0.000000
CH3:1 CH3CHCH:1.0
pC3H4:1.0 CH4:1
C3H6 + H (+ M) [=] nC3H7 (+ M)
1.330000E+10
0.0
3260.700000
6.260000E+32
-6.66
7000.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
1 1000 1310 48097
C3H6:1.0 H:1
nC3H7:1.0
C3H6 + H (+ M) [=] iC3H7 (+ M)
1.330000E+10
0.0
1559.800000
8.700000E+36
-7.5
4721.800000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
1 1000 645.4 6844.3
C3H6:1.0 H:1
iC3H7:1.0
C3H6 + H [=] C2H4 + CH3
8.000000E+18
-2.39
11180.000000
C3H6:1.0 H:1
CH3:1 C2H4:1.0
C3H6 + H [=] aC3H5 + H2
1.730000E+02
2.5
2490.000000
C3H6:1.0 H:1
H2:1 aC3H5:1.0
C3H6 + H [=] CH3CCH2 + H2
4.000000E+02
2.5
9790.000000
C3H6:1.0 H:1
H2:1 CH3CCH2:1.0
C3H6 + H [=] CH3CHCH + H2
8.040000E+02
2.5
12283.000000
C3H6:1.0 H:1
H2:1 CH3CHCH:1.0
C3H6 + O [=] CH2CO + CH3 + H
8.000000E+04
1.65
327.000000
C3H6:1.0 O:1
H:1 CH2CO:1.0 CH3:1
C3H6 + O [=] C2H3CHO + H + H
4.000000E+04
1.65
327.000000
C3H6:1.0 O:1
H:2 C2H3CHO:1.0
C3H6 + O [=] C2H5 + HCO
3.500000E+04
1.65
-972.000000
C3H6:1.0 O:1
C2H5:1.0 HCO:1
C3H6 + O [=] aC3H5 + OH
1.800000E+08
0.7
5880.000000
C3H6:1.0 O:1
aC3H5:1.0 OH:1
C3H6 + O [=] CH3CCH2 + OH
6.000000E+07
0.7
7630.000000
C3H6:1.0 O:1
OH:1 CH3CCH2:1.0
C3H6 + O [=] CH3CHCH + OH
1.210000E+08
0.7
8960.000000
C3H6:1.0 O:1
OH:1 CH3CHCH:1.0
C3H6 + OH [=] aC3H5 + H2O
3.100000E+03
2.0
-298.000000
C3H6:1.0 OH:1
H2O:1 aC3H5:1.0
C3H6 + OH [=] CH3CCH2 + H2O
1.100000E+03
2.0
1450.000000
C3H6:1.0 OH:1
H2O:1 CH3CCH2:1.0
C3H6 + OH [=] CH3CHCH + H2O
2.140000E+03
2.0
2778.000000
C3H6:1.0 OH:1
H2O:1 CH3CHCH:1.0
C3H6 + HO2 [=] aC3H5 + H2O2
9.600000E+00
2.6
13910.000000
C3H6:1.0 HO2:1
aC3H5:1.0 H2O2:1
C3H6 + CH3 [=] aC3H5 + CH4
2.200000E-03
3.5
5675.000000
C3H6:1.0 CH3:1
aC3H5:1.0 CH4:1
C3H6 + CH3 [=] CH3CCH2 + CH4
8.400000E-04
3.5
11660.000000
C3H6:1.0 CH3:1
CH4:1 CH3CCH2:1.0
C3H6 + CH3 [=] CH3CHCH + CH4
1.350000E-03
3.5
12848.000000
C3H6:1.0 CH3:1
CH4:1 CH3CHCH:1.0
C3H6 + C2H3 [=] C4H6 + CH3
7.230000E+08
0.0
5000.000000
C3H6:1.0 C2H3:1
CH3:1 C4H6:1.0
C3H6 + HO2 [=] CH3CHOCH2 + OH
1.090000E+09
0.0
14200.000000
C3H6:1.0 HO2:1
CH3CHOCH2:1.0 OH:1
C2H3CHO + H [=] C2H4 + HCO
1.080000E+08
0.454
5820.000000
H:1 C2H3CHO:1.0
C2H4:1.0 HCO:1
C2H3CHO + O [=] C2H3 + OH + CO
3.000000E+10
0.0
3540.000000
C2H3CHO:1.0 O:1
CO:1 C2H3:1.0 OH:1
C2H3CHO + O [=] CH2O + CH2CO
1.900000E+04
1.8
220.000000
C2H3CHO:1.0 O:1
CH2O:1.0 CH2CO:1
C2H3CHO + OH [=] C2H3 + H2O + CO
3.430000E+06
1.18
-447.000000
C2H3CHO:1.0 OH:1
CO:1 H2O:1 C2H3:1.0
C2H3CHO + CH3 [=] CH2CHCO + CH4
2.000000E+10
0.0
11000.000000
CH3:1 C2H3CHO:1.0
CH2CHCO:1.0 CH4:1
C2H3CHO + C2H3 [=] C4H6 + HCO
2.800000E+18
-2.44
14720.000000
C2H3CHO:1.0 C2H3:1
HCO:1 C4H6:1.0
CH2CHCO [=] C2H3 + CO
1.000000E+14
0.0
27000.000000
CH2CHCO:1.0
CO:1 C2H3:1.0
CH2CHCO + H [=] C2H3CHO
1.000000E+11
0.0
0.000000
CH2CHCO:1.0 H:1
C2H3CHO:1.0
CH3CHOCH2 [=] CH3CH2CHO
1.840000E+14
0.0
58500.000000
CH3CHOCH2:1.0
CH3CH2CHO:1.0
CH3CHOCH2 [=] C2H5 + HCO
2.450000E+13
0.0
58500.000000
CH3CHOCH2:1.0
C2H5:1.0 HCO:1
CH3CHOCH2 [=] CH3 + CH2CHO
2.450000E+13
0.0
58800.000000
CH3CHOCH2:1.0
CH2CHO:1 CH3:1.0
CH3CHOCH2 [=] CH3COCH3
1.010000E+14
0.0
59900.000000
CH3CHOCH2:1.0
CH3COCH3:1.0
CH3CHOCH2 [=] CH3 + CH3CO
4.540000E+13
0.0
59900.000000
CH3CHOCH2:1.0
CH3:1.0 CH3CO:1
iC3H7 + H (+ M) [=] C3H8 (+ M)
2.400000E+10
0.0
0.000000
1.700000E+52
-12.08
11263.700000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.649 1213.1 1213.1 13369.7
iC3H7:1.0 H:1
C3H8:1.0
iC3H7 + H [=] CH3 + C2H5
1.400000E+25
-3.94
15916.000000
iC3H7:1.0 H:1
C2H5:1 CH3:1.0
iC3H7 + H [=] C3H6 + H2
3.200000E+09
0.0
0.000000
iC3H7:1.0 H:1
C3H6:1.0 H2:1
iC3H7 + O [=] CH3CHO + CH3
9.600000E+10
0.0
0.000000
iC3H7:1.0 O:1
CH3CHO:1.0 CH3:1
iC3H7 + OH [=] C3H6 + H2O
2.400000E+10
0.0
0.000000
iC3H7:1.0 OH:1
C3H6:1.0 H2O:1
iC3H7 + O2 [=] C3H6 + HO2
1.300000E+08
0.0
0.000000
iC3H7:1.0 O2:1
C3H6:1.0 HO2:1
iC3H7 + HO2 [=] CH3CHO + CH3 + OH
2.400000E+10
0.0
0.000000
iC3H7:1.0 HO2:1
CH3CHO:1.0 CH3:1 OH:1
iC3H7 + HCO [=] C3H8 + CO
1.200000E+11
0.0
0.000000
iC3H7:1.0 HCO:1
CO:1 C3H8:1.0
iC3H7 + CH3 [=] CH4 + C3H6
2.200000E+11
-0.68
0.000000
iC3H7:1.0 CH3:1
C3H6:1 CH4:1.0
nC3H7 + H (+ M) [=] C3H8 (+ M)
3.600000E+10
0.0
0.000000
3.010000E+42
-9.32
5833.600000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.498 1314 1314 50000
H:1 nC3H7:1.0
C3H8:1.0
nC3H7 + H [=] C2H5 + CH3
3.700000E+21
-2.92
12505.000000
H:1 nC3H7:1.0
C2H5:1.0 CH3:1
nC3H7 + H [=] C3H6 + H2
1.800000E+09
0.0
0.000000
H:1 nC3H7:1.0
C3H6:1.0 H2:1
nC3H7 + O [=] C2H5 + CH2O
9.600000E+10
0.0
0.000000
nC3H7:1.0 O:1
CH2O:1 C2H5:1.0
nC3H7 + OH [=] C3H6 + H2O
2.400000E+10
0.0
0.000000
nC3H7:1.0 OH:1
C3H6:1.0 H2O:1
nC3H7 + O2 [=] C3H6 + HO2
9.000000E+07
0.0
0.000000
nC3H7:1.0 O2:1
C3H6:1.0 HO2:1
nC3H7 + HO2 [=] C2H5 + OH + CH2O
2.400000E+10
0.0
0.000000
nC3H7:1.0 HO2:1
CH2O:1 C2H5:1.0 OH:1
nC3H7 + HCO [=] C3H8 + CO
6.000000E+10
0.0
0.000000
nC3H7:1.0 HCO:1
CO:1 C3H8:1.0
nC3H7 + CH3 [=] CH4 + C3H6
1.100000E+10
0.0
0.000000
nC3H7:1.0 CH3:1
C3H6:1 CH4:1.0
C3H8 + H [=] H2 + nC3H7
1.300000E+03
2.54
6756.000000
H:1 C3H8:1.0
H2:1.0 nC3H7:1
C3H8 + H [=] H2 + iC3H7
1.300000E+03
2.4
4471.000000
H:1 C3H8:1.0
H2:1.0 iC3H7:1
C3H8 + O [=] nC3H7 + OH
1.900000E+02
2.68
3716.000000
O:1 C3H8:1.0
nC3H7:1.0 OH:1
C3H8 + O [=] iC3H7 + OH
4.760000E+01
2.71
2106.000000
O:1 C3H8:1.0
iC3H7:1.0 OH:1
C3H8 + OH [=] nC3H7 + H2O
1.400000E+00
2.66
527.000000
C3H8:1.0 OH:1
nC3H7:1.0 H2O:1
C3H8 + OH [=] iC3H7 + H2O
2.700000E+01
2.39
393.000000
C3H8:1.0 OH:1
iC3H7:1.0 H2O:1
C3H8 + O2 [=] nC3H7 + HO2
4.000000E+10
0.0
50930.000000
O2:1 C3H8:1.0
nC3H7:1.0 HO2:1
C3H8 + O2 [=] iC3H7 + HO2
4.000000E+10
0.0
47590.000000
O2:1 C3H8:1.0
iC3H7:1.0 HO2:1
C3H8 + HO2 [=] nC3H7 + H2O2
4.760000E+01
2.55
16490.000000
HO2:1 C3H8:1.0
nC3H7:1.0 H2O2:1
C3H8 + HO2 [=] iC3H7 + H2O2
9.640000E+00
2.6
13910.000000
HO2:1 C3H8:1.0
iC3H7:1.0 H2O2:1
C3H8 + CH3 [=] CH4 + nC3H7
9.030000E-04
3.65
7153.000000
CH3:1 C3H8:1.0
nC3H7:1 CH4:1.0
C3H8 + CH3 [=] CH4 + iC3H7
1.510000E-03
3.46
5480.000000
CH3:1 C3H8:1.0
iC3H7:1 CH4:1.0
C4H2 + H [=] nC4H3
1.100000E+39
-8.72
15300.000000
H:1 C4H2:1.0
nC4H3:1.0
C4H2 + H [=] iC4H3
1.100000E+27
-4.92
10800.000000
H:1 C4H2:1.0
iC4H3:1.0
C4H2 + OH [=] H2C4O + H
6.600000E+09
0.0
-410.000000
C4H2:1.0 OH:1
H:1 H2C4O:1.0
C4H2 + C2H [=] C6H2 + H
9.600000E+10
0.0
0.000000
C2H:1 C4H2:1.0
C6H2:1.0 H:1
C4H2 + C2H [=] C6H3
4.500000E+34
-7.68
7100.000000
C2H:1 C4H2:1.0
C6H3:1.0
H2C4O + H [=] C2H2 + HCCO
5.000000E+10
0.0
3000.000000
H:1 H2C4O:1.0
C2H2:1.0 HCCO:1
H2C4O + OH [=] CH2CO + HCCO
1.000000E+04
2.0
2000.000000
H2C4O:1.0 OH:1
CH2CO:1.0 HCCO:1
nC4H3 [=] iC4H3
4.100000E+43
-9.49
53000.000000
nC4H3:1.0
iC4H3:1.0
nC4H3 + H [=] iC4H3 + H
2.500000E+17
-1.67
10800.000000
nC4H3:1.0 H:1
H:1 iC4H3:1.0
nC4H3 + H [=] C2H2 + H2CC
6.300000E+22
-3.34
10014.000000
nC4H3:1.0 H:1
H2CC:1 C2H2:1.0
nC4H3 + H [=] C4H4
2.000000E+44
-10.26
13070.000000
nC4H3:1.0 H:1
C4H4:1.0
nC4H3 + H [=] C4H2 + H2
3.000000E+10
0.0
0.000000
nC4H3:1.0 H:1
H2:1 C4H2:1.0
nC4H3 + OH [=] C4H2 + H2O
2.000000E+09
0.0
0.000000
nC4H3:1.0 OH:1
H2O:1 C4H2:1.0
nC4H3 + C2H2 [=] l-C6H4 + H
2.500000E+11
-0.56
10600.000000
nC4H3:1.0 C2H2:1
H:1 l-C6H4:1.0
nC4H3 + C2H2 [=] C6H5
9.600000E+67
-17.77
31300.000000
nC4H3:1.0 C2H2:1
C6H5:1.0
nC4H3 + C2H2 [=] o-C6H4 + H
6.900000E+43
-10.01
30100.000000
nC4H3:1.0 C2H2:1
H:1 o-C6H4:1.0
iC4H3 + H [=] C2H2 + H2CC
2.800000E+20
-2.55
10780.000000
H:1 iC4H3:1.0
H2CC:1 C2H2:1.0
iC4H3 + H [=] C4H4
3.400000E+40
-9.01
12120.000000
H:1 iC4H3:1.0
C4H4:1.0
iC4H3 + H [=] C4H2 + H2
6.000000E+10
0.0
0.000000
H:1 iC4H3:1.0
H2:1 C4H2:1.0
iC4H3 + OH [=] C4H2 + H2O
4.000000E+09
0.0
0.000000
iC4H3:1.0 OH:1
H2O:1 C4H2:1.0
iC4H3 + O2 [=] HCCO + CH2CO
7.860000E+13
-1.8
0.000000
iC4H3:1.0 O2:1
CH2CO:1 HCCO:1.0
C4H4 + H [=] nC4H5
1.300000E+48
-11.92
16500.000000
H:1 C4H4:1.0
nC4H5:1.0
C4H4 + H [=] iC4H5
4.900000E+48
-11.92
17700.000000
H:1 C4H4:1.0
iC4H5:1.0
C4H4 + H [=] nC4H3 + H2
6.650000E+02
2.53
12240.000000
H:1 C4H4:1.0
H2:1 nC4H3:1.0
C4H4 + H [=] iC4H3 + H2
3.330000E+02
2.53
9240.000000
H:1 C4H4:1.0
H2:1 iC4H3:1.0
C4H4 + OH [=] nC4H3 + H2O
3.100000E+04
2.0
3430.000000
C4H4:1.0 OH:1
nC4H3:1.0 H2O:1
C4H4 + OH [=] iC4H3 + H2O
1.550000E+04
2.0
430.000000
C4H4:1.0 OH:1
iC4H3:1.0 H2O:1
C4H4 + O [=] C3H3 + HCO
6.000000E+05
1.45
-860.000000
C4H4:1.0 O:1
C3H3:1.0 HCO:1
C4H4 + C2H [=] l-C6H4 + H
1.200000E+10
0.0
0.000000
C2H:1 C4H4:1.0
H:1 l-C6H4:1.0
nC4H5 [=] iC4H5
1.500000E+67
-16.89
59100.000000
nC4H5:1.0
iC4H5:1.0
nC4H5 + H [=] iC4H5 + H
3.100000E+23
-3.35
17423.000000
H:1 nC4H5:1.0
H:1 iC4H5:1.0
nC4H5 + H [=] C4H4 + H2
1.500000E+10
0.0
0.000000
H:1 nC4H5:1.0
H2:1 C4H4:1.0
nC4H5 + OH [=] C4H4 + H2O
2.000000E+09
0.0
0.000000
OH:1 nC4H5:1.0
H2O:1 C4H4:1.0
nC4H5 + HCO [=] C4H6 + CO
5.000000E+09
0.0
0.000000
HCO:1 nC4H5:1.0
CO:1 C4H6:1.0
nC4H5 + HO2 [=] C2H3 + CH2CO + OH
6.600000E+09
0.0
0.000000
HO2:1 nC4H5:1.0
CH2CO:1 C2H3:1.0 OH:1
nC4H5 + H2O2 [=] C4H6 + HO2
1.210000E+07
0.0
-596.000000
H2O2:1 nC4H5:1.0
HO2:1 C4H6:1.0
nC4H5 + HO2 [=] C4H6 + O2
6.000000E+08
0.0
0.000000
HO2:1 nC4H5:1.0
O2:1 C4H6:1.0
nC4H5 + O2 [=] CH2CHCHCHO + O
3.000000E+08
0.29
11.000000
O2:1 nC4H5:1.0
CH2CHCHCHO:1.0 O:1
nC4H5 + O2 [=] HCO + C2H3CHO
9.200000E+13
-1.39
1010.000000
O2:1 nC4H5:1.0
C2H3CHO:1 HCO:1.0
nC4H5 + C2H2 [=] C6H6 + H
1.600000E+13
-1.33
5400.000000
C2H2:1 nC4H5:1.0
H:1 C6H6:1.0
nC4H5 + C2H3 [=] C6H6 + H2
1.840000E-16
7.07
-3611.000000
C2H3:1 nC4H5:1.0
H2:1 C6H6:1.0
iC4H5 + H [=] C4H4 + H2
3.000000E+10
0.0
0.000000
H:1 iC4H5:1.0
H2:1 C4H4:1.0
iC4H5 + H [=] C3H3 + CH3
2.000000E+10
0.0
2000.000000
H:1 iC4H5:1.0
CH3:1 C3H3:1.0
iC4H5 + OH [=] C4H4 + H2O
4.000000E+09
0.0
0.000000
iC4H5:1.0 OH:1
H2O:1 C4H4:1.0
iC4H5 + HCO [=] C4H6 + CO
5.000000E+09
0.0
0.000000
iC4H5:1.0 HCO:1
CO:1 C4H6:1.0
iC4H5 + HO2 [=] C4H6 + O2
6.000000E+08
0.0
0.000000
HO2:1 iC4H5:1.0
O2:1 C4H6:1.0
iC4H5 + HO2 [=] C2H3 + CH2CO + OH
6.600000E+09
0.0
0.000000
HO2:1 iC4H5:1.0
CH2CO:1 C2H3:1.0 OH:1
