description: |-
  ---------------------------------------------------------------------------
    CTI File converted from Solution Object
  ---------------------------------------------------------------------------

generator: cti2yaml
cantera-version: 3.0.0
date: Sat, 27 Jan 2024 15:25:12 +0100
input-files: [C3H8_23_128_14_QM.cti]

units: {length: cm, quantity: mol, activation-energy: cal/mol}

phases:
- name: gas
  thermo: ideal-gas
  elements: [N, H, O, C]
  species: [N2, H, O2, OH, O, H2, H2O, HO2, H2O2, CO, CO2, CH3, CH4, CH2O,
    C2H4, C2H6, C2H2, CH2CO, CH3OH, C3H6, C3H8, OC3H5OOH, C4H8]
  species_qss: [HCO, T-CH2, S-CH2, CH3O, C2H5, C2H3, CH2CHO, HCCO, CH2OH, 
    C3H4, C3H5, I-C3H7, N-C3H7, C3H6OOH]
  kinetics: custom
  reactions: all
  state:
    T: 300.0
    P: 1.01325e+05

species:
- name: N2
  composition: {N: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.298677, 1.4082404e-03, -3.963222e-06, 5.641515e-09, -2.444854e-12,
      -1020.8999, 3.950372]
    - [2.92664, 1.4879768e-03, -5.68476e-07, 1.0097038e-10, -6.753351e-15,
      -922.7977, 5.980528]
  transport:
    model: gas
    geometry: linear
    diameter: 3.621
    well-depth: 97.53
    polarizability: 1.76
    rotational-relaxation: 4.0
- name: H
  composition: {H: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [2.5, 7.05332819e-13, -1.99591964e-15, 2.30081632e-18, -9.27732332e-22,
      2.54736599e+04, -0.446682853]
    - [2.50000001, -2.30842973e-11, 1.61561948e-14, -4.73515235e-18, 4.98197357e-22,
      2.54736599e+04, -0.446682914]
  transport:
    model: gas
    geometry: atom
    diameter: 2.05
    well-depth: 145.0
- name: O2
  composition: {O: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.78245636, -2.99673416e-03, 9.84730201e-06, -9.68129509e-09, 3.24372837e-12,
      -1063.94356, 3.65767573]
    - [3.28253784, 1.48308754e-03, -7.57966669e-07, 2.09470555e-10, -2.16717794e-14,
      -1088.45772, 5.45323129]
  transport:
    model: gas
    geometry: linear
    diameter: 3.458
    well-depth: 107.4
    polarizability: 1.6
    rotational-relaxation: 3.8
- name: OH
  composition: {H: 1, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [4.12530561, -3.22544939e-03, 6.52764691e-06, -5.79853643e-09, 2.06237379e-12,
      3381.53812, -0.69043296]
    - [2.86472886, 1.05650448e-03, -2.59082758e-07, 3.05218674e-11, -1.33195876e-15,
      3718.85774, 5.70164073]
  transport:
    model: gas
    geometry: linear
    diameter: 2.7500000000000004
    well-depth: 80.0
- name: O
  composition: {O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.1682671, -3.27931884e-03, 6.64306396e-06, -6.12806624e-09, 2.11265971e-12,
      2.91222592e+04, 2.05193346]
    - [2.56942078, -8.59741137e-05, 4.19484589e-08, -1.00177799e-11, 1.22833691e-15,
      2.92175791e+04, 4.78433864]
  transport:
    model: gas
    geometry: atom
    diameter: 2.7500000000000004
    well-depth: 80.0
- name: H2
  composition: {H: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [2.34433112, 7.98052075e-03, -1.9478151e-05, 2.01572094e-08, -7.37611761e-12,
      -917.935173, 0.683010238]
    - [3.3372792, -4.94024731e-05, 4.99456778e-07, -1.79566394e-10, 2.00255376e-14,
      -950.158922, -3.20502331]
  transport:
    model: gas
    geometry: linear
    diameter: 2.9200000000000004
    well-depth: 38.0
    polarizability: 0.7900000000000001
    rotational-relaxation: 280.0
- name: H2O