iC4H5 + H2O2 [=] C4H6 + HO2
1.210000E+07
0.0
-596.000000
iC4H5:1.0 H2O2:1
HO2:1 C4H6:1.0
iC4H5 + O2 [=] CH2CO + CH2CHO
2.160000E+07
0.0
2500.000000
iC4H5:1.0 O2:1
CH2CHO:1 CH2CO:1.0
C4H5-2 [=] iC4H5
1.500000E+67
-16.89
59100.000000
C4H5-2:1.0
iC4H5:1.0
iC4H5 + H [=] C4H5-2 + H
3.100000E+23
-3.35
17423.000000
H:1 iC4H5:1.0
H:1 C4H5-2:1.0
C4H5-2 + HO2 [=] OH + C2H2 + CH3CO
8.000000E+08
0.0
0.000000
C4H5-2:1.0 HO2:1
CH3CO:1 C2H2:1 OH:1.0
C4H5-2 + O2 [=] CH3CO + CH2CO
2.160000E+07
0.0
2500.000000
C4H5-2:1.0 O2:1
CH2CO:1 CH3CO:1.0
C4H5-2 + C2H2 [=] C6H6 + H
5.000000E+11
0.0
25000.000000
C4H5-2:1.0 C2H2:1
H:1 C6H6:1.0
C4H5-2 + C2H4 [=] C5H6 + CH3
5.000000E+11
0.0
25000.000000
C4H5-2:1.0 C2H4:1
CH3:1 C5H6:1.0
C4H6 [=] iC4H5 + H
5.700000E+36
-6.27
112353.000000
C4H6:1.0
H:1 iC4H5:1.0
C4H6 [=] nC4H5 + H
5.300000E+44
-8.62
123608.000000
C4H6:1.0
H:1 nC4H5:1.0
C4H6 [=] C4H4 + H2
2.500000E+15
0.0
94700.000000
C4H6:1.0
H2:1 C4H4:1.0
C4H6 + H [=] nC4H5 + H2
1.330000E+03
2.53
12240.000000
H:1 C4H6:1.0
H2:1 nC4H5:1.0
C4H6 + H [=] iC4H5 + H2
6.650000E+02
2.53
9240.000000
H:1 C4H6:1.0
H2:1 iC4H5:1.0
C4H6 + H [=] C2H4 + C2H3
1.460000E+27
-4.34
21647.000000
H:1 C4H6:1.0
C2H4:1.0 C2H3:1
C4H6 + H [=] pC3H4 + CH3
2.000000E+09
0.0
7000.000000
H:1 C4H6:1.0
CH3:1 pC3H4:1.0
C4H6 + H [=] aC3H4 + CH3
2.000000E+09
0.0
7000.000000
H:1 C4H6:1.0
aC3H4:1.0 CH3:1
C4H6 + O [=] nC4H5 + OH
7.500000E+03
1.9
3740.000000
O:1 C4H6:1.0
OH:1 nC4H5:1.0
C4H6 + O [=] iC4H5 + OH
7.500000E+03
1.9
3740.000000
O:1 C4H6:1.0
iC4H5:1.0 OH:1
C4H6 + O [=] CH3CHCHCO + H
1.500000E+05
1.45
-860.000000
O:1 C4H6:1.0
H:1 CH3CHCHCO:1.0
C4H6 + O [=] CH2CHCHCHO + H
4.500000E+05
1.45
-860.000000
O:1 C4H6:1.0
H:1 CH2CHCHCHO:1.0
C4H6 + OH [=] nC4H5 + H2O
6.200000E+03
2.0
3430.000000
OH:1 C4H6:1.0
H2O:1 nC4H5:1.0
C4H6 + OH [=] iC4H5 + H2O
3.100000E+03
2.0
430.000000
OH:1 C4H6:1.0
H2O:1 iC4H5:1.0
C4H6 + HO2 [=] C4H6O25 + OH
1.200000E+09
0.0
14000.000000
HO2:1 C4H6:1.0
C4H6O25:1.0 OH:1
C4H6 + HO2 [=] C2H3CHOCH2 + OH
4.800000E+09
0.0
14000.000000
HO2:1 C4H6:1.0
OH:1 C2H3CHOCH2:1.0
C4H6 + CH3 [=] nC4H5 + CH4
2.000000E+11
0.0
22800.000000
CH3:1 C4H6:1.0
CH4:1 nC4H5:1.0
C4H6 + CH3 [=] iC4H5 + CH4
1.000000E+11
0.0
19800.000000
CH3:1 C4H6:1.0
CH4:1 iC4H5:1.0
C4H6 + C2H3 [=] nC4H5 + C2H4
5.000000E+10
0.0
22800.000000
C2H3:1 C4H6:1.0
C2H4:1 nC4H5:1.0
C4H6 + C2H3 [=] iC4H5 + C2H4
2.500000E+10
0.0
19800.000000
C2H3:1 C4H6:1.0
C2H4:1 iC4H5:1.0
C4H6 + C3H3 [=] nC4H5 + aC3H4
1.000000E+10
0.0
22500.000000
C3H3:1 C4H6:1.0
aC3H4:1 nC4H5:1.0
C4H6 + C3H3 [=] iC4H5 + aC3H4
5.000000E+09
0.0
19500.000000
C3H3:1 C4H6:1.0
aC3H4:1 iC4H5:1.0
C4H6 + aC3H5 [=] nC4H5 + C3H6
1.000000E+10
0.0
22500.000000
aC3H5:1 C4H6:1.0
C3H6:1 nC4H5:1.0
C4H6 + aC3H5 [=] iC4H5 + C3H6
5.000000E+09
0.0
19500.000000
aC3H5:1 C4H6:1.0
C3H6:1 iC4H5:1.0
C4H6 + C2H3 [=] C6H6 + H2 + H
5.620000E+08
0.0
3240.000000
C2H3:1 C4H6:1.0
H2:1 H:1 C6H6:1.0
C4H612 [=] iC4H5 + H
4.200000E+15
0.0
92600.000000
C4H612:1.0
H:1 iC4H5:1.0
C4H612 + H [=] C4H6 + H
2.000000E+10
0.0
4000.000000
H:1 C4H612:1.0
H:1 C4H6:1.0
C4H612 + H [=] iC4H5 + H2
1.700000E+02
2.5
2490.000000
H:1 C4H612:1.0
H2:1 iC4H5:1.0
C4H612 + H [=] aC3H4 + CH3
2.000000E+10
0.0
2000.000000
H:1 C4H612:1.0
aC3H4:1.0 CH3:1
C4H612 + H [=] pC3H4 + CH3
2.000000E+10
0.0
2000.000000
H:1 C4H612:1.0
CH3:1 pC3H4:1.0
C4H612 + CH3 [=] iC4H5 + CH4
7.000000E+10
0.0
18500.000000
CH3:1 C4H612:1.0
CH4:1 iC4H5:1.0
C4H612 + O [=] CH2CO + C2H4
1.200000E+05
1.65
327.000000
C4H612:1.0 O:1
CH2CO:1.0 C2H4:1
C4H612 + O [=] iC4H5 + OH
1.800000E+08
0.7
5880.000000
C4H612:1.0 O:1
iC4H5:1.0 OH:1
C4H612 + OH [=] iC4H5 + H2O
3.100000E+03
2.0
-298.000000
C4H612:1.0 OH:1
H2O:1 iC4H5:1.0
C4H612 [=] C4H6
3.000000E+13
0.0
65000.000000
C4H612:1.0
C4H6:1.0
C4H6-2 [=] C4H6
3.000000E+13
0.0
65000.000000
C4H6-2:1.0
C4H6:1.0
C4H6-2 [=] C4H612
3.000000E+13
0.0
67000.000000
C4H6-2:1.0
C4H612:1.0
C4H6-2 + H [=] C4H612 + H
2.000000E+10
0.0
4000.000000
C4H6-2:1.0 H:1
H:1 C4H612:1.0
C4H6-2 + H [=] C4H5-2 + H2
3.400000E+02
2.5
2490.000000
C4H6-2:1.0 H:1
H2:1 C4H5-2:1.0
C4H6-2 + H [=] CH3 + pC3H4
2.600000E+02
2.5
1000.000000
C4H6-2:1.0 H:1
CH3:1.0 pC3H4:1
C4H6-2 [=] H + C4H5-2
5.000000E+15
0.0
87300.000000
C4H6-2:1.0
H:1.0 C4H5-2:1
C4H6-2 + CH3 [=] C4H5-2 + CH4
1.400000E+11
0.0
18500.000000
C4H6-2:1.0 CH3:1
C4H5-2:1.0 CH4:1
C2H3CHOCH2 [=] C4H6O23
2.000000E+14
0.0
50600.000000
C2H3CHOCH2:1.0
C4H6O23:1.0
C4H6O23 [=] CH3CHCHCHO
1.950000E+13
0.0
49400.000000
C4H6O23:1.0
CH3CHCHCHO:1.0
C4H6O23 [=] C2H4 + CH2CO
5.750000E+15
0.0
69300.000000
C4H6O23:1.0
CH2CO:1 C2H4:1.0
C4H6O23 [=] C2H2 + CH2OCH2
1.000000E+16
0.0
75800.000000
C4H6O23:1.0
CH2OCH2:1 C2H2:1.0
C4H6O25 [=] C4H4O + H2
5.300000E+12
0.0
48500.000000
C4H6O25:1.0
H2:1 C4H4O:1.0
C4H4O [=] CO + pC3H4
1.780000E+15
0.0
77500.000000
C4H4O:1.0
pC3H4:1 CO:1.0
C4H4O [=] C2H2 + CH2CO
5.010000E+14
0.0
77500.000000
C4H4O:1.0
CH2CO:1 C2H2:1.0
CH3CHCHCHO [=] C3H6 + CO
3.900000E+14
0.0
69000.000000
CH3CHCHCHO:1.0
C3H6:1.0 CO:1
CH3CHCHCHO + H [=] CH2CHCHCHO + H2
1.700000E+02
2.5
2490.000000
H:1 CH3CHCHCHO:1.0
H2:1 CH2CHCHCHO:1.0
CH3CHCHCHO + H [=] CH3CHCHCO + H2
1.000000E+02
2.5
2490.000000
H:1 CH3CHCHCHO:1.0
H2:1 CH3CHCHCO:1.0
CH3CHCHCHO + H [=] CH3 + C2H3CHO
4.000000E+18
-2.39
11180.000000
H:1 CH3CHCHCHO:1.0
C2H3CHO:1 CH3:1.0
CH3CHCHCHO + H [=] C3H6 + HCO
4.000000E+18
-2.39
11180.000000
H:1 CH3CHCHCHO:1.0
C3H6:1.0 HCO:1
CH3CHCHCHO + CH3 [=] CH2CHCHCHO + CH4
2.100000E-03
3.5
5675.000000
CH3:1 CH3CHCHCHO:1.0
CH4:1 CH2CHCHCHO:1.0
CH3CHCHCHO + CH3 [=] CH3CHCHCO + CH4
1.100000E-03
3.5
5675.000000
CH3:1 CH3CHCHCHO:1.0
CH4:1 CH3CHCHCO:1.0
CH3CHCHCHO + C2H3 [=] CH2CHCHCHO + C2H4
2.210000E-03
3.5
4682.000000
C2H3:1 CH3CHCHCHO:1.0
C2H4:1 CH2CHCHCHO:1.0
CH3CHCHCHO + C2H3 [=] CH3CHCHCO + C2H4
1.110000E-03
3.5
4682.000000
C2H3:1 CH3CHCHCHO:1.0
C2H4:1 CH3CHCHCO:1.0
CH3CHCHCO [=] CH3CHCH + CO
1.000000E+14
0.0
30000.000000
CH3CHCHCO:1.0
CO:1 CH3CHCH:1.0
CH3CHCHCO + H [=] CH3CHCHCHO
1.000000E+11
0.0
0.000000
H:1 CH3CHCHCO:1.0
CH3CHCHCHO:1.0
CH2CHCHCHO [=] aC3H5 + CO
1.000000E+14
0.0
25000.000000
CH2CHCHCHO:1.0
aC3H5:1.0 CO:1
CH2CHCHCHO + H [=] CH3CHCHCHO
1.000000E+11
0.0
0.000000
H:1 CH2CHCHCHO:1.0
CH3CHCHCHO:1.0
C4H7 [=] C4H6 + H
2.480000E+53
-12.3
52000.000000
C4H7:1.0
H:1 C4H6:1.0
C4H7 + H (+ M) [=] C4H81 (+ M)
3.600000E+10
0.0
0.000000
3.010000E+42
-9.32
5833.600000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.498 1314 1314 50000
H:1 C4H7:1.0
C4H81:1.0
C4H7 + H [=] CH3 + aC3H5
2.000000E+18
-2.0
11000.000000
H:1 C4H7:1.0
CH3:1.0 aC3H5:1
C4H7 + H [=] C4H6 + H2
1.800000E+09
0.0
0.000000
H:1 C4H7:1.0
H2:1 C4H6:1.0
C4H7 + O2 [=] C4H6 + HO2
1.000000E+08
0.0
0.000000
O2:1 C4H7:1.0
HO2:1 C4H6:1.0
C4H7 + HO2 [=] CH2O + OH + aC3H5
2.400000E+10
0.0
0.000000
HO2:1 C4H7:1.0
CH2O:1.0 aC3H5:1 OH:1
C4H7 + HCO [=] C4H81 + CO
6.000000E+10
0.0
0.000000
HCO:1 C4H7:1.0
C4H81:1.0 CO:1
C4H7 + CH3 [=] C4H6 + CH4
1.100000E+10
0.0
0.000000
CH3:1 C4H7:1.0
CH4:1 C4H6:1.0
iC4H7 + H (+ M) [=] iC4H8 (+ M)
2.000000E+11
0.0
0.000000
1.330000E+54
-12.0
5967.800000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.02 1096.6 1096.6 6859.5
H:1 iC4H7:1.0
iC4H8:1.0
iC4H7 + H [=] CH3CCH2 + CH3
2.600000E+42
-8.19
37890.000000
H:1 iC4H7:1.0
CH3:1 CH3CCH2:1.0
iC4H7 + O [=] CH2O + CH3CCH2
9.000000E+10
0.0
0.000000
O:1 iC4H7:1.0
CH2O:1.0 CH3CCH2:1
iC4H7 + HO2 [=] CH3CCH2 + CH2O + OH
4.000000E+09
0.0
0.000000
HO2:1 iC4H7:1.0
CH2O:1 OH:1 CH3CCH2:1.0
C4H81 + H (+ M) [=] pC4H9 (+ M)
1.330000E+10
0.0
3260.700000
6.260000E+32
-6.66
7000.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
1 1000 1310 48097
H:1 C4H81:1.0
pC4H9:1.0
C4H81 + H (+ M) [=] sC4H9 (+ M)
1.330000E+10
0.0
1559.800000
8.700000E+36
-7.5
4721.800000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
1 1000 645.4 6844.3
H:1 C4H81:1.0
sC4H9:1.0
C4H81 + H [=] C2H4 + C2H5
1.600000E+19
-2.39
11180.000000
H:1 C4H81:1.0
C2H5:1 C2H4:1.0
C4H81 + H [=] C3H6 + CH3
3.200000E+19
-2.39
11180.000000
H:1 C4H81:1.0
C3H6:1.0 CH3:1
C4H81 + H [=] C4H7 + H2
6.500000E+02
2.54
6756.000000
H:1 C4H81:1.0
H2:1 C4H7:1.0
C4H81 + O [=] nC3H7 + HCO
3.300000E+05
1.45
-402.000000
C4H81:1.0 O:1
nC3H7:1.0 HCO:1
C4H81 + O [=] C4H7 + OH
1.500000E+10
0.0
5760.000000
C4H81:1.0 O:1
C4H7:1.0 OH:1
C4H81 + O [=] C4H7 + OH
2.600000E+10
0.0
4470.000000
C4H81:1.0 O:1
C4H7:1.0 OH:1
C4H81 + OH [=] C4H7 + H2O
7.000000E-01
2.66
527.000000
C4H81:1.0 OH:1
H2O:1 C4H7:1.0
C4H81 + O2 [=] C4H7 + HO2
2.000000E+10
0.0
50930.000000
C4H81:1.0 O2:1
HO2:1 C4H7:1.0
C4H81 + HO2 [=] C4H7 + H2O2
1.000000E+09
0.0
14340.000000
C4H81:1.0 HO2:1
H2O2:1 C4H7:1.0
C4H81 + CH3 [=] C4H7 + CH4
4.500000E-04
3.65
7153.000000
CH3:1 C4H81:1.0
CH4:1 C4H7:1.0
C4H82 + H (+ M) [=] sC4H9 (+ M)
1.330000E+10
0.0
1559.800000
8.700000E+36
-7.5
4721.800000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
1 1000 645.4 6844.3
C4H82:1.0 H:1
sC4H9:1.0
C4H82 + H [=] C4H7 + H2
3.400000E+02
2.5
2490.000000
C4H82:1.0 H:1
H2:1 C4H7:1.0
C4H82 + O [=] C2H4 + CH3CHO
2.400000E+05
1.65
327.000000
C4H82:1.0 O:1
CH3CHO:1 C2H4:1.0
C4H82 + OH [=] C4H7 + H2O
6.200000E+03
2.0
-298.000000
C4H82:1.0 OH:1
H2O:1 C4H7:1.0
C4H82 + O2 [=] C4H7 + HO2
5.000000E+10
0.0
53300.000000
C4H82:1.0 O2:1
HO2:1 C4H7:1.0
C4H82 + HO2 [=] C4H7 + H2O2
1.900000E+01
2.6
13910.000000
C4H82:1.0 HO2:1
H2O2:1 C4H7:1.0
C4H82 + CH3 [=] C4H7 + CH4
4.400000E-03
3.5
5675.000000
C4H82:1.0 CH3:1
CH4:1 C4H7:1.0
iC4H8 + H (+ M) [=] iC4H9 (+ M)
1.330000E+10
0.0
3260.700000
6.260000E+32
-6.66
7000.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
1 1000 1310 48097
iC4H8:1.0 H:1
iC4H9:1.0
iC4H8 + H [=] iC4H7 + H2
1.200000E+03
2.54
6760.000000
iC4H8:1.0 H:1
H2:1 iC4H7:1.0
iC4H8 + H [=] C3H6 + CH3
8.000000E+18
-2.39
11180.000000
iC4H8:1.0 H:1
C3H6:1.0 CH3:1
iC4H8 + O [=] CH3 + CH3 + CH2CO
1.200000E+05
1.65
327.000000
iC4H8:1.0 O:1
CH2CO:1 CH3:2.0
iC4H8 + O [=] iC3H7 + HCO
3.500000E+04
1.65
-972.000000
iC4H8:1.0 O:1
iC3H7:1.0 HCO:1
iC4H8 + O [=] iC4H7 + OH
2.900000E+02
2.5