  composition: {H: 2, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [4.19864056, -2.0364341e-03, 6.52040211e-06, -5.48797062e-09, 1.77197817e-12,
      -3.02937267e+04, -0.849032208]
    - [3.03399249, 2.17691804e-03, -1.64072518e-07, -9.7041987e-11, 1.68200992e-14,
      -3.00042971e+04, 4.9667701]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 2.6050000000000004
    well-depth: 572.4
    dipole: 1.8440005262719967
    rotational-relaxation: 4.0
- name: HO2
  composition: {H: 1, O: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [4.30179801, -4.74912051e-03, 2.11582891e-05, -2.42763894e-08, 9.29225124e-12,
      294.80804, 3.71666245]
    - [4.0172109, 2.23982013e-03, -6.3365815e-07, 1.1424637e-10, -1.07908535e-14,
      111.856713, 3.78510215]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.458
    well-depth: 107.4
    rotational-relaxation: 1.0
- name: H2O2
  composition: {H: 2, O: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [4.27611269, -5.42822417e-04, 1.67335701e-05, -2.15770813e-08, 8.62454363e-12,
      -1.77025821e+04, 3.43505074]
    - [4.16500285, 4.90831694e-03, -1.90139225e-06, 3.71185986e-10, -2.87908305e-14,
      -1.78617877e+04, 2.91615662]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.458
    well-depth: 107.4
    rotational-relaxation: 3.8
- name: CO
  composition: {C: 1, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.57953347, -6.1035368e-04, 1.01681433e-06, 9.07005884e-10, -9.04424499e-13,
      -1.4344086e+04, 3.50840928]
    - [2.71518561, 2.06252743e-03, -9.98825771e-07, 2.30053008e-10, -2.03647716e-14,
      -1.41518724e+04, 7.81868772]
  transport:
    model: gas
    geometry: linear
    diameter: 3.65
    well-depth: 98.1
    polarizability: 1.9500000000000002
    rotational-relaxation: 1.8
- name: CO2
  composition: {C: 1, O: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [2.35677352, 8.98459677e-03, -7.12356269e-06, 2.45919022e-09, -1.43699548e-13,
      -4.83719697e+04, 9.90105222]
    - [3.85746029, 4.41437026e-03, -2.21481404e-06, 5.23490188e-10, -4.72084164e-14,
      -4.8759166e+04, 2.27163806]
  transport:
    model: gas
    geometry: linear
    diameter: 3.763
    well-depth: 244.0
    polarizability: 2.6500000000000004
    rotational-relaxation: 2.1
- name: HCO
  composition: {C: 1, H: 1, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [4.22118584, -3.24392532e-03, 1.37799446e-05, -1.33144093e-08, 4.33768865e-12,
      3839.56496, 3.39437243]
    - [2.77217438, 4.95695526e-03, -2.48445613e-06, 5.89161778e-10, -5.33508711e-14,
      4011.91815, 9.79834492]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.59
    well-depth: 498.0
- name: CH3
  composition: {C: 1, H: 3}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.6735904, 2.01095175e-03, 5.73021856e-06, -6.87117425e-09, 2.54385734e-12,
      1.64449988e+04, 1.60456433]
    - [2.28571772, 7.23990037e-03, -2.98714348e-06, 5.95684644e-10, -4.67154394e-14,
      1.67755843e+04, 8.48007179]
  transport:
    model: gas
    geometry: linear
    diameter: 3.8
    well-depth: 144.0
- name: CH4
  composition: {C: 1, H: 4}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [5.14987613, -0.0136709788, 4.91800599e-05, -4.84743026e-08, 1.66693956e-11,
      -1.02466476e+04, -4.64130376]
    - [0.074851495, 0.0133909467, -5.73285809e-06, 1.22292535e-09, -1.0181523e-13,
      -9468.34459, 18.437318]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.7460000000000004
    well-depth: 141.4
    polarizability: 2.6