3640.000000
iC4H8:1.0 O:1
iC4H7:1.0 OH:1
iC4H8 + OH [=] iC4H7 + H2O
1.500000E+05
1.53
775.000000
iC4H8:1.0 OH:1
H2O:1 iC4H7:1.0
iC4H8 + HO2 [=] iC4H7 + H2O2
2.000000E+01
2.55
15500.000000
iC4H8:1.0 HO2:1
H2O2:1 iC4H7:1.0
iC4H8 + O2 [=] iC4H7 + HO2
2.700000E+10
0.0
50900.000000
iC4H8:1.0 O2:1
HO2:1 iC4H7:1.0
iC4H8 + CH3 [=] iC4H7 + CH4
9.100000E-04
3.65
7150.000000
iC4H8:1.0 CH3:1
CH4:1 iC4H7:1.0
C2H4 + C2H5 [=] pC4H9
1.500000E+08
0.0
7300.000000
C2H5:1 C2H4:1.0
pC4H9:1.0
pC4H9 + H (+ M) [=] C4H10 (+ M)
3.600000E+10
0.0
0.000000
3.010000E+42
-9.32
5833.600000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.498 1314 1314 50000
pC4H9:1.0 H:1
C4H10:1.0
pC4H9 + H [=] C2H5 + C2H5
3.700000E+21
-2.92
12505.000000
pC4H9:1.0 H:1
C2H5:2.0
pC4H9 + H [=] C4H81 + H2
1.800000E+09
0.0
0.000000
pC4H9:1.0 H:1
H2:1 C4H81:1.0
pC4H9 + O [=] nC3H7 + CH2O
9.600000E+10
0.0
0.000000
pC4H9:1.0 O:1
CH2O:1 nC3H7:1.0
pC4H9 + OH [=] C4H81 + H2O
2.400000E+10
0.0
0.000000
pC4H9:1.0 OH:1
H2O:1 C4H81:1.0
pC4H9 + O2 [=] C4H81 + HO2
2.700000E+08
0.0
0.000000
pC4H9:1.0 O2:1
C4H81:1.0 HO2:1
pC4H9 + HO2 [=] nC3H7 + OH + CH2O
2.400000E+10
0.0
0.000000
pC4H9:1.0 HO2:1
CH2O:1 nC3H7:1.0 OH:1
pC4H9 + HCO [=] C4H10 + CO
9.000000E+10
0.0
0.000000
pC4H9:1.0 HCO:1
C4H10:1.0 CO:1
pC4H9 + CH3 [=] C4H81 + CH4
1.100000E+10
0.0
0.000000
pC4H9:1.0 CH3:1
C4H81:1.0 CH4:1
C3H6 + CH3 (+ M) [=] sC4H9 (+ M)
1.700000E+08
0.0
7403.600000
2.310000E+22
-4.27
1831.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.565 60000 534.2 3007.2
C3H6:1.0 CH3:1
sC4H9:1.0
sC4H9 + H (+ M) [=] C4H10 (+ M)
2.400000E+10
0.0
0.000000
1.700000E+52
-12.08
11263.700000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.649 1213.1 1213.1 13369.7
H:1 sC4H9:1.0
C4H10:1.0
sC4H9 + H [=] C2H5 + C2H5
1.400000E+25
-3.94
15916.000000
H:1 sC4H9:1.0
C2H5:2.0
sC4H9 + H [=] C4H81 + H2
3.200000E+09
0.0
0.000000
H:1 sC4H9:1.0
H2:1 C4H81:1.0
sC4H9 + H [=] C4H82 + H2
2.100000E+09
0.0
0.000000
H:1 sC4H9:1.0
C4H82:1.0 H2:1
sC4H9 + O [=] CH3CHO + C2H5
9.600000E+10
0.0
0.000000
O:1 sC4H9:1.0
CH3CHO:1.0 C2H5:1
sC4H9 + OH [=] C4H81 + H2O
2.400000E+10
0.0
0.000000
sC4H9:1.0 OH:1
H2O:1 C4H81:1.0
sC4H9 + OH [=] C4H82 + H2O
1.600000E+10
0.0
0.000000
sC4H9:1.0 OH:1
C4H82:1.0 H2O:1
sC4H9 + O2 [=] C4H81 + HO2
5.100000E+07
0.0
0.000000
O2:1 sC4H9:1.0
C4H81:1.0 HO2:1
sC4H9 + O2 [=] C4H82 + HO2
1.200000E+08
0.0
0.000000
O2:1 sC4H9:1.0
C4H82:1.0 HO2:1
sC4H9 + HO2 [=] CH3CHO + C2H5 + OH
2.400000E+10
0.0
0.000000
HO2:1 sC4H9:1.0
CH3CHO:1.0 C2H5:1 OH:1
sC4H9 + HCO [=] C4H10 + CO
1.200000E+11
0.0
0.000000
HCO:1 sC4H9:1.0
C4H10:1.0 CO:1
sC4H9 + CH3 [=] CH4 + C4H81
2.200000E+11
-0.68
0.000000
CH3:1 sC4H9:1.0
C4H81:1 CH4:1.0
sC4H9 + CH3 [=] CH4 + C4H82
1.500000E+11
-0.68
0.000000
CH3:1 sC4H9:1.0
C4H82:1 CH4:1.0
C3H6 + CH3 (+ M) [=] iC4H9 (+ M)
9.600000E+07
0.0
8003.600000
1.300000E+22
-4.27
2431.100000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.565 60000 534.2 3007.2
C3H6:1.0 CH3:1
iC4H9:1.0
iC4H9 + H (+ M) [=] iC4H10 (+ M)
3.600000E+10
0.0
0.000000
3.270000E+50
-11.74
6430.800000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.506 1266.6 1266.6 50000
iC4H9:1.0 H:1
iC4H10:1.0
iC4H9 + H [=] iC3H7 + CH3
1.900000E+32
-5.83
22470.000000
iC4H9:1.0 H:1
iC3H7:1.0 CH3:1
iC4H9 + H [=] iC4H8 + H2
9.000000E+08
0.0
0.000000
iC4H9:1.0 H:1
H2:1 iC4H8:1.0
iC4H9 + O [=] iC3H7 + CH2O
9.600000E+10
0.0
0.000000
iC4H9:1.0 O:1
CH2O:1 iC3H7:1.0
iC4H9 + OH [=] iC4H8 + H2O
1.200000E+10
0.0
0.000000
iC4H9:1.0 OH:1
iC4H8:1.0 H2O:1
iC4H9 + O2 [=] iC4H8 + HO2
2.400000E+07
0.0
0.000000
iC4H9:1.0 O2:1
iC4H8:1.0 HO2:1
iC4H9 + HO2 [=] iC3H7 + CH2O + OH
2.410000E+10
0.0
0.000000
iC4H9:1.0 HO2:1
CH2O:1 iC3H7:1.0 OH:1
iC4H9 + HCO [=] iC4H10 + CO
3.600000E+10
0.0
0.000000
iC4H9:1.0 HCO:1
iC4H10:1.0 CO:1
iC4H9 + CH3 [=] iC4H8 + CH4
6.000000E+09
-0.32
0.000000
iC4H9:1.0 CH3:1
iC4H8:1.0 CH4:1
tC4H9 (+ M) [=] iC4H8 + H (+ M)
8.300000E+13
0.0
38150.400000
1.900000E+38
-7.36
36631.700000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.293 649 60000 3425.9
tC4H9:1.0
iC4H8:1.0 H:1
tC4H9 + H (+ M) [=] iC4H10 (+ M)
2.400000E+10
0.0
0.000000
1.470000E+55
-12.94
8000.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0 1456.4 1000 10000.5
H:1 tC4H9:1.0
iC4H10:1.0
tC4H9 + H [=] iC3H7 + CH3
2.600000E+33
-6.12
25640.000000
H:1 tC4H9:1.0
iC3H7:1.0 CH3:1
tC4H9 + H [=] iC4H8 + H2
5.420000E+09
0.0
0.000000
H:1 tC4H9:1.0
H2:1 iC4H8:1.0
tC4H9 + O [=] iC4H8 + OH
1.800000E+11
0.0
0.000000
tC4H9:1.0 O:1
iC4H8:1.0 OH:1
tC4H9 + O [=] CH3COCH3 + CH3
1.800000E+11
0.0
0.000000
tC4H9:1.0 O:1
CH3COCH3:1.0 CH3:1
tC4H9 + OH [=] iC4H8 + H2O
1.800000E+10
0.0
0.000000
tC4H9:1.0 OH:1
iC4H8:1.0 H2O:1
tC4H9 + O2 [=] iC4H8 + HO2
4.800000E+08
0.0
0.000000
tC4H9:1.0 O2:1
iC4H8:1.0 HO2:1
tC4H9 + HO2 [=] CH3 + CH3COCH3 + OH
1.800000E+10
0.0
0.000000
HO2:1 tC4H9:1.0
CH3COCH3:1 CH3:1.0 OH:1
tC4H9 + HCO [=] iC4H10 + CO
6.000000E+10
0.0
0.000000
tC4H9:1.0 HCO:1
iC4H10:1.0 CO:1
tC4H9 + CH3 [=] iC4H8 + CH4
3.800000E+12
-1.0
0.000000
CH3:1 tC4H9:1.0
iC4H8:1.0 CH4:1
CH3COCH3 + H [=] H2 + CH2CO + CH3
1.300000E+03
2.54
6756.000000
H:1 CH3COCH3:1.0
H2:1.0 CH2CO:1 CH3:1
CH3COCH3 + O [=] OH + CH2CO + CH3
1.900000E+02
2.68
3716.000000
CH3COCH3:1.0 O:1
CH2CO:1 CH3:1 OH:1.0
CH3COCH3 + OH [=] H2O + CH2CO + CH3
3.200000E+04
1.8
934.000000
CH3COCH3:1.0 OH:1
H2O:1.0 CH3:1 CH2CO:1
CH3 + CH3CO [=] CH3COCH3
4.000000E+12
-0.8
0.000000
CH3:1.0 CH3CO:1
CH3COCH3:1.0
nC3H7 + CH3 (+ M) [=] C4H10 (+ M)
1.930000E+11
-0.32
0.000000
2.680000E+55
-13.24
6000.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
1 1000 1433.9 5328.8
nC3H7:1.0 CH3:1
C4H10:1.0
C2H5 + C2H5 (+ M) [=] C4H10 (+ M)
1.880000E+11
-0.5
0.000000
2.610000E+55
-13.42
6000.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
1 1000 1433.9 5328.8
C2H5:2.0
C4H10:1.0
C4H10 + H [=] pC4H9 + H2
9.200000E+02
2.54
6756.000000
C4H10:1.0 H:1
H2:1 pC4H9:1.0
C4H10 + H [=] sC4H9 + H2
2.400000E+03
2.4
4471.000000
C4H10:1.0 H:1
H2:1 sC4H9:1.0
C4H10 + O [=] pC4H9 + OH
4.900000E+03
2.4
5500.000000
C4H10:1.0 O:1
pC4H9:1.0 OH:1
C4H10 + O [=] sC4H9 + OH
4.300000E+02
2.6
2580.000000
C4H10:1.0 O:1
sC4H9:1.0 OH:1
C4H10 + OH [=] pC4H9 + H2O
3.300000E+04
1.8
954.000000
C4H10:1.0 OH:1
pC4H9:1.0 H2O:1
C4H10 + OH [=] sC4H9 + H2O
5.400000E+03
2.0
-596.000000
C4H10:1.0 OH:1
H2O:1 sC4H9:1.0
C4H10 + O2 [=] pC4H9 + HO2
4.000000E+10
0.0
50930.000000
C4H10:1.0 O2:1
pC4H9:1.0 HO2:1
C4H10 + O2 [=] sC4H9 + HO2
8.000000E+10
0.0
47590.000000
C4H10:1.0 O2:1
HO2:1 sC4H9:1.0
C4H10 + HO2 [=] pC4H9 + H2O2
4.760000E+01
2.55
16490.000000
C4H10:1.0 HO2:1
pC4H9:1.0 H2O2:1
C4H10 + HO2 [=] sC4H9 + H2O2
1.900000E+01
2.6
13910.000000
C4H10:1.0 HO2:1
H2O2:1 sC4H9:1.0
C4H10 + CH3 [=] pC4H9 + CH4
9.030000E-04
3.65
7153.000000
C4H10:1.0 CH3:1
pC4H9:1.0 CH4:1
C4H10 + CH3 [=] sC4H9 + CH4
3.000000E-03
3.46
5480.000000
C4H10:1.0 CH3:1
CH4:1 sC4H9:1.0
iC3H7 + CH3 (+ M) [=] iC4H10 (+ M)
1.400000E+12
-0.68
0.000000
4.160000E+55
-13.33
3903.400000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 AR:0.7 CH4:2.0 C2H6:3.0
0.931 60000 1265.3 5469.8
iC3H7:1.0 CH3:1
iC4H10:1.0
iC4H10 + H [=] iC4H9 + H2
1.800000E+03
2.54
6760.000000
iC4H10:1.0 H:1
iC4H9:1.0 H2:1
iC4H10 + H [=] tC4H9 + H2
6.000000E+02
2.4
2580.000000
iC4H10:1.0 H:1
H2:1 tC4H9:1.0
iC4H10 + O [=] iC4H9 + OH
4.300000E+02
2.5
3640.000000
iC4H10:1.0 O:1
iC4H9:1.0 OH:1
iC4H10 + O [=] tC4H9 + OH
1.570000E+02
2.5
1110.000000
iC4H10:1.0 O:1
tC4H9:1.0 OH:1
iC4H10 + OH [=] iC4H9 + H2O
2.300000E+05
1.53
775.000000
iC4H10:1.0 OH:1
iC4H9:1.0 H2O:1
iC4H10 + OH [=] tC4H9 + H2O
5.730000E+07
0.51
64.000000
iC4H10:1.0 OH:1
H2O:1 tC4H9:1.0
iC4H10 + HO2 [=] iC4H9 + H2O2
3.000000E+01
2.55
15500.000000
iC4H10:1.0 HO2:1
iC4H9:1.0 H2O2:1
iC4H10 + HO2 [=] tC4H9 + H2O2
3.600000E+00
2.55
10500.000000
iC4H10:1.0 HO2:1
tC4H9:1.0 H2O2:1
iC4H10 + O2 [=] iC4H9 + HO2
4.000000E+10
0.0
50900.000000
iC4H10:1.0 O2:1
iC4H9:1.0 HO2:1
iC4H10 + O2 [=] tC4H9 + HO2
4.000000E+10
0.0
44000.000000
iC4H10:1.0 O2:1
HO2:1 tC4H9:1.0
iC4H10 + CH3 [=] iC4H9 + CH4
1.360000E-03
3.65
7150.000000
iC4H10:1.0 CH3:1
iC4H9:1.0 CH4:1
iC4H10 + CH3 [=] tC4H9 + CH4
9.000000E-04
3.46
4600.000000
iC4H10:1.0 CH3:1
CH4:1 tC4H9:1.0
C6H2 + H [=] C6H3
1.100000E+27
-4.92
10800.000000
C6H2:1.0 H:1
C6H3:1.0
C6H3 + H [=] C4H2 + C2H2
2.800000E+20
-2.55
10780.000000
C6H3:1.0 H:1
C4H2:1.0 C2H2:1
C6H3 + H [=] l-C6H4
3.400000E+40
-9.01
12120.000000
C6H3:1.0 H:1
l-C6H4:1.0
C6H3 + H [=] C6H2 + H2
3.000000E+10
0.0
0.000000
C6H3:1.0 H:1
H2:1 C6H2:1.0
C6H3 + OH [=] C6H2 + H2O
4.000000E+09
0.0
0.000000
C6H3:1.0 OH:1
C6H2:1.0 H2O:1
l-C6H4 + H [=] C6H5
1.700000E+75
-19.72
31400.000000
H:1 l-C6H4:1.0
C6H5:1.0
l-C6H4 + H [=] o-C6H4 + H
1.400000E+51
-11.7
34500.000000
H:1 l-C6H4:1.0
H:1 o-C6H4:1.0
l-C6H4 + H [=] C6H3 + H2
1.330000E+03
2.53
9240.000000
H:1 l-C6H4:1.0
C6H3:1.0 H2:1
l-C6H4 + OH [=] C6H3 + H2O
3.100000E+03
2.0
430.000000
l-C6H4:1.0 OH:1
C6H3:1.0 H2O:1
C4H2 + C2H2 [=] o-C6H4
5.000000E+75
-19.31
67920.000000
C4H2:1.0 C2H2:1
o-C6H4:1.0
o-C6H4 + OH [=] CO + C5H5
1.000000E+10
0.0
0.000000
o-C6H4:1.0 OH:1
CO:1.0 C5H5:1
C6H5 + CH3 [=] C6H5CH3
1.380000E+10
0.0
46.000000
CH3:1 C6H5:1.0
C6H5CH3:1.0
C6H5CH3 + O2 [=] C6H5CH2 + HO2
3.000000E+11
0.0
42992.000000
C6H5CH3:1.0 O2:1
C6H5CH2:1.0 HO2:1
C6H5CH3 + OH [=] C6H5CH2 + H2O
1.620000E+10
0.0
2770.000000
C6H5CH3:1.0 OH:1
C6H5CH2:1.0 H2O:1
C6H5CH3 + OH [=] C6H4CH3 + H2O
1.333000E+05
1.42
1450.000000
C6H5CH3:1.0 OH:1
H2O:1 C6H4CH3:1.0
C6H5CH3 + H [=] C6H5CH2 + H2
1.259000E+11
0.0
8359.000000
C6H5CH3:1.0 H:1
C6H5CH2:1.0 H2:1
C6H5CH3 + H [=] C6H6 + CH3
1.930000E+03
2.17
4163.000000
C6H5CH3:1.0 H:1
CH3:1 C6H6:1.0
C6H5CH3 + O [=] OC6H4CH3 + H
2.600000E+10
0.0
3795.000000
C6H5CH3:1.0 O:1
OC6H4CH3:1.0 H:1
C6H5CH3 + CH3 [=] C6H5CH2 + CH4
3.160000E+08
0.0
9500.000000
C6H5CH3:1.0 CH3:1
C6H5CH2:1.0 CH4:1
C6H5CH3 + C6H5 [=] C6H5CH2 + C6H6
2.103000E+09
0.0
4400.000000
C6H5CH3:1.0 C6H5:1
C6H5CH2:1.0 C6H6:1
C6H5CH3 + HO2 [=] C6H5CH2 + H2O2
3.975000E+08