    rotational-relaxation: 13.0
- name: CH2O
  composition: {C: 1, H: 2, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [4.79372315, -9.90833369e-03, 3.73220008e-05, -3.79285261e-08, 1.31772652e-11,
      -1.43089567e+04, 0.6028129]
    - [1.76069008, 9.20000082e-03, -4.42258813e-06, 1.00641212e-09, -8.8385564e-14,
      -1.39958323e+04, 13.656323]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.59
    well-depth: 498.0
    rotational-relaxation: 2.0
- name: T-CH2
  composition: {C: 1, H: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.76267867, 9.68872143e-04, 2.79489841e-06, -3.85091153e-09, 1.68741719e-12,
      4.60040401e+04, 1.56253185]
    - [2.87410113, 3.65639292e-03, -1.40894597e-06, 2.60179549e-10, -1.87727567e-14,
      4.6263604e+04, 6.17119324]
  transport:
    model: gas
    geometry: linear
    diameter: 3.8
    well-depth: 144.0
- name: S-CH2
  composition: {C: 1, H: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [4.19860411, -2.36661419e-03, 8.2329622e-06, -6.68815981e-09, 1.94314737e-12,
      5.04968163e+04, -0.769118967]
    - [2.29203842, 4.65588637e-03, -2.01191947e-06, 4.17906e-10, -3.39716365e-14,
      5.09259997e+04, 8.62650169]
  transport:
    model: gas
    geometry: linear
    diameter: 3.8
    well-depth: 144.0
- name: C2H4
  composition: {C: 2, H: 4}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.95920148, -7.57052247e-03, 5.70990292e-05, -6.91588753e-08, 2.69884373e-11,
      5089.77593, 4.09733096]
    - [2.03611116, 0.0146454151, -6.71077915e-06, 1.47222923e-09, -1.25706061e-13,
      4939.88614, 10.3053693]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.496
    well-depth: 238.4
    rotational-relaxation: 1.5
- name: CH3O
  composition: {C: 1, H: 3, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.71180502, -2.80463306e-03, 3.76550971e-05, -4.73072089e-08, 1.8658842e-11,
      1307.72484, 6.57240864]
    - [4.75779238, 7.44142474e-03, -2.69705176e-06, 4.38090504e-10, -2.63537098e-14,
      390.139164, -1.96680028]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.6900000000000004
    well-depth: 417.0
    dipole: 1.7000004851748343
    rotational-relaxation: 2.0
- name: C2H5
  composition: {C: 2, H: 5}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [4.30646568, -4.18658892e-03, 4.97142807e-05, -5.99126606e-08, 2.30509004e-11,
      1.28416265e+04, 4.70720924]
    - [1.95465642, 0.0173972722, -7.98206668e-06, 1.75217689e-09, -1.49641576e-13,
      1.285752e+04, 13.4624343]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.35
    well-depth: 247.49999999999997
    rotational-relaxation: 1.5
- name: C2H6
  composition: {C: 2, H: 6}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [4.29142492, -5.5015427e-03, 5.99438288e-05, -7.08466285e-08, 2.68685771e-11,
      -1.15222055e+04, 2.66682316]
    - [1.0718815, 0.0216852677, -1.00256067e-05, 2.21412001e-09, -1.9000289e-13,
      -1.14263932e+04, 15.1156107]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.35
    well-depth: 247.49999999999997
    rotational-relaxation: 1.5
- name: C2H2
  composition: {C: 2, H: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [0.808681094, 0.0233615629, -3.55171815e-05, 2.80152437e-08, -8.50072974e-12,
      2.64289807e+04, 13.9397051]
    - [4.14756964, 5.96166664e-03, -2.37294852e-06, 4.67412171e-10, -3.61235213e-14,
      2.59359992e+04, -1.23028121]
  transport:
    model: gas
    geometry: linear