0.0
14069.000000
C6H5CH3:1.0 HO2:1
C6H5CH2:1.0 H2O2:1
C6H5CH3 + HO2 [=] C6H4CH3 + H2O2
5.420000E+09
0.0
28810.000000
C6H5CH3:1.0 HO2:1
H2O2:1 C6H4CH3:1.0
C6H5CH2 + H (+ M) [=] C6H5CH3 (+ M)
1.000000E+11
0.0
0.000000
1.100000E+97
-24.63
14590.000000
CO2:2.0 CO:1.5 H2:2.0 H2O:6.0 CH4:2.0 C2H6:3.0
0.431 383 152 4730
C6H5CH2:1.0 H:1
C6H5CH3:1.0
C6H5CH2 + H [=] C6H5 + CH3
1.500000E+63
-13.94
64580.000000
C6H5CH2:1.0 H:1
CH3:1 C6H5:1.0
C6H5CH2 + O [=] C6H5CHO + H
4.000000E+11
0.0
0.000000
C6H5CH2:1.0 O:1
H:1 C6H5CHO:1.0
C6H5CH2 + OH [=] C6H5CH2OH
2.000000E+10
0.0
0.000000
C6H5CH2:1.0 OH:1
C6H5CH2OH:1.0
C6H5CH2 + HO2 [=] C6H5CHO + H + OH
5.000000E+09
0.0
0.000000
C6H5CH2:1.0 HO2:1
H:1 C6H5CHO:1.0 OH:1
C6H5CH2 + C6H5OH [=] C6H5CH3 + C6H5O
1.050000E+08
0.0
9500.000000
C6H5CH2:1.0 C6H5OH:1
C6H5CH3:1.0 C6H5O:1
C6H5CH2 + HOC6H4CH3 [=] C6H5CH3 + OC6H4CH3
1.050000E+08
0.0
9500.000000
C6H5CH2:1.0 HOC6H4CH3:1
OC6H4CH3:1 C6H5CH3:1.0
C6H5CH2OH + OH [=] C6H5CHO + H2O + H
5.000000E+09
0.0
0.000000
OH:1 C6H5CH2OH:1.0
H:1 H2O:1 C6H5CHO:1.0
C6H5CH2OH + H [=] C6H5CHO + H2 + H
8.000000E+10
0.0
8235.000000
H:1 C6H5CH2OH:1.0
H2:1 H:1 C6H5CHO:1.0
C6H5CH2OH + H [=] C6H6 + CH2OH
1.200000E+10
0.0
5148.000000
H:1 C6H5CH2OH:1.0
CH2OH:1 C6H6:1.0
C6H5CH2OH + C6H5 [=] C6H5CHO + C6H6 + H
1.400000E+09
0.0
4400.000000
C6H5:1 C6H5CH2OH:1.0
H:1 C6H5CHO:1.0 C6H6:1
C6H5 + HCO [=] C6H5CHO
1.000000E+10
0.0
0.000000
HCO:1 C6H5:1.0
C6H5CHO:1.0
C6H5CHO [=] C6H5CO + H
3.980000E+15
0.0
86900.000000
C6H5CHO:1.0
H:1 C6H5CO:1.0
C6H5CHO + O2 [=] C6H5CO + HO2
1.020000E+10
0.0
38950.000000
C6H5CHO:1.0 O2:1
HO2:1 C6H5CO:1.0
C6H5CHO + OH [=] C6H5CO + H2O
2.350000E+07
0.73
-1110.000000
C6H5CHO:1.0 OH:1
H2O:1 C6H5CO:1.0
C6H5CHO + H [=] C6H5CO + H2
4.100000E+06
1.16
2400.000000
H:1 C6H5CHO:1.0
H2:1 C6H5CO:1.0
C6H5CHO + H [=] C6H6 + HCO
1.930000E+03
2.17
4163.000000
H:1 C6H5CHO:1.0
C6H6:1.0 HCO:1
C6H5CHO + O [=] C6H5CO + OH
5.800000E+09
0.0
1800.000000
C6H5CHO:1.0 O:1
C6H5CO:1.0 OH:1
C6H5CHO + C6H5CH2 [=] C6H5CO + C6H5CH3
2.000000E-09
5.6
2460.000000
C6H5CH2:1 C6H5CHO:1.0
C6H5CH3:1 C6H5CO:1.0
C6H5CHO + CH3 [=] C6H5CO + CH4
2.000000E-09
5.6
2460.000000
CH3:1 C6H5CHO:1.0
CH4:1 C6H5CO:1.0
C6H5CHO + C6H5 [=] C6H5CO + C6H6
2.103000E+09
0.0
4400.000000
C6H5CHO:1.0 C6H5:1
C6H6:1 C6H5CO:1.0
C6H5CO + H2O2 [=] C6H5CHO + HO2
1.800000E+08
0.0
8226.000000
H2O2:1 C6H5CO:1.0
HO2:1 C6H5CHO:1.0
OC6H4CH3 + H (+ M) [=] HOC6H4CH3 (+ M)
1.000000E+11
0.0
0.000000
4.000000E+87
-21.84
13880.000000
H2:2.0 CH4:2.0 H2O:6.0 CO2:2.0 CO:1.5
0.043 304.2 60000 5896.4
OC6H4CH3:1.0 H:1
HOC6H4CH3:1.0
OC6H4CH3 + H [=] C6H5O + CH3
1.930000E+03
2.17
4163.000000
OC6H4CH3:1.0 H:1
CH3:1 C6H5O:1.0
OC6H4CH3 + O [=] C6H4O2 + CH3
8.000000E+10
0.0
0.000000
OC6H4CH3:1.0 O:1
CH3:1 C6H4O2:1.0
HOC6H4CH3 + OH [=] OC6H4CH3 + H2O
6.000000E+09
0.0
0.000000
HOC6H4CH3:1.0 OH:1
OC6H4CH3:1.0 H2O:1
HOC6H4CH3 + H [=] OC6H4CH3 + H2
1.150000E+11
0.0
12400.000000
HOC6H4CH3:1.0 H:1
OC6H4CH3:1.0 H2:1
HOC6H4CH3 + H [=] C6H5CH3 + OH
2.210000E+10
0.0
7910.000000
HOC6H4CH3:1.0 H:1
C6H5CH3:1.0 OH:1
HOC6H4CH3 + H [=] C6H5OH + CH3
1.200000E+10
0.0
5148.000000
HOC6H4CH3:1.0 H:1
CH3:1 C6H5OH:1.0
C6H5CO [=] C6H5 + CO
5.270000E+14
0.0
29013.000000
C6H5CO:1.0
CO:1 C6H5:1.0
C6H5 + H (+ M) [=] C6H6 (+ M)
1.000000E+11
0.0
0.000000
6.600000E+69
-16.3
7000.000000
H2:2.0 CH4:2.0 H2O:6.0 CO2:2.0 CO:1.5
1 0.1 584.9 6113
H:1 C6H5:1.0
C6H6:1.0
C6H6 + OH [=] C6H5 + H2O
3.985000E+02
2.286
1058.000000
C6H6:1.0 OH:1
H2O:1 C6H5:1.0
C6H6 + OH [=] C6H5OH + H
1.300000E+10
0.0
10600.000000
C6H6:1.0 OH:1
H:1 C6H5OH:1.0
C6H6 + O [=] C6H5O + H
1.390000E+10
0.0
4910.000000
C6H6:1.0 O:1
H:1 C6H5O:1.0
C6H6 + O [=] C5H5 + HCO
1.390000E+10
0.0
4530.000000
C6H6:1.0 O:1
C5H5:1.0 HCO:1
C6H5 + H2 [=] C6H6 + H
5.707000E+01
2.43
6273.000000
H2:1 C6H5:1.0
H:1 C6H6:1.0
C6H5 (+ M) [=] o-C6H4 + H (+ M)
4.300000E+12
0.616
77313.000000
1.000000E+81
-18.866
90064.000000
H2:2.0 CH4:2.0 H2O:6.0 CO2:2.0 CO:1.5
0.902 696 358 3856
C6H5:1.0
H:1 o-C6H4:1.0
C6H5 + H [=] o-C6H4 + H2
2.000000E+08
1.1
24500.000000
H:1 C6H5:1.0
H2:1 o-C6H4:1.0
C6H5 + O2 [=] C6H5O + O
2.600000E+10
0.0
6120.000000
O2:1 C6H5:1.0
C6H5O:1.0 O:1
C6H5 + O2 [=] C6H4O2 + H
3.000000E+10
0.0
8980.000000
O2:1 C6H5:1.0
H:1 C6H4O2:1.0
C6H5 + O [=] C5H5 + CO
1.000000E+11
0.0
0.000000
O:1 C6H5:1.0
CO:1 C5H5:1.0
C6H5 + OH [=] C6H5O + H
3.000000E+10
0.0
0.000000
C6H5:1.0 OH:1
H:1 C6H5O:1.0
C6H5 + HO2 [=] C6H5O + OH
3.000000E+10
0.0
0.000000
HO2:1 C6H5:1.0
C6H5O:1.0 OH:1
C6H5 + HO2 [=] C6H6 + O2
1.000000E+09
0.0
0.000000
HO2:1 C6H5:1.0
C6H6:1.0 O2:1
C6H5 + CH4 [=] C6H6 + CH3
3.890000E-06
4.57
5256.000000
CH4:1 C6H5:1.0
CH3:1 C6H6:1.0
C6H5 + C2H6 [=] C6H6 + C2H5
2.100000E+08
0.0
4443.000000
C2H6:1 C6H5:1.0
C2H5:1 C6H6:1.0
C6H5 + CH2O [=] C6H6 + HCO
8.550000E+01
2.19
38.000000
CH2O:1 C6H5:1.0
C6H6:1.0 HCO:1
C6H4O2 [=] C5H4O + CO
7.400000E+11
0.0
59000.000000
C6H4O2:1.0
C5H4O:1.0 CO:1
C6H4O2 + H [=] CO + C5H5O(1,3)
4.300000E+06
1.45
3900.000000
H:1 C6H4O2:1.0
CO:1.0 C5H5O(1,3):1
C6H4O2 + O [=] 2 CO + C2H2 + CH2CO
3.000000E+10
0.0
5000.000000
O:1 C6H4O2:1.0
CH2CO:1 CO:2.0 C2H2:1
C6H5O + H [=] C5H5 + HCO
1.000000E+10
0.0
12000.000000
H:1 C6H5O:1.0
C5H5:1.0 HCO:1
C6H5O + H [=] C5H6 + CO
5.000000E+10
0.0
0.000000
H:1 C6H5O:1.0
CO:1 C5H6:1.0
C6H5O [=] CO + C5H5
3.760000E+54
-12.06
72800.000000
C6H5O:1.0
CO:1.0 C5H5:1
C6H5O + O [=] C6H4O2 + H
2.600000E+07
0.47
795.000000
C6H5O:1.0 O:1
H:1 C6H4O2:1.0
C6H5OH [=] C5H6 + CO
1.000000E+12
0.0
60808.000000
C6H5OH:1.0
CO:1 C5H6:1.0
C6H5OH + OH [=] C6H5O + H2O
2.950000E+03
2.0
-1312.000000
C6H5OH:1.0 OH:1
H2O:1 C6H5O:1.0
C6H5OH + H [=] C6H5O + H2
1.150000E+11
0.0
12398.000000
H:1 C6H5OH:1.0
H2:1 C6H5O:1.0
C6H5OH + O [=] C6H5O + OH
2.810000E+10
0.0
7352.000000
C6H5OH:1.0 O:1
C6H5O:1.0 OH:1
C6H5OH + C2H3 [=] C6H5O + C2H4
6.000000E+09
0.0
0.000000
C2H3:1 C6H5OH:1.0
C2H4:1 C6H5O:1.0
C6H5OH + nC4H5 [=] C6H5O + C4H6
6.000000E+09
0.0
0.000000
C6H5OH:1.0 nC4H5:1
C6H5O:1.0 C4H6:1
C6H5OH + C6H5 [=] C6H5O + C6H6
4.910000E+09
0.0
4400.000000
C6H5OH:1.0 C6H5:1
C6H5O:1.0 C6H6:1
C5H6 + H [=] C2H2 + aC3H5
7.740000E+33
-6.18
32890.000000
H:1 C5H6:1.0
aC3H5:1 C2H2:1.0
C5H6 + H [=] lC5H7
8.270000E+123
-32.3
82348.000000
H:1 C5H6:1.0
lC5H7:1.0
C5H6 + H [=] C5H5 + H2
3.030000E+05
1.71
5590.000000
H:1 C5H6:1.0
H2:1 C5H5:1.0
C5H6 + O [=] C5H5 + OH
4.770000E+01
2.71
1106.000000
O:1 C5H6:1.0
C5H5:1.0 OH:1
C5H6 + O [=] C5H5O(1,3) + H
8.910000E+09
-0.15
590.000000
O:1 C5H6:1.0
H:1 C5H5O(1,3):1.0
C5H6 + O [=] C5H5O(1,3) + H
5.600000E+09
-0.06
200.000000
O:1 C5H6:1.0
H:1 C5H5O(1,3):1.0
C5H6 + O [=] nC4H5 + CO + H
8.700000E+48
-11.09
33240.000000
O:1 C5H6:1.0
H:1 CO:1 nC4H5:1.0
C5H6 + OH [=] C5H5 + H2O
3.080000E+03
2.0
0.000000
C5H6:1.0 OH:1
H2O:1 C5H5:1.0
C5H6 + HO2 [=] C5H5 + H2O2
1.100000E+01
2.6
12900.000000
HO2:1 C5H6:1.0
C5H5:1.0 H2O2:1
C5H6 + O2 [=] C5H5 + HO2
4.000000E+10
0.0
37150.000000
O2:1 C5H6:1.0
HO2:1 C5H5:1.0
C5H6 + HCO [=] C5H5 + CH2O
1.080000E+05
1.9
16000.000000
HCO:1 C5H6:1.0
CH2O:1 C5H5:1.0
C5H6 + CH3 [=] C5H5 + CH4
1.800000E-04
4.0
0.000000
CH3:1 C5H6:1.0
CH4:1 C5H5:1.0
C5H5 + H (+ M) [=] C5H6 (+ M)
1.000000E+11
0.0
0.000000
4.400000E+74
-18.28
12994.000000
H2:2.0 CH4:2.0 H2O:6.0 CO2:2.0 CO:1.5
0.068 400.7 4135.8 5501.9
H:1 C5H5:1.0
C5H6:1.0
C5H5 + O2 [=] C5H5O(2,4) + O
7.780000E+12
-0.73
48740.000000
C5H5:1.0 O2:1
C5H5O(2,4):1.0 O:1
C5H5 + O [=] C5H5O(2,4)
1.120000E-15
5.87
-17310.000000
C5H5:1.0 O:1
C5H5O(2,4):1.0
C5H5 + O [=] C5H4O + H
5.810000E+10
-0.02
20.000000
C5H5:1.0 O:1
H:1 C5H4O:1.0
C5H5 + O [=] nC4H5 + CO
3.200000E+10
-0.17
440.000000
C5H5:1.0 O:1
CO:1 nC4H5:1.0
C5H5 + OH [=] C5H4OH + H
3.510000E+54
-12.18
48350.000000
C5H5:1.0 OH:1
H:1 C5H4OH:1.0
C5H5 + OH [=] C5H5O(2,4) + H
1.360000E+48
-10.46
57100.000000
C5H5:1.0 OH:1
C5H5O(2,4):1.0 H:1
C5H5 + HO2 [=] C5H5O(2,4) + OH
6.270000E+26
-4.69
11650.000000
HO2:1 C5H5:1.0
C5H5O(2,4):1.0 OH:1
C5H5 + OH [=] C5H5OH
6.490000E+11
-0.85
-2730.000000
C5H5:1.0 OH:1
C5H5OH:1.0
C5H5 + OH [=] C5H5OH
1.150000E+40
-8.76
18730.000000
C5H5:1.0 OH:1
C5H5OH:1.0
C5H5 + OH [=] C5H5OH
1.060000E+56
-13.08
33450.000000
C5H5:1.0 OH:1
C5H5OH:1.0
C5H5 + O2 [=] C5H4O + OH
1.800000E+09
0.08
18000.000000
C5H5:1.0 O2:1
C5H4O:1.0 OH:1
C5H5OH + H [=] C5H5O(2,4) + H2
1.150000E+11
0.0
15400.000000
H:1 C5H5OH:1.0
H2:1 C5H5O(2,4):1.0
C5H5OH + H [=] C5H4OH + H2
1.200000E+02
2.5
1492.000000
H:1 C5H5OH:1.0
H2:1 C5H4OH:1.0
C5H5OH + OH [=] C5H5O(2,4) + H2O
6.000000E+09
0.0
0.000000
C5H5OH:1.0 OH:1
C5H5O(2,4):1.0 H2O:1
C5H5OH + OH [=] C5H4OH + H2O
3.080000E+03
2.0
0.000000
C5H5OH:1.0 OH:1
H2O:1 C5H4OH:1.0
C5H5O(2,4) + H [=] C5H5OH
1.000000E+11
0.0
0.000000
C5H5O(2,4):1.0 H:1
C5H5OH:1.0
C5H5O(2,4) [=] C5H4O + H
2.000000E+13
0.0
30000.000000
C5H5O(2,4):1.0
H:1 C5H4O:1.0
C5H5O(2,4) + O2 [=] C5H4O + HO2
1.000000E+08
0.0
0.000000
C5H5O(2,4):1.0 O2:1
C5H4O:1.0 HO2:1
C5H4O + H [=] C5H5O(1,3)
2.000000E+10
0.0
2000.000000
H:1 C5H4O:1.0
C5H5O(1,3):1.0
C5H5O(1,3) [=] c-C4H5 + CO
1.000000E+12
0.0
36000.000000
C5H5O(1,3):1.0
c-C4H5:1.0 CO:1
C5H5O(1,3) + O2 [=] C5H4O + HO2
1.000000E+08
0.0
0.000000
C5H5O(1,3):1.0 O2:1
C5H4O:1.0 HO2:1
C5H4OH [=] C5H4O + H
2.100000E+13
0.0
48000.000000
C5H4OH:1.0
H:1 C5H4O:1.0
C5H4O [=] 2 C2H2 + CO
6.200000E+41
-7.87
98700.000000
C5H4O:1.0
CO:1 C2H2:2.0
C5H4O + H [=] CO + c-C4H5
4.300000E+06
1.45
3900.000000
H:1 C5H4O:1.0
c-C4H5:1 CO:1.0
C5H4O + O [=] CO + HCO + C3H3
6.200000E+05
1.45
-858.000000
C5H4O:1.0 O:1
CO:1.0 HCO:1 C3H3:1
c-C4H5 + H [=] C4H6
1.000000E+10
0.0
0.000000
H:1 c-C4H5:1.0
C4H6:1.0
c-C4H5 + H [=] C2H4 + C2H2
1.000000E+10
0.0
0.000000
H:1 c-C4H5:1.0
C2H4:1.0 C2H2:1
c-C4H5 + O [=] CH2CHO + C2H2
1.000000E+11
0.0
0.000000
c-C4H5:1.0 O:1
CH2CHO:1.0 C2H2:1
c-C4H5 + O2 [=] CH2CHO + CH2CO
4.800000E+08
0.0
19000.000000
c-C4H5:1.0 O2:1
CH2CHO:1.0 CH2CO:1
c-C4H5 [=] C4H4 + H
3.000000E+12
0.0
52000.000000
c-C4H5:1.0
H:1 C4H4:1.0
c-C4H5 [=] C2H3 + C2H2
2.000000E+12
0.0
58000.000000
c-C4H5:1.0
C2H3:1.0 C2H2:1