    diameter: 3.7210000000000005
    well-depth: 265.3
    rotational-relaxation: 2.5
- name: C2H3
  composition: {C: 2, H: 3}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.21246645, 1.51479162e-03, 2.59209412e-05, -3.57657847e-08, 1.47150873e-11,
      3.48598468e+04, 8.51054025]
    - [3.016724, 0.0103302292, -4.68082349e-06, 1.01763288e-09, -8.62607041e-14,
      3.46128739e+04, 7.78732378]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.7210000000000005
    well-depth: 265.3
    rotational-relaxation: 1.0
- name: CH2CHO
  composition: {C: 2, H: 3, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [1.0134001, 0.022681467, -1.5733944e-05, 4.0491503e-09, 2.9599012e-13,
      380.42853, 19.356552]
    - [5.1662006, 0.010847826, -4.4658368e-06, 8.0628548e-10, -4.8410193e-14,
      -731.99347, -1.9633361]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.97
    well-depth: 436.0
    rotational-relaxation: 2.0
- name: HCCO
  composition: {C: 2, H: 1, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [2.2517214, 0.017655021, -2.3729101e-05, 1.7275759e-08, -5.0664811e-12,
      2.0059449e+04, 12.490417]
    - [5.6282058, 4.0853401e-03, -1.5934547e-06, 2.8626052e-10, -1.9407832e-14,
      1.9327215e+04, -3.9302595]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 2.5
    well-depth: 150.0
    rotational-relaxation: 1.0
- name: CH2CO
  composition: {C: 2, H: 2, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [2.1358363, 0.0181188721, -1.73947474e-05, 9.34397568e-09, -2.01457615e-12,
      -7042.91804, 12.215648]
    - [4.51129732, 9.00359745e-03, -4.16939635e-06, 9.23345882e-10, -7.94838201e-14,
      -7551.05311, 0.632247205]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.97
    well-depth: 436.0
    rotational-relaxation: 2.0
- name: CH2OH
  composition: {C: 1, H: 3, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [4.47832317, -1.35069687e-03, 2.78483707e-05, -3.64867397e-08, 1.47906775e-11,
      -3524.76728, 3.30911984]
    - [5.09312037, 5.9475855e-03, -2.06496524e-06, 3.23006703e-10, -1.88125052e-14,
      -4058.13228, -1.84690613]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.6900000000000004
    well-depth: 417.0
    dipole: 1.7000004851748343
    rotational-relaxation: 2.0
- name: CH3OH
  composition: {C: 1, H: 4, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [5.71539582, -0.0152309129, 6.52441155e-05, -7.10806889e-08, 2.61352698e-11,
      -2.56427656e+04, -1.50409823]
    - [1.78970791, 0.0140938292, -6.36500835e-06, 1.38171085e-09, -1.1706022e-13,
      -2.53748747e+04, 14.5023623]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.6260000000000003
    well-depth: 481.8
    rotational-relaxation: 1.0
- name: C3H4
  composition: {C: 3, H: 4}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [2.6130445, 0.012122575, 1.853988e-05, -3.4525149e-08, 1.5335079e-11,
      2.1541567e+04, 10.226139]
    - [6.3168722, 0.011133728, -3.9629378e-06, 6.3564238e-10, -3.787554e-14,
      2.0117495e+04, -10.995766]
  transport:
    model: gas
    geometry: linear
    diameter: 4.29
    well-depth: 324.8
    rotational-relaxation: 1.0
- name: C3H5
  composition: {C: 3, H: 5}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [1.3631835, 0.019813821, 1.249706e-05, -3.3355555e-08, 1.5846571e-11,
      1.9245629e+04, 17.173214]
    - [6.5007877, 0.014324731, -5.6781632e-06, 1.1080801e-09, -9.0363887e-14,
      1.7482449e+04, -11.24305]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.22