aC3H5 + C2H3 [=] lC5H7 + H
1.000000E+10
0.0
0.000000
aC3H5:1.0 C2H3:1
H:1 lC5H7:1.0
lC5H7 + O [=] C2H3CHO + C2H3
5.000000E+10
0.0
0.000000
lC5H7:1.0 O:1
C2H3CHO:1.0 C2H3:1
lC5H7 + OH [=] C2H3CHO + C2H4
2.000000E+10
0.0
0.000000
lC5H7:1.0 OH:1
C2H3CHO:1.0 C2H4:1
NC5H12 =] pC4H9 + CH3
5.620000E+23
-1.88
89761.000000
NC5H12:1.0
pC4H9:1.0 CH3:1
NC5H12 =] nC3H7 + C2H5
7.100000E+25
-2.68
87989.000000
NC5H12:1.0
nC3H7:1.0 C2H5:1
NC5H12 + H =] nC3H7 + C2H4 + H2
1.300000E+03
2.54
6756.000000
NC5H12:1.0 H:1
H2:1 nC3H7:1.0 C2H4:1
NC5H12 + H =] C3H6 + C2H5 + H2
2.600000E+03
2.4
4471.000000
NC5H12:1.0 H:1
C3H6:1.0 H2:1 C2H5:1
NC5H12 + H =] C4H81 + CH3 + H2
1.300000E+03
2.4
4471.000000
NC5H12:1.0 H:1
H2:1 CH3:1 C4H81:1.0
NC5H12 + O =] nC3H7 + C2H4 + OH
4.400000E+03
2.4
5504.000000
NC5H12:1.0 O:1
nC3H7:1.0 C2H4:1 OH:1
NC5H12 + O =] C3H6 + C2H5 + OH
6.200000E+02
2.5
2225.000000
NC5H12:1.0 O:1
C3H6:1.0 C2H5:1 OH:1
NC5H12 + O =] C4H81 + CH3 + OH
3.100000E+02
2.5
2225.000000
NC5H12:1.0 O:1
CH3:1 C4H81:1.0 OH:1
NC5H12 + OH =] nC3H7 + C2H4 + H2O
2.600000E+04
1.8
974.000000
NC5H12:1.0 OH:1
nC3H7:1.0 C2H4:1 H2O:1
NC5H12 + OH =] C3H6 + C2H5 + H2O
4.900000E+03
2.0
-596.000000
NC5H12:1.0 OH:1
C3H6:1.0 C2H5:1 H2O:1
NC5H12 + OH =] C4H81 + CH3 + H2O
1.700000E+03
2.0
-1371.000000
NC5H12:1.0 OH:1
CH3:1 H2O:1 C4H81:1.0
NC5H12 + CH3 =] nC3H7 + C2H4 + CH4
9.030000E-04
3.65
7153.000000
NC5H12:1.0 CH3:1
nC3H7:1.0 C2H4:1 CH4:1
NC5H12 + CH3 =] C3H6 + C2H5 + CH4
3.000000E-03
3.46
5480.000000
NC5H12:1.0 CH3:1
C3H6:1.0 C2H5:1 CH4:1
NC5H12 + CH3 =] C4H81 + CH3 + CH4
1.500000E-03
3.46
5480.000000
NC5H12:1.0 CH3:1
CH3:1 C4H81:1.0 CH4:1
NC5H12 + O2 =] nC3H7 + C2H4 + HO2
4.000000E+10
0.0
50930.000000
NC5H12:1.0 O2:1
nC3H7:1.0 C2H4:1 HO2:1
NC5H12 + O2 =] C3H6 + C2H5 + HO2
8.000000E+10
0.0
47590.000000
NC5H12:1.0 O2:1
C3H6:1.0 C2H5:1 HO2:1
NC5H12 + O2 =] C4H81 + CH3 + HO2
4.000000E+10
0.0
47590.000000
NC5H12:1.0 O2:1
CH3:1 C4H81:1.0 HO2:1
NC5H12 + HO2 =] nC3H7 + C2H4 + H2O2
4.760000E+01
2.55
16490.000000
NC5H12:1.0 HO2:1
nC3H7:1.0 C2H4:1 H2O2:1
NC5H12 + HO2 =] C3H6 + C2H5 + H2O2
1.900000E+01
2.6
13910.000000
NC5H12:1.0 HO2:1
C3H6:1.0 C2H5:1 H2O2:1
NC5H12 + HO2 =] C4H81 + CH3 + H2O2
9.500000E+00
2.6
13910.000000
NC5H12:1.0 HO2:1
CH3:1 C4H81:1.0 H2O2:1
NC6H14 =] nC3H7 + C2H4 + CH3
8.450000E+23
-2.03
90033.000000
NC6H14:1.0
CH3:1 nC3H7:1.0 C2H4:1
NC6H14 =] pC4H9 + C2H5
3.760000E+25
-2.51
87932.000000
NC6H14:1.0
pC4H9:1.0 C2H5:1
NC6H14 =] nC3H7 + nC3H7
1.110000E+26
-2.7
87950.000000
NC6H14:1.0
nC3H7:2.0
NC6H14 + H =] nC3H7 + C3H6 + H2
1.300000E+03
2.54
6756.000000
H:1 NC6H14:1.0
C3H6:1 H2:1 nC3H7:1.0
NC6H14 + H =] C3H6 + nC3H7 + H2
2.600000E+03
2.4
4471.000000
H:1 NC6H14:1.0
C3H6:1.0 H2:1 nC3H7:1
NC6H14 + H =] C4H81 + C2H5 + H2
2.600000E+03
2.4
4471.000000
H:1 NC6H14:1.0
H2:1 C2H5:1 C4H81:1.0
NC6H14 + O =] nC3H7 + C3H6 + OH
3.700000E+03
2.4
5504.000000
O:1 NC6H14:1.0
C3H6:1 nC3H7:1.0 OH:1
NC6H14 + O =] C3H6 + nC3H7 + OH
3.500000E+02
2.6
2106.000000
O:1 NC6H14:1.0
C3H6:1.0 nC3H7:1 OH:1
NC6H14 + O =] C4H81 + C2H5 + OH
3.500000E+02
2.6
2106.000000
O:1 NC6H14:1.0
C2H5:1 C4H81:1.0 OH:1
NC6H14 + OH =] nC3H7 + C3H6 + H2O
1.900000E+04
1.8
974.000000
NC6H14:1.0 OH:1
C3H6:1 nC3H7:1.0 H2O:1
NC6H14 + OH =] C3H6 + nC3H7 + H2O
4.000000E+03
2.0
-596.000000
NC6H14:1.0 OH:1
C3H6:1.0 nC3H7:1 H2O:1
NC6H14 + OH =] C4H81 + C2H5 + H2O
2.900000E+01
2.0
-1331.000000
NC6H14:1.0 OH:1
C2H5:1 C4H81:1.0 H2O:1
NC6H14 + CH3 =] nC3H7 + C3H6 + CH4
9.030000E-04
3.65
7153.000000
CH3:1 NC6H14:1.0
C3H6:1 nC3H7:1.0 CH4:1
NC6H14 + CH3 =] C3H6 + nC3H7 + CH4
3.000000E-03
3.46
5480.000000
CH3:1 NC6H14:1.0
C3H6:1.0 nC3H7:1 CH4:1
NC6H14 + CH3 =] C4H81 + C2H5 + CH4
3.000000E-03
3.46
5480.000000
CH3:1 NC6H14:1.0
C2H5:1 C4H81:1.0 CH4:1
NC6H14 + O2 =] nC3H7 + C3H6 + HO2
4.000000E+10
0.0
50930.000000
O2:1 NC6H14:1.0
C3H6:1 nC3H7:1.0 HO2:1
NC6H14 + O2 =] C3H6 + nC3H7 + HO2
8.000000E+10
0.0
47590.000000
O2:1 NC6H14:1.0
C3H6:1.0 nC3H7:1 HO2:1
NC6H14 + O2 =] C4H81 + C2H5 + HO2
8.000000E+10
0.0
47590.000000
O2:1 NC6H14:1.0
C2H5:1 C4H81:1.0 HO2:1
NC6H14 + HO2 =] nC3H7 + C3H6 + H2O2
4.760000E+01
2.55
16490.000000
HO2:1 NC6H14:1.0
C3H6:1 nC3H7:1.0 H2O2:1
NC6H14 + HO2 =] C3H6 + nC3H7 + H2O2
1.900000E+01
2.6
13910.000000
HO2:1 NC6H14:1.0
C3H6:1.0 nC3H7:1 H2O2:1
NC6H14 + HO2 =] C4H81 + C2H5 + H2O2
1.900000E+01
2.6
13910.000000
HO2:1 NC6H14:1.0
C2H5:1 C4H81:1.0 H2O2:1
NC7H16 =] C3H6 + nC3H7 + CH3
8.540000E+23
-2.03
90032.000000
NC7H16:1.0
C3H6:1.0 nC3H7:1 CH3:1
NC7H16 =] nC3H7 + C2H4 + C2H5
5.780000E+25
-2.66
88204.000000
NC7H16:1.0
nC3H7:1.0 C2H4:1 C2H5:1
NC7H16 =] pC4H9 + nC3H7
6.020000E+25
-2.53
87894.000000
NC7H16:1.0
pC4H9:1.0 nC3H7:1
NC7H16 + H =] nC3H7 + C4H81 + H2
1.300000E+03
2.54
6756.000000
H:1 NC7H16:1.0
H2:1 nC3H7:1.0 C4H81:1
NC7H16 + H =] nC3H7 + C4H81 + H2
2.600000E+03
2.4
4471.000000
H:1 NC7H16:1.0
H2:1 nC3H7:1.0 C4H81:1
NC7H16 + H =] pC4H9 + C3H6 + H2
2.600000E+03
2.4
4471.000000
H:1 NC7H16:1.0
C3H6:1 pC4H9:1.0 H2:1
NC7H16 + H =] C5H10 + C2H5 + H2
1.300000E+03
2.4
4471.000000
H:1 NC7H16:1.0
H2:1 C5H10:1.0 C2H5:1
NC7H16 + O =] nC3H7 + C4H81 + OH
2.900000E+03
2.4
5504.000000
O:1 NC7H16:1.0
nC3H7:1.0 C4H81:1 OH:1
NC7H16 + O =] nC3H7 + C4H81 + OH
2.800000E+02
2.6
1908.000000
O:1 NC7H16:1.0
nC3H7:1.0 C4H81:1 OH:1
NC7H16 + O =] pC4H9 + C3H6 + OH
2.800000E+02
2.6
1908.000000
O:1 NC7H16:1.0
C3H6:1 pC4H9:1.0 OH:1
NC7H16 + O =] C5H10 + C2H5 + OH
1.400000E+02
2.6
1908.000000
O:1 NC7H16:1.0
C5H10:1.0 C2H5:1 OH:1
NC7H16 + OH =] nC3H7 + C4H81 + H2O
1.700000E+04
1.8
974.000000
OH:1 NC7H16:1.0
nC3H7:1.0 C4H81:1 H2O:1
NC7H16 + OH =] nC3H7 + C4H81 + H2O
2.900000E+03
2.0
-1311.000000
OH:1 NC7H16:1.0
nC3H7:1.0 C4H81:1 H2O:1
NC7H16 + OH =] pC4H9 + C3H6 + H2O
3.800000E+03
2.0
-595.000000
OH:1 NC7H16:1.0
C3H6:1 pC4H9:1.0 H2O:1
NC7H16 + OH =] C5H10 + C2H5 + H2O
1.500000E+03
2.0
-1311.000000
OH:1 NC7H16:1.0
C5H10:1.0 C2H5:1 H2O:1
NC7H16 + CH3 =] nC3H7 + C4H81 + CH4
9.030000E-04
3.65
7153.000000
CH3:1 NC7H16:1.0
nC3H7:1.0 C4H81:1 CH4:1
NC7H16 + CH3 =] nC3H7 + C4H81 + CH4
3.000000E-03
3.46
5480.000000
CH3:1 NC7H16:1.0
nC3H7:1.0 C4H81:1 CH4:1
NC7H16 + CH3 =] pC4H9 + C3H6 + CH4
3.000000E-03
3.46
5480.000000
CH3:1 NC7H16:1.0
C3H6:1 pC4H9:1.0 CH4:1
NC7H16 + CH3 =] C5H10 + C2H5 + CH4
1.500000E-03
3.46
5480.000000
CH3:1 NC7H16:1.0
C5H10:1.0 CH4:1 C2H5:1
NC7H16 + O2 =] nC3H7 + C4H81 + HO2
4.000000E+10
0.0
50930.000000
O2:1 NC7H16:1.0
nC3H7:1.0 C4H81:1 HO2:1
NC7H16 + O2 =] nC3H7 + C4H81 + HO2
8.000000E+10
0.0
47590.000000
O2:1 NC7H16:1.0
nC3H7:1.0 C4H81:1 HO2:1
NC7H16 + O2 =] pC4H9 + C3H6 + HO2
8.000000E+10
0.0
47590.000000
O2:1 NC7H16:1.0
C3H6:1 pC4H9:1.0 HO2:1
NC7H16 + O2 =] C5H10 + C2H5 + HO2
4.000000E+10
0.0
47590.000000
O2:1 NC7H16:1.0
C5H10:1.0 HO2:1 C2H5:1
NC7H16 + HO2 =] nC3H7 + C4H81 + H2O2
4.760000E+01
2.55
16490.000000
HO2:1 NC7H16:1.0
nC3H7:1.0 C4H81:1 H2O2:1
NC7H16 + HO2 =] nC3H7 + C4H81 + H2O2
1.900000E+01
2.6
13910.000000
HO2:1 NC7H16:1.0
nC3H7:1.0 C4H81:1 H2O2:1
NC7H16 + HO2 =] pC4H9 + C3H6 + H2O2
1.900000E+01
2.6
13910.000000
HO2:1 NC7H16:1.0
C3H6:1 pC4H9:1.0 H2O2:1
NC7H16 + HO2 =] C5H10 + C2H5 + H2O2
9.500000E+00
2.6
13910.000000
HO2:1 NC7H16:1.0
C5H10:1.0 C2H5:1 H2O2:1
NC8H18 =] C4H81 + nC3H7 + CH3
8.530000E+23
-2.03
90034.000000
NC8H18:1.0
CH3:1 nC3H7:1 C4H81:1.0
NC8H18 =] C3H6 + nC3H7 + C2H5
5.860000E+25
-2.66
88206.000000
NC8H18:1.0
C3H6:1.0 nC3H7:1 C2H5:1
NC8H18 =] 2 nC3H7 + C2H4
9.280000E+25
-2.68
88168.000000
NC8H18:1.0
nC3H7:2.0 C2H4:1
NC8H18 =] 2 pC4H9
3.270000E+25
-2.36
87839.000000
NC8H18:1.0
pC4H9:2.0
NC8H18 + H =] C5H10 + nC3H7 + H2
1.300000E+03
2.54
6756.000000
NC8H18:1.0 H:1
H2:1 C5H10:1.0 nC3H7:1
NC8H18 + H =] C5H10 + nC3H7 + H2
2.600000E+03
2.4
4471.000000
NC8H18:1.0 H:1
H2:1 C5H10:1.0 nC3H7:1
NC8H18 + H =] C3H6 + C2H4 + nC3H7 + H2
2.600000E+03
2.4
4471.000000
NC8H18:1.0 H:1
C3H6:1.0 H2:1 nC3H7:1 C2H4:1
NC8H18 + H =] C4H81 + pC4H9 + H2
2.600000E+03
2.4
4471.000000
NC8H18:1.0 H:1
H2:1 pC4H9:1 C4H81:1.0
NC8H18 + O =] C5H10 + nC3H7 + OH
2.500000E+03
2.4
5504.000000
NC8H18:1.0 O:1
C5H10:1.0 nC3H7:1 OH:1
NC8H18 + O =] C5H10 + nC3H7 + OH
2.300000E+02
2.6
1768.000000
NC8H18:1.0 O:1
C5H10:1.0 nC3H7:1 OH:1
NC8H18 + O =] C3H6 + C2H4 + nC3H7 + OH
2.300000E+02
2.6
1768.000000
NC8H18:1.0 O:1
C3H6:1.0 nC3H7:1 C2H4:1 OH:1
NC8H18 + O =] C4H81 + pC4H9 + OH
2.300000E+02
2.6
1768.000000
NC8H18:1.0 O:1
pC4H9:1 C4H81:1.0 OH:1
NC8H18 + OH =] C5H10 + nC3H7 + H2O
1.700000E+04
1.8
974.000000
NC8H18:1.0 OH:1
C5H10:1.0 nC3H7:1 H2O:1
NC8H18 + OH =] C5H10 + nC3H7 + H2O
2.600000E+03
2.0
-1351.000000
NC8H18:1.0 OH:1
C5H10:1.0 nC3H7:1 H2O:1
NC8H18 + OH =] C3H6 + C2H4 + nC3H7 + H2O
3.500000E+03
2.0
-595.100000
NC8H18:1.0 OH:1
C3H6:1.0 nC3H7:1 C2H4:1 H2O:1
NC8H18 + OH =] C4H81 + pC4H9 + H2O
2.600000E+03
2.0
-1351.000000
NC8H18:1.0 OH:1
pC4H9:1 H2O:1 C4H81:1.0
NC8H18 + CH3 =] C5H10 + nC3H7 + CH4
9.030000E-04
3.65
7153.000000
NC8H18:1.0 CH3:1
C5H10:1.0 CH4:1 nC3H7:1
NC8H18 + CH3 =] C5H10 + nC3H7 + CH4
3.000000E-03
3.46
5480.000000
NC8H18:1.0 CH3:1
C5H10:1.0 CH4:1 nC3H7:1
NC8H18 + CH3 =] C3H6 + C2H4 + nC3H7 + CH4
3.000000E-03
3.46
5480.000000
NC8H18:1.0 CH3:1
C3H6:1.0 nC3H7:1 C2H4:1 CH4:1
NC8H18 + CH3 =] C4H81 + pC4H9 + CH4
3.000000E-03
3.46
5480.000000
NC8H18:1.0 CH3:1
pC4H9:1 C4H81:1.0 CH4:1
NC8H18 + O2 =] C5H10 + nC3H7 + HO2
4.000000E+10
0.0
50930.000000
NC8H18:1.0 O2:1
C5H10:1.0 HO2:1 nC3H7:1
NC8H18 + O2 =] C5H10 + nC3H7 + HO2
8.000000E+10
0.0
47590.000000
NC8H18:1.0 O2:1
C5H10:1.0 HO2:1 nC3H7:1
NC8H18 + O2 =] C3H6 + C2H4 + nC3H7 + HO2
8.000000E+10
0.0
47590.000000
NC8H18:1.0 O2:1
C3H6:1.0 nC3H7:1 C2H4:1 HO2:1
NC8H18 + O2 =] C4H81 + pC4H9 + HO2
8.000000E+10
0.0
47590.000000
NC8H18:1.0 O2:1
pC4H9:1 C4H81:1.0 HO2:1
NC8H18 + HO2 =] C5H10 + nC3H7 + H2O2
4.760000E+01
2.55
16490.000000
NC8H18:1.0 HO2:1
C5H10:1.0 nC3H7:1 H2O2:1
NC8H18 + HO2 =] C5H10 + nC3H7 + H2O2
1.900000E+01
2.6
13910.000000
NC8H18:1.0 HO2:1
C5H10:1.0 nC3H7:1 H2O2:1
NC8H18 + HO2 =] C3H6 + C2H4 + nC3H7 + H2O2
1.900000E+01
2.6
13910.000000