    well-depth: 316.0
    rotational-relaxation: 1.0
- name: C3H6
  composition: {C: 3, H: 6}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [1.493307, 0.02092518, 4.486794e-06, -1.668912e-08, 7.158146e-12,
      1074.826, 16.14534]
    - [6.732257, 0.01490834, -4.949899e-06, 7.212022e-10, -3.766204e-14,
      -923.5703, -13.31335]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.14
    well-depth: 307.8
    rotational-relaxation: 1.0
- name: C3H8
  composition: {C: 3, H: 8}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [0.92851093, 0.026460566, 6.0332446e-06, -2.1914953e-08, 9.4961544e-12,
      -1.4057907e+04, 19.225538]
    - [7.5244152, 0.018898282, -6.2921041e-06, 9.2161457e-10, -4.8684478e-14,
      -1.6564394e+04, -17.838375]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.81
    well-depth: 303.4
    rotational-relaxation: 1.0
- name: I-C3H7
  composition: {C: 3, H: 7}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [1.4449199, 0.020999112, 7.7036222e-06, -1.8476253e-08, 7.1282962e-12,
      9422.3724, 20.116317]
    - [6.5192741, 0.017220104, -5.7364217e-06, 8.4130732e-10, -4.4565913e-14,
      7322.7193, -9.0830215]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.81
    well-depth: 303.4
    rotational-relaxation: 1.0
- name: N-C3H7
  composition: {C: 3, H: 7}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [1.0491173, 0.026008973, 2.3542516e-06, -1.9595132e-08, 9.3720207e-12,
      1.0312346e+04, 21.136034]
    - [7.7097479, 0.016031485, -5.2720238e-06, 7.5888352e-10, -3.8862719e-14,
      7976.2236, -15.515297]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.81
    well-depth: 303.4
    rotational-relaxation: 1.0
- name: C3H6OOH
  composition: {C: 3, H: 7, O: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [1.91005011, 0.0411666833, -2.51630217e-05, 7.11856873e-09, -6.98838732e-13,
      -1793.05093, 23.4514457]
    - [14.613998, 0.0143723015, -4.88635144e-06, 7.5651962e-10, -4.38364992e-14,
      -6461.01457, -45.7478245]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.820000000000001
    well-depth: 487.9
    rotational-relaxation: 1.0
- name: OC3H5OOH
  composition: {C: 3, H: 6, O: 3}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [0.768933034, 0.054690588, -4.65072405e-05, 2.03159585e-08, -3.58398999e-12,
      -3.63238861e+04, 26.8291637]
    - [17.0285271, 0.0130716784, -4.59310856e-06, 7.26135156e-10, -4.26658337e-14,
      -4.16334217e+04, -59.2513577]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.820000000000001
    well-depth: 487.9
    rotational-relaxation: 1.0
- name: C4H8
  composition: {C: 4, H: 8}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [1.181138, 0.03085338, 5.086524e-06, -2.465488e-08, 1.1110192e-11,
      -1790.4, 21.06247]
    - [2.053584, 0.0343505, -1.5883196e-05, 3.308966e-09, -2.536104e-13,
      -2139.723, 15.543201]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.65
    well-depth: 355.0
    rotational-relaxation: 1.0

reactions:
- equation: 'C3H8 + 5.0 O2 => 3.0 CO2 + 4.0 H2O '  # Reaction 1
  rate-constant: {A: 0.0, b: 0.0, Ea: 0.0}
  
reactions_skeletal:
- equation: H + O2 <=> O + OH  # Reaction 2
  rate-constant: {A: 3.52e+16, b: -0.7, Ea: 1.706979e+04}
- equation: H2 + O <=> H + OH  # Reaction 3
  rate-constant: {A: 5.06e+04, b: 2.67, Ea: 6290.63}
- equation: H2 + OH <=> H + H2O  # Reaction 4
  rate-constant: {A: 1.17e+09, b: 1.3, Ea: 3635.28}