NC8H18:1.0 HO2:1
C3H6:1.0 nC3H7:1 C2H4:1 H2O2:1
NC8H18 + HO2 =] C4H81 + pC4H9 + H2O2
1.900000E+01
2.6
13910.000000
NC8H18:1.0 HO2:1
pC4H9:1 C4H81:1.0 H2O2:1
NC9H20 =] C5H10 + nC3H7 + CH3
8.530000E+23
-2.03
90034.000000
NC9H20:1.0
C5H10:1.0 CH3:1 nC3H7:1
NC9H20 =] C4H81 + nC3H7 + C2H5
5.860000E+25
-2.66
88207.000000
NC9H20:1.0
nC3H7:1 C4H81:1.0 C2H5:1
NC9H20 =] 2 nC3H7 + C3H6
9.420000E+25
-2.68
88170.000000
NC9H20:1.0
C3H6:1 nC3H7:2.0
NC9H20 =] pC4H9 + C2H4 + nC3H7
5.040000E+25
-2.51
88114.000000
NC9H20:1.0
pC4H9:1.0 nC3H7:1 C2H4:1
NC9H20 + H =] C6H12 + nC3H7 + H2
1.300000E+03
2.54
6756.000000
H:1 NC9H20:1.0
H2:1 nC3H7:1 C6H12:1.0
NC9H20 + H =] C6H12 + nC3H7 + H2
1.300000E+03
2.4
4471.000000
H:1 NC9H20:1.0
H2:1 nC3H7:1 C6H12:1.0
NC9H20 + H =] 2 C3H6 + nC3H7 + H2
2.600000E+03
2.4
4471.000000
H:1 NC9H20:1.0
C3H6:2.0 H2:1 nC3H7:1
NC9H20 + H =] nC3H7 + C2H4 + C4H81 + H2
2.600000E+03
2.4
4471.000000
H:1 NC9H20:1.0
H2:1 nC3H7:1.0 C2H4:1 C4H81:1
NC9H20 + H =] pC4H9 + C5H10 + H2
2.600000E+03
2.4
4471.000000
H:1 NC9H20:1.0
H2:1 pC4H9:1.0 C5H10:1
NC9H20 + O =] C6H12 + nC3H7 + OH
2.500000E+03
2.4
5504.000000
O:1 NC9H20:1.0
nC3H7:1 C6H12:1.0 OH:1
NC9H20 + O =] C6H12 + nC3H7 + OH
1.150000E+02
2.6
1768.000000
O:1 NC9H20:1.0
nC3H7:1 C6H12:1.0 OH:1
NC9H20 + O =] 2 C3H6 + nC3H7 + OH
2.300000E+02
2.6
1768.000000
O:1 NC9H20:1.0
C3H6:2.0 nC3H7:1 OH:1
NC9H20 + O =] nC3H7 + C2H4 + C4H81 + OH
2.300000E+02
2.6
1768.000000
O:1 NC9H20:1.0
nC3H7:1.0 C2H4:1 C4H81:1 OH:1
NC9H20 + O =] pC4H9 + C5H10 + OH
2.300000E+02
2.6
1768.000000
O:1 NC9H20:1.0
pC4H9:1.0 C5H10:1 OH:1
NC9H20 + OH =] C6H12 + nC3H7 + H2O
1.500000E+04
1.8
974.000000
NC9H20:1.0 OH:1
nC3H7:1 C6H12:1.0 H2O:1
NC9H20 + OH =] C6H12 + nC3H7 + H2O
2.600000E+03
2.0
-1371.000000
NC9H20:1.0 OH:1
nC3H7:1 C6H12:1.0 H2O:1
NC9H20 + OH =] 2 C3H6 + nC3H7 + H2O
3.300000E+03
2.0
-596.000000
NC9H20:1.0 OH:1
C3H6:2.0 nC3H7:1 H2O:1
NC9H20 + OH =] nC3H7 + C2H4 + C4H81 + H2O
2.600000E+03
2.0
-1371.000000
NC9H20:1.0 OH:1
nC3H7:1.0 C2H4:1 C4H81:1 H2O:1
NC9H20 + OH =] pC4H9 + C5H10 + H2O
2.600000E+03
2.0
-1371.000000
NC9H20:1.0 OH:1
pC4H9:1.0 C5H10:1 H2O:1
NC9H20 + CH3 =] C6H12 + nC3H7 + CH4
9.030000E-04
3.65
7153.000000
CH3:1 NC9H20:1.0
nC3H7:1 CH4:1 C6H12:1.0
NC9H20 + CH3 =] C6H12 + nC3H7 + CH4
1.500000E-03
3.46
5480.000000
CH3:1 NC9H20:1.0
nC3H7:1 CH4:1 C6H12:1.0
NC9H20 + CH3 =] 2 C3H6 + nC3H7 + CH4
3.000000E-03
3.46
5480.000000
CH3:1 NC9H20:1.0
C3H6:2.0 nC3H7:1 CH4:1
NC9H20 + CH3 =] nC3H7 + C2H4 + C4H81 + CH4
3.000000E-03
3.46
5480.000000
CH3:1 NC9H20:1.0
nC3H7:1.0 C2H4:1 CH4:1 C4H81:1
NC9H20 + CH3 =] pC4H9 + C5H10 + CH4
3.000000E-03
3.46
5480.000000
CH3:1 NC9H20:1.0
pC4H9:1.0 C5H10:1 CH4:1
NC9H20 + O2 =] C6H12 + nC3H7 + HO2
4.000000E+10
0.0
50930.000000
O2:1 NC9H20:1.0
nC3H7:1 HO2:1 C6H12:1.0
NC9H20 + O2 =] C6H12 + nC3H7 + HO2
4.000000E+10
0.0
47590.000000
O2:1 NC9H20:1.0
nC3H7:1 HO2:1 C6H12:1.0
NC9H20 + O2 =] 2 C3H6 + nC3H7 + HO2
8.000000E+10
0.0
47590.000000
O2:1 NC9H20:1.0
C3H6:2.0 nC3H7:1 HO2:1
NC9H20 + O2 =] nC3H7 + C2H4 + C4H81 + HO2
8.000000E+10
0.0
47590.000000
O2:1 NC9H20:1.0
nC3H7:1.0 C2H4:1 HO2:1 C4H81:1
NC9H20 + O2 =] pC4H9 + C5H10 + HO2
8.000000E+10
0.0
47590.000000
O2:1 NC9H20:1.0
pC4H9:1.0 C5H10:1 HO2:1
NC9H20 + HO2 =] C6H12 + nC3H7 + H2O2
4.760000E+01
2.55
16490.000000
HO2:1 NC9H20:1.0
nC3H7:1 C6H12:1.0 H2O2:1
NC9H20 + HO2 =] C6H12 + nC3H7 + H2O2
9.500000E+00
2.6
13910.000000
HO2:1 NC9H20:1.0
nC3H7:1 C6H12:1.0 H2O2:1
NC9H20 + HO2 =] 2 C3H6 + nC3H7 + H2O2
1.900000E+01
2.6
13910.000000
HO2:1 NC9H20:1.0
C3H6:2.0 nC3H7:1 H2O2:1
NC9H20 + HO2 =] nC3H7 + C2H4 + C4H81 + H2O2
1.900000E+01
2.6
13910.000000
HO2:1 NC9H20:1.0
nC3H7:1.0 C2H4:1 C4H81:1 H2O2:1
NC9H20 + HO2 =] pC4H9 + C5H10 + H2O2
1.900000E+01
2.6
13910.000000
HO2:1 NC9H20:1.0
pC4H9:1.0 C5H10:1 H2O2:1
NC10H22 =] nC3H7 + C6H12 + CH3
5.120000E+24
-2.03
90034.000000
NC10H22:1.0
nC3H7:1.0 CH3:1 C6H12:1
NC10H22 =] C5H10 + nC3H7 + C2H5
5.860000E+25
-2.66
88207.000000
NC10H22:1.0
C2H5:1 C5H10:1.0 nC3H7:1
NC10H22 =] 2 nC3H7 + C4H81
9.410000E+25
-2.68
88171.000000
NC10H22:1.0
nC3H7:2.0 C4H81:1
NC10H22 =] nC3H7 + pC4H9 + C3H6
5.110000E+25
-2.51
88116.000000
NC10H22:1.0
C3H6:1 pC4H9:1 nC3H7:1.0
NC10H22 =] 2 nC3H7 + 2 C2H4
7.770000E+25
-2.65
88389.000000
NC10H22:1.0
nC3H7:2.0 C2H4:2.0
NC10H22 + H =] pC4H9 + C6H12 + H2
1.300000E+03
2.54
6756.000000
NC10H22:1.0 H:1
H2:1 pC4H9:1.0 C6H12:1
NC10H22 + H =] pC4H9 + C6H12 + H2
2.600000E+03
2.4
4471.000000
NC10H22:1.0 H:1
H2:1 pC4H9:1.0 C6H12:1
NC10H22 + H =] C3H6 + C4H81 + nC3H7 + H2
5.200000E+03
2.4
4471.000000
NC10H22:1.0 H:1
C3H6:1.0 H2:1 nC3H7:1 C4H81:1
NC10H22 + H =] nC3H7 + C2H4 + C5H10 + H2
2.600000E+03
2.4
4471.000000
NC10H22:1.0 H:1
H2:1 nC3H7:1.0 C2H4:1 C5H10:1
NC10H22 + O =] pC4H9 + C6H12 + OH
2.500000E+03
2.4
5504.000000
NC10H22:1.0 O:1
pC4H9:1.0 C6H12:1 OH:1
NC10H22 + O =] pC4H9 + C6H12 + OH
2.300000E+02
2.6
1768.000000
NC10H22:1.0 O:1
pC4H9:1.0 C6H12:1 OH:1
NC10H22 + O =] C3H6 + C4H81 + nC3H7 + OH
4.600000E+02
2.6
1768.000000
NC10H22:1.0 O:1
C3H6:1.0 nC3H7:1 C4H81:1 OH:1
NC10H22 + O =] nC3H7 + C2H4 + C5H10 + OH
2.300000E+02
2.6
1768.000000
NC10H22:1.0 O:1
nC3H7:1.0 C2H4:1 C5H10:1 OH:1
NC10H22 + OH =] pC4H9 + C6H12 + H2O
1.400000E+04
1.8
974.000000
NC10H22:1.0 OH:1
pC4H9:1.0 H2O:1 C6H12:1
NC10H22 + OH =] pC4H9 + C6H12 + H2O
2.300000E+03
2.0
-1391.000000
NC10H22:1.0 OH:1
pC4H9:1.0 H2O:1 C6H12:1
NC10H22 + OH =] C3H6 + C4H81 + nC3H7 + H2O
4.000000E+03
2.0
-596.000000
NC10H22:1.0 OH:1
C3H6:1.0 nC3H7:1 C4H81:1 H2O:1
NC10H22 + OH =] nC3H7 + C2H4 + C5H10 + H2O
2.300000E+03
2.0
-1391.000000
NC10H22:1.0 OH:1
nC3H7:1.0 C2H4:1 C5H10:1 H2O:1
NC10H22 + CH3 =] pC4H9 + C6H12 + CH4
9.030000E-04
3.65
7153.000000
NC10H22:1.0 CH3:1
pC4H9:1.0 CH4:1 C6H12:1
NC10H22 + CH3 =] pC4H9 + C6H12 + CH4
3.000000E-03
3.46
5480.000000
NC10H22:1.0 CH3:1
pC4H9:1.0 CH4:1 C6H12:1
NC10H22 + CH3 =] C3H6 + C4H81 + nC3H7 + CH4
6.000000E-03
3.46
5480.000000
NC10H22:1.0 CH3:1
C3H6:1.0 nC3H7:1 C4H81:1 CH4:1
NC10H22 + CH3 =] nC3H7 + C2H4 + C5H10 + CH4
3.000000E-03
3.46
5480.000000
NC10H22:1.0 CH3:1
nC3H7:1.0 C2H4:1 CH4:1 C5H10:1
NC10H22 + O2 =] pC4H9 + C6H12 + HO2
4.000000E+10
0.0
50930.000000
NC10H22:1.0 O2:1
pC4H9:1.0 HO2:1 C6H12:1
NC10H22 + O2 =] pC4H9 + C6H12 + HO2
8.000000E+10
0.0
47590.000000
NC10H22:1.0 O2:1
pC4H9:1.0 HO2:1 C6H12:1
NC10H22 + O2 =] C3H6 + C4H81 + nC3H7 + HO2
1.600000E+11
0.0
47590.000000
NC10H22:1.0 O2:1
C3H6:1.0 nC3H7:1 C4H81:1 HO2:1
NC10H22 + O2 =] nC3H7 + C2H4 + C5H10 + HO2
8.000000E+10
0.0
47590.000000
NC10H22:1.0 O2:1
nC3H7:1.0 C2H4:1 HO2:1 C5H10:1
NC10H22 + HO2 =] pC4H9 + C6H12 + H2O2
4.760000E+01
2.55
16490.000000
NC10H22:1.0 HO2:1
pC4H9:1.0 C6H12:1 H2O2:1
NC10H22 + HO2 =] pC4H9 + C6H12 + H2O2
1.900000E+01
2.6
13910.000000
NC10H22:1.0 HO2:1
pC4H9:1.0 C6H12:1 H2O2:1
NC10H22 + HO2 =] C3H6 + C4H81 + nC3H7 + H2O2
3.800000E+01
2.6
13910.000000
NC10H22:1.0 HO2:1
C3H6:1.0 nC3H7:1 C4H81:1 H2O2:1
NC10H22 + HO2 =] nC3H7 + C2H4 + C5H10 + H2O2
1.900000E+01
2.6
13910.000000
NC10H22:1.0 HO2:1
nC3H7:1.0 C2H4:1 C5H10:1 H2O2:1
NC12H26 =] C6H12 + C2H4 + nC3H7 + CH3
8.530000E+23
-2.03
90034.000000
NC12H26:1.0
CH3:1 nC3H7:1 C2H4:1 C6H12:1.0
NC12H26 =] C6H12 + pC4H9 + C2H5
5.860000E+25
-2.66
88207.000000
NC12H26:1.0
pC4H9:1 C2H5:1 C6H12:1.0
NC12H26 =] C6H12 + 2 nC3H7
5.640000E+26
-2.68
88171.000000
NC12H26:1.0
nC3H7:2.0 C6H12:1.0
NC12H26 =] C5H10 + nC3H7 + pC4H9
5.110000E+25
-2.51
88117.000000
NC12H26:1.0
pC4H9:1 C5H10:1.0 nC3H7:1
NC12H26 =] C4H81 + C2H4 + 2 nC3H7
7.880000E+25
-2.65
88391.000000
NC12H26:1.0
nC3H7:2.0 C4H81:1.0 C2H4:1
NC12H26 =] 2 C3H6 + 2 nC3H7
4.000000E+26
-2.66
88392.000000
NC12H26:1.0
C3H6:2.0 nC3H7:2.0
NC12H26 + H =] C6H12 + C3H6 + nC3H7 + H2
1.300000E+03
2.54
6756.000000
H:1 NC12H26:1.0
C3H6:1 H2:1 nC3H7:1 C6H12:1.0
NC12H26 + H =] C6H12 + C3H6 + nC3H7 + H2
5.200000E+03
2.4
4471.000000
H:1 NC12H26:1.0
C3H6:1 H2:1 nC3H7:1 C6H12:1.0
NC12H26 + H =] C5H10 + C4H81 + nC3H7 + H2
7.800000E+03
2.4
4471.000000
H:1 NC12H26:1.0
H2:1 C5H10:1.0 C4H81:1 nC3H7:1
NC12H26 + O =] C6H12 + C3H6 + nC3H7 + OH
2.500000E+03
2.4
5504.000000
NC12H26:1.0 O:1
C3H6:1 nC3H7:1 C6H12:1.0 OH:1
NC12H26 + O =] C6H12 + C3H6 + nC3H7 + OH
4.600000E+02
2.6
1768.000000
NC12H26:1.0 O:1
C3H6:1 nC3H7:1 C6H12:1.0 OH:1
NC12H26 + O =] C5H10 + C4H81 + nC3H7 + OH
6.900000E+02
2.6
1768.000000
NC12H26:1.0 O:1
C5H10:1.0 C4H81:1 nC3H7:1 OH:1
NC12H26 + OH =] C6H12 + C3H6 + nC3H7 + H2O
1.400000E+04
1.8
974.000000
NC12H26:1.0 OH:1
C3H6:1 nC3H7:1 C6H12:1.0 H2O:1
NC12H26 + OH =] C6H12 + C3H6 + nC3H7 + H2O
4.000000E+03
2.0
-596.000000
NC12H26:1.0 OH:1
C3H6:1 nC3H7:1 C6H12:1.0 H2O:1
NC12H26 + OH =] C5H10 + C4H81 + nC3H7 + H2O
6.000000E+03
2.0
-596.000000
NC12H26:1.0 OH:1
C5H10:1.0 C4H81:1 nC3H7:1 H2O:1
NC12H26 + CH3 =] C6H12 + C3H6 + nC3H7 + CH4
9.030000E-04
3.65
7153.000000
CH3:1 NC12H26:1.0
C3H6:1 nC3H7:1 CH4:1 C6H12:1.0
NC12H26 + CH3 =] C6H12 + C3H6 + nC3H7 + CH4
6.000000E-03
3.46
5480.000000
CH3:1 NC12H26:1.0
C3H6:1 nC3H7:1 CH4:1 C6H12:1.0
NC12H26 + CH3 =] C5H10 + C4H81 + nC3H7 + CH4
9.000000E-03
3.46
5480.000000
CH3:1 NC12H26:1.0
C5H10:1.0 C4H81:1 CH4:1 nC3H7:1
NC12H26 + O2 =] C6H12 + C3H6 + nC3H7 + HO2
4.000000E+10
0.0
50930.000000
NC12H26:1.0 O2:1
C3H6:1 nC3H7:1 HO2:1 C6H12:1.0
NC12H26 + O2 =] C6H12 + C3H6 + nC3H7 + HO2
1.600000E+11
0.0
47590.000000
NC12H26:1.0 O2:1
C3H6:1 nC3H7:1 HO2:1 C6H12:1.0
NC12H26 + O2 =] C5H10 + C4H81 + nC3H7 + HO2
2.400000E+11
0.0
47590.000000
NC12H26:1.0 O2:1
C5H10:1.0 C4H81:1 HO2:1 nC3H7:1
NC12H26 + HO2 =] C6H12 + C3H6 + nC3H7 + H2O2
4.760000E+01
2.55
16490.000000
NC12H26:1.0 HO2:1
C3H6:1 nC3H7:1 C6H12:1.0 H2O2:1
NC12H26 + HO2 =] C6H12 + C3H6 + nC3H7 + H2O2
3.800000E+01
2.6
13910.000000
NC12H26:1.0 HO2:1
C3H6:1 nC3H7:1 C6H12:1.0 H2O2:1
NC12H26 + HO2 =] C5H10 + C4H81 + nC3H7 + H2O2
5.700000E+01
2.6
13910.000000
NC12H26:1.0 HO2:1
C5H10:1.0 C4H81:1 nC3H7:1 H2O2:1
C5H10 [=] C2H5 + aC3H5
7.240000E+22
-1.94
75470.000000
C5H10:1.0
C2H5:1.0 aC3H5:1
C5H10 + H [=] C2H4 + nC3H7
8.000000E+18
-2.39
11180.000000
H:1 C5H10:1.0
nC3H7:1 C2H4:1.0
C5H10 + H [=] C3H6 + C2H5
1.600000E+19
-2.39
11180.000000
H:1 C5H10:1.0
C3H6:1.0 C2H5:1
C5H10 + H [=] C4H6 + CH3 + H2
5.400000E+01
2.5
-1900.000000
H:1 C5H10:1.0
H2:1 CH3:1 C4H6:1.0
C5H10 + O [=] pC4H9 + HCO
3.300000E+05
1.45
-402.000000
C5H10:1.0 O:1
pC4H9:1.0 HCO:1
C6H12 [=] aC3H5 + nC3H7
1.070000E+23
-2.03
74958.000000
C6H12:1.0
nC3H7:1 aC3H5:1.0
C6H12 + H [=] C2H4 + pC4H9
8.000000E+18
-2.39
11180.000000
H:1 C6H12:1.0
pC4H9:1 C2H4:1.0
C6H12 + H [=] C3H6 + nC3H7
1.600000E+19
-2.39
11180.000000
H:1 C6H12:1.0
C3H6:1.0 nC3H7:1
C6H12 + H [=] C4H6 + C2H5 + H2
5.400000E+01
2.5
-1900.000000
H:1 C6H12:1.0
H2:1 C2H5:1 C4H6:1.0
C6H12 + O [=] C2H4 + nC3H7 + HCO
3.300000E+05
1.45
-402.000000
C6H12:1.0 O:1
nC3H7:1 C2H4:1.0 HCO:1
NO + H + N2 =] HNO + N2
7.000000E+13
-1.5
0.000000
H:1 N2:1 NO:1.0
N2:1 HNO:1.0
HNO + N2 =] NO + H + N2
2.718000E+18
-1.724
49995.940000
N2:1 HNO:1.0
H:1 N2:1 NO:1.0
NO + HO2 =] NO2 + OH
2.100000E+09
0.0
-478.970000
HO2:1 NO:1.0
NO2:1.0 OH:1
NO2 + OH =] NO + HO2
2.848000E+10
-0.123
6305.930000
NO2:1.0 OH:1
HO2:1 NO:1.0
NO + HCO =] HNO + CO
7.200000E+09
0.0
0.000000
HCO:1 NO:1.0
CO:1 HNO:1.0
HNO + CO =] NO + HCO
2.743000E+10
0.1
34506.930000
CO:1 HNO:1.0
HCO:1 NO:1.0
NO + C2H3 =] C2H2 + HNO
1.000000E+09
0.0
1000.000000
C2H3:1 NO:1.0
C2H2:1.0 HNO:1
C2H2 + HNO =] NO + C2H3
3.310000E+11
-0.5
16224.900000
C2H2:1.0 HNO:1
C2H3:1 NO:1.0
NO2 + H =] NO + OH
8.400000E+10
0.0
0.000000
H:1 NO2:1.0
OH:1 NO:1.0
NO + OH =] NO2 + H
9.604000E+05
0.914
28193.120000
OH:1 NO:1.0
H:1 NO2:1.0
NO2 + O =] NO + O2
3.900000E+09
0.0
-238.050000
O:1 NO2:1.0
O2:1 NO:1.0
NO + O2 =] NO2 + O
2.248000E+07
0.477
45235.900000
O2:1 NO:1.0
O:1 NO2:1.0
NO2 + HCO =] CO + HONO
1.200000E+20
-3.29
2354.920000
HCO:1 NO2:1.0
HONO:1 CO:1.0
NO2 + HCO =] H + CO2 + NO
8.400000E+12
-0.75
1929.970000
HCO:1 NO2:1.0
H:1.0 CO2:1 NO:1
NO2 + CO =] CO2 + NO
9.000000E+10
0.0
33778.920000
CO:1 NO2:1.0
CO2:1.0 NO:1
CO2 + NO =] NO2 + CO
6.319000E+12
-0.379
88090.110000
CO2:1.0 NO:1
CO:1 NO2:1.0
NO2 + CH2O =] HCO + HONO
8.000000E-01
2.77
13729.920000
CH2O:1 NO2:1.0
HONO:1 HCO:1.0
NO2 + CH2 =] CH2O + NO
5.900000E+10
0.0
0.000000
CH2:1 NO2:1.0
CH2O:1.0 NO:1
NO2 + CH =] HCO + NO
1.000000E+11
0.0
0.000000
CH:1 NO2:1.0
HCO:1.0 NO:1
HNO + H =] H2 + NO
4.500000E+08
0.72
655.110000
H:1 HNO:1.0
H2:1.0 NO:1
H2 + NO =] HNO + H
4.369000E+06
1.231
54266.010000
H2:1.0 NO:1
H:1 HNO:1.0
HNO + O =] NO + OH
1.000000E+10
0.0
0.000000
O:1 HNO:1.0
OH:1 NO:1.0
NO + OH =] HNO + O
5.942000E+07
0.472
51822.900000
OH:1 NO:1.0
O:1 HNO:1.0
HNO + OH =] NO + H2O
3.600000E+10
0.0
0.000000
HNO:1.0 OH:1
H2O:1 NO:1.0
NO + H2O =] HNO + OH
5.619000E+09
0.358
69108.030000
H2O:1 NO:1.0
HNO:1.0 OH:1
HNO + O2 =] HO2 + NO
1.000000E+10
0.0
25000.000000
O2:1 HNO:1.0
HO2:1.0 NO:1
HO2 + NO =] HNO + O2
7.599000E+08
0.117
24563.100000
HO2:1.0 NO:1
O2:1 HNO:1.0
HONO + H =] H2 + NO2
1.200000E+10
0.0
7352.060000
H:1 HONO:1.0
H2:1.0 NO2:1
H2 + NO2 =] HONO + H
8.233000E+06
0.909
32326.960000
H2:1.0 NO2:1
H:1 HONO:1.0
HONO + O =] OH + NO2
1.200000E+10
0.0
5961.040000
HONO:1.0 O:1
NO2:1 OH:1.0
HONO + OH =] H2O + NO2
4.000000E+09
0.0
0.000000
HONO:1.0 OH:1
H2O:1.0 NO2:1
H2O + NO2 =] HONO + OH
4.412000E+07
0.756
40471.080000
H2O:1.0 NO2:1
HONO:1.0 OH:1
NH3 + H =] NH2 + H2
6.400000E+02
2.39
10170.890000
H:1 NH3:1.0
H2:1 NH2:1.0
NH2 + H2 =] NH3 + H
8.595000E-01
2.943
4824.090000
H2:1 NH2:1.0
H:1 NH3:1.0
NH3 + O =] NH2 + OH
9.400000E+03
1.94
6460.090000
O:1 NH3:1.0
OH:1 NH2:1.0
NH2 + OH =] NH3 + O
7.725000E+00
2.453
-675.910000
OH:1 NH2:1.0
O:1 NH3:1.0
NH3 + OH =] NH2 + H2O
2.000000E+03
2.04
565.970000
NH3:1.0 OH:1
H2O:1 NH2:1.0
NH2 + H2O =] NH3 + OH
4.318000E+01
2.44
10715.110000
H2O:1 NH2:1.0
NH3:1.0 OH:1
NH2 + H =] NH + H2
4.000000E+10
0.0
3650.100000
H:1 NH2:1.0
NH:1.0 H2:1
NH + H2 =] NH2 + H
4.139000E+09
0.227
15528.920000
NH:1.0 H2:1
H:1 NH2:1.0
NH2 + O =] HNO + H
6.600000E+11
-0.5
0.000000
O:1 NH2:1.0
H:1 HNO:1.0
HNO + H =] NH2 + O
3.680000E+14
-1.049
29636.950000
H:1 HNO:1.0
O:1 NH2:1.0
NH2 + O =] NH + OH
6.800000E+09
0.0
0.000000
O:1 NH2:1.0
NH:1.0 OH:1
NH + OH =] NH2 + O
4.306000E+08
0.188
10090.110000
NH:1.0 OH:1
O:1 NH2:1.0
NH2 + OH =] NH + H2O
4.000000E+03
2.0
1000.000000
OH:1 NH2:1.0
NH:1.0 H2O:1
NH + H2O =] NH2 + OH
6.653000E+03
2.074
28375.000000
NH:1.0 H2O:1
OH:1 NH2:1.0
NH2 + HO2 =] NH3 + O2
1.000000E+10
0.0
0.000000
HO2:1 NH2:1.0
O2:1 NH3:1.0
NH3 + O2 =] NH2 + HO2
9.514000E+11
-0.159
59395.080000
O2:1 NH3:1.0
HO2:1 NH2:1.0
NH2 + NO =] NNH + OH
8.900000E+09
-0.35
0.000000
NO:1 NH2:1.0
OH:1 NNH:1.0
NNH + OH =] NH2 + NO
2.703000E+10
-0.574
-739.010000
OH:1 NNH:1.0
NO:1 NH2:1.0
NH2 + NO =] N2 + H2O
2.900000E+12
-0.988
0.000000
NO:1 NH2:1.0
N2:1.0 H2O:1
N2 + H2O =] NH2 + NO
8.082000E+12
-0.709
124628.110000
N2:1.0 H2O:1
NO:1 NH2:1.0
NH2 + NO2 =] N2O + H2O
3.200000E+15
-2.2
0.000000
NO2:1 NH2:1.0
H2O:1 N2O:1.0
NH2 + N =] N2 + 2.0 H
7.200000E+10
0.0
0.000000
N:1 NH2:1.0
H:2.0 N2:1.0
N2 + 2.0 H =] NH2 + N
1.675000E+09
-0.203
54496.890000
H:2.0 N2:1.0
N:1 NH2:1.0
NH + H =] N + H2
3.000000E+10
0.0
0.000000
NH:1.0 H:1
H2:1 N:1.0
N + H2 =] NH + H
5.068000E+10
0.123
24184.990000
H2:1 N:1.0
NH:1.0 H:1
NH + O =] NO + H
9.200000E+10
0.0
0.000000
NH:1.0 O:1
H:1 NO:1.0
NO + H =] NH + O
4.813000E+12
-0.265
71369.980000
H:1 NO:1.0
NH:1.0 O:1
NH + OH =] HNO + H
2.000000E+10
0.0
0.000000
NH:1.0 OH:1
H:1 HNO:1.0
HNO + H =] NH + OH
1.761000E+14
-0.737
19547.080000
H:1 HNO:1.0
NH:1.0 OH:1
NH + OH =] N + H2O
5.000000E+08
0.5
2000.000000
NH:1.0 OH:1
H2O:1 N:1.0
N + H2O =] NH + OH
1.358000E+10
0.47
41681.880000
H2O:1 N:1.0
NH:1.0 OH:1
NH + O2 =] HNO + O
4.600000E+02
2.0
6500.000000
NH:1.0 O2:1
O:1 HNO:1.0
HNO + O =] NH + O2
8.033000E+03
1.7
8766.010000
O:1 HNO:1.0
NH:1.0 O2:1
NH + O2 =] NO + OH
1.300000E+03
1.5
99.900000
NH:1.0 O2:1
OH:1 NO:1.0
NO + OH =] NH + O2
1.349000E+02
1.672
54188.100000
OH:1 NO:1.0
NH:1.0 O2:1
NH + NO =] N2O + H
2.850000E+11
-0.366
0.000000
NH:1.0 NO:1
H:1 N2O:1.0
N2O + H =] NH + NO
1.266000E+18
-1.556
36123.090000
H:1 N2O:1.0
NH:1.0 NO:1
NH + NO =] N2 + OH
2.200000E+10
-0.23
0.000000
NH:1.0 NO:1
N2:1.0 OH:1
N2 + OH =] NH + NO
3.686000E+10
-0.025
97253.110000
N2:1.0 OH:1
NH:1.0 NO:1
NH + NO2 =] N2O + OH
1.000000E+10
0.0
0.000000
NH:1.0 NO2:1
N2O:1.0 OH:1
N2O + OH =] NH + NO2
5.079000E+11
-0.277
64315.970000
N2O:1.0 OH:1
NH:1.0 NO2:1
2.0 NH =] N2 + 2.0 H
2.500000E+10
0.0
0.000000
NH:2.0
H:2.0 N2:1.0
N2 + 2.0 H =] 2.0 NH
9.498000E+09
-0.308
66804.020000
H:2.0 N2:1.0
NH:2.0
NH + N =] N2 + H
3.000000E+10
0.0
0.000000
NH:1.0 N:1
H:1 N2:1.0
N2 + H =] NH + N
2.544000E+12
-0.143
146226.100000
H:1 N2:1.0
NH:1.0 N:1
N + OH =] NO + H
3.800000E+10
0.0
0.000000
OH:1 N:1.0
H:1 NO:1.0
NO + H =] N + OH
1.923000E+12
-0.348
48973.950000
H:1 NO:1.0
OH:1 N:1.0
N + O2 =] NO + O
6.400000E+06
1.0
6280.110000
O2:1 N:1.0
O:1 NO:1.0
NO + O =] N + O2
6.424000E+05
1.088
37972.040000
O:1 NO:1.0
O2:1 N:1.0
N + NO =] N2 + O
3.300000E+09
0.3
0.000000
NO:1 N:1.0
N2:1.0 O:1
N2 + O =] N + NO
5.349000E+09
0.422
74856.120000
N2:1.0 O:1
NO:1 N:1.0
N + CO2 =] NO + CO
1.900000E+08
0.0
3400.100000
CO2:1 N:1.0
CO:1 NO:1.0
NO + CO =] N + CO2
1.566000E+03
0.945
26254.060000
CO:1 NO:1.0
CO2:1 N:1.0
N + HCCO =] HCN + CO
5.000000E+10
0.0
0.000000
HCCO:1 N:1.0
CO:1 HCN:1.0
N + CH3 =] H2CN + H
7.100000E+10
0.0
0.000000
CH3:1 N:1.0
H:1 H2CN:1.0
N + CH2 =] HCN + H
5.000000E+10
0.0
0.000000
CH2:1 N:1.0
H:1 HCN:1.0
N2 + CH2 =] N + H2CN
5.170000E+06
0.952
78416.110000
N2:1.0 CH2:1
H2CN:1 N:1.0
N + CH =] CN + H
1.300000E+10
0.0
0.000000
CH:1 N:1.0
H:1 CN:1.0
N + C2H3 =] HCN + CH2
2.000000E+10
0.0
0.000000
C2H3:1 N:1.0
CH2:1 HCN:1.0
NNH =] N2 + H
1.000000E+07
0.0
0.000000
NNH:1.0
H:1 N2:1.0
N2 + H =] NNH
1.514000E+03
0.369
6261.950000
H:1 N2:1.0
NNH:1.0
NNH + H =] N2 + H2
1.000000E+11
0.0
0.000000
H:1 NNH:1.0
H2:1 N2:1.0
N2 + H2 =] NNH + H
5.709000E+09
0.656
109869.980000
H2:1 N2:1.0
H:1 NNH:1.0
NNH + O =] N2 + OH
8.000000E+10
0.0
0.000000
O:1 NNH:1.0
N2:1.0 OH:1
N2 + OH =] NNH + O
2.795000E+09
0.617
108081.020000
N2:1.0 OH:1
O:1 NNH:1.0
NNH + O =] N2O + H
1.000000E+11
0.0
0.000000
O:1 NNH:1.0
H:1 N2O:1.0
N2O + H =] NNH + O
9.263000E+15
-0.779
46951.960000
H:1 N2O:1.0
O:1 NNH:1.0
NNH + O =] NH + NO
5.000000E+10
0.0
0.000000
O:1 NNH:1.0
NH:1.0 NO:1
NH + NO =] NNH + O
1.043000E+09
0.412
10829.110000
NH:1.0 NO:1
O:1 NNH:1.0
NNH + OH =] N2 + H2O
5.000000E+10
0.0
0.000000
OH:1 NNH:1.0
N2:1.0 H2O:1
N2 + H2O =] NNH + OH
4.589000E+10
0.503
125367.110000
N2:1.0 H2O:1
OH:1 NNH:1.0
NNH + O2 =] N2 + HO2
2.000000E+11
0.0
0.000000
O2:1 NNH:1.0
N2:1.0 HO2:1
N2 + HO2 =] NNH + O2
8.937000E+10
0.262
55821.940000
N2:1.0 HO2:1
O2:1 NNH:1.0
NNH + O2 =] N2 + O2 + H
5.000000E+10
0.0
0.000000
O2:1 NNH:1.0
H:1 N2:1.0 O2:1
N2 + O2 + H =] NNH + O2
7.571000E+06
0.369
6261.950000
H:1 N2:1.0 O2:1
O2:1 NNH:1.0
NNH + NO =] N2 + HNO
5.000000E+10
0.0
0.000000
NO:1 NNH:1.0
N2:1.0 HNO:1
N2 + HNO =] NNH + NO
2.940000E+11
0.145
56259.080000
N2:1.0 HNO:1
NO:1 NNH:1.0
N2O + H =] N2 + OH
2.360000E-14
7.0
-440.970000
H:1 N2O:1.0
N2:1.0 OH:1
N2 + OH =] N2O + H
8.901000E-21
8.396
60689.050000
N2:1.0 OH:1
H:1 N2O:1.0
N2O + O =] 2.0 NO
6.600000E+10
0.0
26630.020000
N2O:1.0 O:1
NO:2.0
2.0 NO =] N2O + O
7.772000E+05
0.926
61876.910000
NO:2.0
N2O:1.0 O:1
N2O + O =] N2 + O2
1.000000E+11
0.0
28000.000000
N2O:1.0 O:1
N2:1.0 O2:1
N2 + O2 =] N2O + O
1.902000E+07
0.959
106411.090000
N2:1.0 O2:1
N2O:1.0 O:1
N2O + OH =] N2 + HO2
1.300000E-05
4.72
36560.950000
N2O:1.0 OH:1
N2:1.0 HO2:1
N2 + HO2 =] N2O + OH
3.162000E-08
5.325
62712.950000
N2:1.0 HO2:1
N2O:1.0 OH:1
N2O + OH =] HNO + NO
1.200000E-07
4.33
25081.020000
N2O:1.0 OH:1
HNO:1.0 NO:1
N2O + NO =] NO2 + N2
5.300000E+02
2.23
46281.070000
N2O:1.0 NO:1
N2:1 NO2:1.0
NO2 + N2 =] N2O + NO
1.748000E+01
2.712
79217.970000
N2:1 NO2:1.0
N2O:1.0 NO:1
N2O + CO =] N2 + CO2
3.200000E+08
0.0
20237.090000
CO:1 N2O:1.0
N2:1.0 CO2:1
N2 + CO2 =] N2O + CO
7.411000E+08
0.103
107485.900000
N2:1.0 CO2:1
CO:1 N2O:1.0
N2O + CH =] HCN + NO
1.900000E+10
0.0
-510.990000
CH:1 N2O:1.0
HCN:1.0 NO:1
HCN + O =] NCO + H
1.400000E+01
2.64
4979.920000
HCN:1.0 O:1
H:1 NCO:1.0
NCO + H =] HCN + O
1.408000E+04
2.002
13217.970000
H:1 NCO:1.0
HCN:1.0 O:1
HCN + O =] NH + CO
3.500000E+00
2.64
4979.920000
HCN:1.0 O:1
NH:1.0 CO:1
NH + CO =] HCN + O
1.595000E-03
3.444
36860.900000
NH:1.0 CO:1
HCN:1.0 O:1
HCN + O =] CN + OH
2.700000E+06
1.58
29200.050000
HCN:1.0 O:1
CN:1.0 OH:1
CN + OH =] HCN + O
3.968000E+02
2.409
6466.060000
CN:1.0 OH:1
HCN:1.0 O:1
HCN + OH =] CN + H2O
3.900000E+03
1.83
10299.950000
HCN:1.0 OH:1
H2O:1 CN:1.0
CN + H2O =] HCN + OH
1.506000E+01
2.546
4852.060000
H2O:1 CN:1.0
HCN:1.0 OH:1
HCN + OH =] HOCN + H
5.900000E+01
2.4
12500.000000
HCN:1.0 OH:1
HOCN:1.0 H:1
HOCN + H =] HCN + OH
9.210000E+03
2.084
5473.950000
HOCN:1.0 H:1
HCN:1.0 OH:1
HCN + OH =] HNCO + H
2.000000E-06
4.0
1000.000000
HCN:1.0 OH:1
HNCO:1.0 H:1
HNCO + H =] HCN + OH
4.273000E-02
3.129
19071.940000
HNCO:1.0 H:1
HCN:1.0 OH:1
HCN + OH =] NH2 + CO
7.800000E-07
4.0
4000.000000
HCN:1.0 OH:1
CO:1 NH2:1.0
NH2 + CO =] HCN + OH
5.614000E-09
4.617
25791.110000
CO:1 NH2:1.0
HCN:1.0 OH:1
HCN + CH2* =] CH3 + CN
5.000000E+10
0.0
0.000000
HCN:1.0 CH2*:1
CH3:1.0 CN:1
CH3 + CN =] HCN + CH2*
5.983000E+09
0.216
-5493.070000
CH3:1.0 CN:1
HCN:1.0 CH2*:1
CN + O =] CO + N
7.700000E+10
0.0
0.000000
CN:1.0 O:1
CO:1.0 N:1
CO + N =] CN + O
2.468000E+11
0.058
77010.990000
CO:1.0 N:1
CN:1.0 O:1
CN + OH =] NCO + H
4.000000E+10
0.0
0.000000
CN:1.0 OH:1
H:1 NCO:1.0
NCO + H =] CN + OH
2.738000E+17
-1.468
30972.040000
H:1 NCO:1.0
CN:1.0 OH:1
CN + O2 =] NCO + O
7.500000E+09
0.0
-389.100000
CN:1.0 O2:1
O:1 NCO:1.0
NCO + O =] CN + O2
1.018000E+14
-1.031
13300.910000
O:1 NCO:1.0
CN:1.0 O2:1
CN + CO2 =] NCO + CO
3.700000E+03
2.16
26884.080000
CO2:1 CN:1.0
CO:1 NCO:1.0
NCO + CO =] CN + CO2
4.124000E+03
1.985
31735.900000
CO:1 NCO:1.0
CO2:1 CN:1.0
CN + H2 =] HCN + H
3.000000E+02
2.45
2237.090000
H2:1 CN:1.0
H:1 HCN:1.0
HCN + H =] CN + H2
1.249000E+06
1.581
23181.880000
H:1 HCN:1.0
H2:1 CN:1.0
CN + CH4 =] CH3 + HCN
6.200000E+01
2.64
-436.900000
CH4:1 CN:1.0
CH3:1.0 HCN:1
CH3 + HCN =] CN + CH4
2.769000E+02
2.187
18625.960000
CH3:1.0 HCN:1
CH4:1 CN:1.0
CN + CH2CO =] HCCO + HCN
2.000000E+10
0.0
0.000000
CH2CO:1 CN:1.0
HCN:1 HCCO:1.0
HCCO + HCN =] CN + CH2CO
2.281000E+10
-0.286
17099.900000
HCN:1 HCCO:1.0
CH2CO:1 CN:1.0
CN + C2H6 =] C2H5 + HCN
1.200000E+02
2.77
-1788.000000
C2H6:1 CN:1.0
C2H5:1.0 HCN:1
C2H5 + HCN =] CN + C2H6
1.289000E+02
2.488
22180.930000
C2H5:1.0 HCN:1
C2H6:1 CN:1.0
CN + C2H4 =] C2H3 + HCN
5.900000E+11
-0.24
0.000000
C2H4:1 CN:1.0
HCN:1 C2H3:1.0
C2H3 + HCN =] CN + C2H4
1.542000E+11
-0.356
12711.040000
HCN:1 C2H3:1.0
C2H4:1 CN:1.0
HNCO + H =] NH2 + CO
2.200000E+04
1.7
3799.950000
HNCO:1.0 H:1
CO:1 NH2:1.0
NH2 + CO =] HNCO + H
7.412000E-03
3.188
7518.880000
CO:1 NH2:1.0
HNCO:1.0 H:1
HNCO + O =] HNO + CO
1.500000E+05
1.57
44011.950000
HNCO:1.0 O:1
CO:1 HNO:1.0
HNO + CO =] HNCO + O
2.817000E+01
2.508
77368.070000
CO:1 HNO:1.0
HNCO:1.0 O:1
HNCO + O =] NH + CO2
9.800000E+04
1.41
8523.900000
HNCO:1.0 O:1
NH:1.0 CO2:1
NH + CO2 =] HNCO + O
1.284000E+04
1.792
48451.960000
NH:1.0 CO2:1
HNCO:1.0 O:1
HNCO + O =] NCO + OH
2.200000E+03
2.11
11424.950000
HNCO:1.0 O:1
OH:1 NCO:1.0
NCO + OH =] HNCO + O
1.036000E+02
2.342
1591.060000
OH:1 NCO:1.0
HNCO:1.0 O:1
HNCO + OH =] NCO + H2O
6.400000E+02
2.0
2563.100000
HNCO:1.0 OH:1
H2O:1 NCO:1.0
NCO + H2O =] HNCO + OH
7.915000E+02
2.119
10014.100000
H2O:1 NCO:1.0
HNCO:1.0 OH:1
HNCO + O2 =] HNO + CO2
1.000000E+09
0.0
35000.000000
HNCO:1.0 O2:1
CO2:1 HNO:1.0
HNO + CO2 =] HNCO + O2
2.288000E+09
0.082
77193.120000
CO2:1 HNO:1.0
HNCO:1.0 O2:1
HNCO + NH2 =] NH3 + NCO
5.000000E+09
0.0
6200.050000
HNCO:1.0 NH2:1
NH3:1.0 NCO:1
NH3 + NCO =] HNCO + NH2
2.864000E+11
-0.281
3501.910000
NH3:1.0 NCO:1
HNCO:1.0 NH2:1
HOCN + H =] HNCO + H
2.000000E+04
2.0
2000.000000
HOCN:1.0 H:1
HNCO:1.0 H:1
HNCO + H =] HOCN + H
2.737000E+06
1.445
27097.990000
HNCO:1.0 H:1
HOCN:1.0 H:1
HOCN + O =] NCO + OH
1.500000E+01
2.64
4000.000000
HOCN:1.0 O:1
OH:1 NCO:1.0
NCO + OH =] HOCN + O
9.665000E+01
2.318
19264.100000
OH:1 NCO:1.0
HOCN:1.0 O:1
HOCN + OH =] NCO + H2O
6.400000E+02
2.0
2563.100000
HOCN:1.0 OH:1
H2O:1 NCO:1.0
NCO + H2O =] HOCN + OH
1.083000E+05
1.564
35112.090000
H2O:1 NCO:1.0
HOCN:1.0 OH:1
NCO + NO =] N2O + CO
8.400000E+14
-1.73
762.910000
NO:1 NCO:1.0
CO:1 N2O:1.0
N2O + CO =] NCO + NO
1.691000E+15
-1.478
60528.920000
CO:1 N2O:1.0
NO:1 NCO:1.0
NCO + NO =] N2 + CO2
5.600000E+14
-1.73
762.910000
NO:1 NCO:1.0
N2:1.0 CO2:1
N2 + CO2 =] NCO + NO
2.611000E+15
-1.375
147777.010000
N2:1.0 CO2:1
NO:1 NCO:1.0
NCO + HO2 =] HNCO + O2
2.000000E+10
0.0
0.000000
HO2:1 NCO:1.0
HNCO:1.0 O2:1
HNCO + O2 =] NCO + HO2
3.321000E+10
0.122
62093.930000
HNCO:1.0 O2:1
HO2:1 NCO:1.0
NCO + H =] NH + CO
5.000000E+10
0.0
0.000000
H:1 NCO:1.0
NH:1.0 CO:1
NH + CO =] NCO + H
2.265000E+04
1.443
23642.930000
NH:1.0 CO:1
H:1 NCO:1.0
NCO + O =] NO + CO
4.700000E+10
0.0
0.000000
O:1 NCO:1.0
CO:1 NO:1.0
NO + CO =] NCO + O
1.114000E+06
1.178
95012.910000
CO:1 NO:1.0
O:1 NCO:1.0
NCO + OH =] NO + HCO
5.000000E+09
0.0
15000.000000
OH:1 NCO:1.0
HCO:1 NO:1.0
NO + HCO =] NCO + OH
5.235000E+06
0.605
23683.080000
HCO:1 NO:1.0
OH:1 NCO:1.0
NCO + O2 =] NO + CO2
2.000000E+09
0.0
20000.000000
O2:1 NCO:1.0
CO2:1 NO:1.0
NO + CO2 =] NCO + O2
5.774000E+08
0.322
123849.900000
CO2:1 NO:1.0
O2:1 NCO:1.0
NCO + H2 =] HNCO + H
7.600000E-01
3.0
4000.000000
H2:1 NCO:1.0
HNCO:1.0 H:1
HNCO + H =] NCO + H2
9.879000E+00
2.728
12044.930000
HNCO:1.0 H:1
H2:1 NCO:1.0
NCO + HCO =] HNCO + CO
3.600000E+10
0.0
0.000000
HCO:1 NCO:1.0
HNCO:1.0 CO:1
NCO + NO2 =] CO + 2.0 NO
2.500000E+08
0.0
-706.980000
NO2:1 NCO:1.0
CO:1.0 NO:2.0
NCO + NO2 =] CO2 + N2O
3.000000E+09
0.0
-706.980000
NO2:1 NCO:1.0
CO2:1.0 N2O:1
NCO + N =] N2 + CO
2.000000E+10
0.0
0.000000
N:1 NCO:1.0
N2:1.0 CO:1
2.0 NCO =] N2 + 2.0 CO
1.800000E+10
0.0
0.000000
NCO:2.0
N2:1.0 CO:2.0
NCO + CH4 =] CH3 + HNCO
9.800000E+09
0.0
8119.980000
CH4:1 NCO:1.0
HNCO:1 CH3:1.0
CH3 + HNCO =] NCO + CH4
1.366000E+08
0.144
14283.940000
HNCO:1 CH3:1.0
CH4:1 NCO:1.0
NCO + CH2O =] HNCO + HCO
6.000000E+09
0.0
0.000000
CH2O:1 NCO:1.0
HNCO:1.0 HCO:1
NCO + C2H6 =] C2H5 + HNCO
1.500000E-12
6.89
-2909.890000
C2H6:1 NCO:1.0
HNCO:1 C2H5:1.0
C2H5 + HNCO =] NCO + C2H6
5.031000E-15
7.204
8159.890000
HNCO:1 C2H5:1.0
C2H6:1 NCO:1.0
NCO + C2H2 =] HCCO + HCN
1.400000E+09
0.0
1815.010000
C2H2:1 NCO:1.0
HCN:1 HCCO:1.0
HCCO + HCN =] NCO + C2H2
9.350000E+05
0.51
12493.070000
HCN:1 HCCO:1.0
C2H2:1 NCO:1.0
CH3CN + H =] HCN + CH3
4.000000E+04
2.0
2000.000000
H:1 CH3CN:1.0
CH3:1 HCN:1.0
HCN + CH3 =] CH3CN + H
7.833000E-02
3.16
5718.930000
CH3:1 HCN:1.0
H:1 CH3CN:1.0
CH3CN + O =] NCO + CH3
1.500000E+01
2.64
4979.920000
CH3CN:1.0 O:1
CH3:1 NCO:1.0
CH3 + HOCN =] CH3CN + OH
5.000000E+09
0.0
2000.000000
HOCN:1 CH3:1.0
CH3CN:1.0 OH:1
CH3CN + OH =] CH3 + HOCN
1.636000E+13
-0.844
5306.880000
CH3CN:1.0 OH:1
HOCN:1 CH3:1.0
N2 + CH2 =] HCN + NH
1.000000E+10
0.0
73999.040000
N2:1.0 CH2:1
NH:1 HCN:1.0
N2 + CH =] HCN + N
3.700000E+04
1.42
20722.990000
N2:1.0 CH:1
HCN:1.0 N:1
HCN + N =] N2 + CH
3.572000E+07
0.786
18465.110000
HCN:1.0 N:1
N2:1.0 CH:1
HCCO + NO =] HCN + CO2
1.600000E+10
0.0
0.000000
HCCO:1.0 NO:1
CO2:1 HCN:1.0
C2H + NO =] CN + HCO
2.100000E+10
0.0
0.000000
C2H:1.0 NO:1
CN:1.0 HCO:1
CH3 + NO =] HCN + H2O
1.500000E-04
3.523
3950.050000
CH3:1.0 NO:1
H2O:1 HCN:1.0
HCN + H2O =] CH3 + NO
2.738000E-04
3.657
85995.940000
H2O:1 HCN:1.0
CH3:1.0 NO:1
CH3 + NO =] H2CN + OH
1.500000E-04
3.523
3950.050000
CH3:1.0 NO:1
H2CN:1.0 OH:1
H2CN + OH =] CH3 + NO
4.439000E-04
3.311
-7933.080000
H2CN:1.0 OH:1
CH3:1.0 NO:1
CH2* + NO =] HCN + OH
2.000000E+10
0.0
0.000000
CH2*:1.0 NO:1
HCN:1.0 OH:1
CH2* + NO =] CH2 + NO
1.000000E+11
0.0
0.000000
CH2*:1.0 NO:1
CH2:1.0 NO:1
CH2 + NO =] CH2* + NO
3.843000E+10
0.005
8917.070000
CH2:1.0 NO:1
CH2*:1.0 NO:1
CH2 + NO =] HCN + OH
2.200000E+09
0.0
-378.110000
CH2:1.0 NO:1
HCN:1.0 OH:1
CH + NO =] HCN + O
4.800000E+10
0.0
0.000000
CH:1.0 NO:1
HCN:1.0 O:1
HCN + O =] CH + NO
7.511000E+13
-0.512
72597.990000
HCN:1.0 O:1
CH:1.0 NO:1
CH + NO =] HCO + N
3.400000E+10
0.0
0.000000
CH:1.0 NO:1
HCO:1.0 N:1
CH + NO =] NCO + H
1.900000E+10
0.0
0.000000
CH:1.0 NO:1
H:1 NCO:1.0
C2H2 + NO =] HCO + HCN
6.000000E+04
0.0
0.000000
C2H2:1.0 NO:1
HCN:1 HCO:1.0
HCO + HCN =] C2H2 + NO
3.393000E+02
0.512
33208.890000
HCN:1 HCO:1.0
C2H2:1.0 NO:1
NO + H + M =] HNO + M
2.700000E+09
0.0
-599.900000
H2:2.0 N2:0.0 CO:3.0 O2:1.5 H2O:10.0
H:1 NO:1.0
HNO:1.0
HNO + M =] NO + H + M
1.049000E+14
-0.224
49396.990000
H2:2.0 N2:0.0 CO:3.0 O2:1.5 H2O:10.0
HNO:1.0
H:1 NO:1.0
NO + O + M =] NO2 + M
7.500000E+13
-1.41
0.000000
N2:1.7 O2:1.5 H2O:10.0
O:1 NO:1.0
NO2:1.0
NO2 + M =] NO + O + M
1.514000E+21
-2.076
73626.910000
N2:1.7 O2:1.5 H2O:10.0
NO2:1.0
O:1 NO:1.0
NO + OH + M =] HONO + M
5.100000E+17
-2.51
-68.120000
H2O:5.0
OH:1 NO:1.0
HONO:1.0
HONO + M =] NO + OH + M
2.451000E+28
-4.046
50371.890000
H2O:5.0
HONO:1.0
OH:1 NO:1.0
NH3 + M =] NH2 + H + M
2.200000E+13
0.0
93468.930000
N2:1.0
NH3:1.0
H:1 NH2:1.0
NH2 + H + M =] NH3 + M
7.835000E+07
0.266
-15485.900000
N2:1.0
H:1 NH2:1.0
NH3:1.0
N2O + M =] N2 + O + M
4.000000E+11
0.0
56099.900000
N2:1.7 CO2:3.0 CO:1.5 O2:1.4 H2O:12.0
N2O:1.0
N2:1.0 O:1
N2 + O + M =] N2O + M
6.538000E+02
1.148
15409.890000
N2:1.7 CO2:3.0 CO:1.5 O2:1.4 H2O:12.0
N2:1.0 O:1
N2O:1.0
HNCO + M =] NH + CO + M
1.100000E+13
0.0
85999.040000
N2:1.0
HNCO:1.0
NH:1.0 CO:1
NH + CO + M =] HNCO + M
1.017000E+03
1.427
-2010.990000
N2:1.0
NH:1.0 CO:1
HNCO:1.0
NCO + M =] N + CO + M
3.100000E+13
-0.5
48000.000000
N2:1.0
NCO:1.0
CO:1 N:1.0
N + CO + M =] NCO + M
6.293000E+04
0.778
-7780.110000
N2:1.0
CO:1 N:1.0
NCO:1.0
H2CN + M =] HCN + H + M
3.000000E+11
0.0
22000.000000
N2:1.0
H2CN:1.0
H:1 HCN:1.0
HCN + H + M =] H2CN + M
3.053000E+07
0.211
-3175.910000
N2:1.0
H:1 HCN:1.0
H2CN:1.0