- equation: H2O + O <=> 2 OH  # Reaction 5
  rate-constant: {A: 7.0e+05, b: 2.33, Ea: 1.454828e+04}
- equation: 2 H + M <=> H2 + M  # Reaction 6
  type: three-body
  rate-constant: {A: 1.3e+18, b: -1.0, Ea: 0.0}
  efficiencies: {CO: 1.9, CO2: 3.8, H2: 2.5, H2O: 12.0}
- equation: H + OH + M <=> H2O + M  # Reaction 7
  type: three-body
  rate-constant: {A: 4.0e+22, b: -2.0, Ea: 0.0}
  efficiencies: {CO: 1.9, CO2: 3.8, H2: 2.5, H2O: 12.0}
- equation: H + O + M <=> OH + M  # Reaction 8
  type: three-body
  rate-constant: {A: 4.71e+18, b: -1.0, Ea: 0.0}
  efficiencies: {CO: 1.9, CO2: 3.8, H2: 2.5, H2O: 12.0}
- equation: H + O2 (+M) <=> HO2 (+M)  # Reaction 9
  type: falloff
  low-P-rate-constant: {A: 5.75e+19, b: -1.4, Ea: 0.0}
  high-P-rate-constant: {A: 4.65e+12, b: 0.44, Ea: 0.0}
  Troe: {A: 0.5, T3: 0.0, T1: 1.0000000000000002e+30, T2: 0.0}
  efficiencies: {CO: 1.2, CO2: 2.4, H2: 2.5, H2O: 16.0}
- equation: H + HO2 <=> 2 OH  # Reaction 10
  rate-constant: {A: 7.08e+13, b: 0.0, Ea: 294.93}
- equation: H + HO2 <=> H2 + O2  # Reaction 11
  rate-constant: {A: 1.66e+13, b: 0.0, Ea: 822.9}
- equation: H + HO2 <=> H2O + O  # Reaction 12
  rate-constant: {A: 3.1e+13, b: 0.0, Ea: 1720.84}
- equation: HO2 + O <=> O2 + OH  # Reaction 13
  rate-constant: {A: 2.0e+13, b: 0.0, Ea: 0.0}
- equation: HO2 + OH <=> H2O + O2  # Reaction 14
  rate-constant: {A: 7.0e+12, b: 0.0, Ea: -1094.65}
  duplicate: true
- equation: HO2 + OH <=> H2O + O2  # Reaction 15
  rate-constant: {A: 4.5e+14, b: 0.0, Ea: 1.092973e+04}
  duplicate: true
- equation: 2 OH (+M) <=> H2O2 (+M)  # Reaction 16
  type: falloff
  low-P-rate-constant: {A: 2.76e+25, b: -3.2, Ea: 0.0}
  high-P-rate-constant: {A: 9.55e+13, b: -0.27, Ea: 0.0}
  Troe: {A: 0.57, T3: 1.0000000000000002e+30, T1: 0.0, T2: 0.0}
  efficiencies: {CO: 1.5, CO2: 2.0, H2: 2.5, H2O: 6.0, H2O2: 6.0}
- equation: 2 HO2 <=> H2O2 + O2  # Reaction 17
  rate-constant: {A: 1.03e+14, b: 0.0, Ea: 1.104207e+04}
  duplicate: true
- equation: 2 HO2 <=> H2O2 + O2  # Reaction 18
  rate-constant: {A: 1.94e+11, b: 0.0, Ea: -1408.94}
  duplicate: true
- equation: H + H2O2 <=> H2 + HO2  # Reaction 19
  rate-constant: {A: 2.3e+13, b: 0.0, Ea: 7950.05}
- equation: H + H2O2 <=> H2O + OH  # Reaction 20
  rate-constant: {A: 1.0e+13, b: 0.0, Ea: 3585.09}
- equation: H2O2 + OH <=> H2O + HO2  # Reaction 21
  rate-constant: {A: 1.74e+12, b: 0.0, Ea: 1434.03}
  duplicate: true
- equation: H2O2 + OH <=> H2O + HO2  # Reaction 22
  rate-constant: {A: 7.59e+13, b: 0.0, Ea: 7272.94}
  duplicate: true
- equation: CO + O (+M) <=> CO2 (+M)  # Reaction 23
  type: falloff
  low-P-rate-constant: {A: 1.55e+24, b: -2.79, Ea: 4190.97}
  high-P-rate-constant: {A: 1.8e+11, b: 0.0, Ea: 2384.08}
  Troe: {A: 1.0, T3: 1.0, T1: 1.0e+07, T2: 1.0e+07}
  efficiencies: {CO: 2.0, CO2: 4.0, H2: 2.5, H2O: 12.0}
- equation: CO + OH <=> CO2 + H  # Reaction 24
  rate-constant: {A: 4.4e+06, b: 1.5, Ea: -740.92}
- equation: CO + HO2 <=> CO2 + OH  # Reaction 25
  rate-constant: {A: 2.0e+13, b: 0.0, Ea: 2.294455e+04}
- equation: HCO + M <=> CO + H + M  # Reaction 26
  type: three-body
  rate-constant: {A: 1.86e+17, b: -1.0, Ea: 1.700048e+04}
  efficiencies: {CO: 2.5, CO2: 2.5, H2: 1.9, H2O: 12.0}
- equation: HCO + OH <=> CO + H2O  # Reaction 27
  rate-constant: {A: 3.0e+13, b: 0.0, Ea: 0.0}
- equation: HCO + O2 <=> CO + HO2  # Reaction 28
  rate-constant: {A: 7.58e+12, b: 0.0, Ea: 409.89}
- equation: CH2O + H <=> H2 + HCO  # Reaction 29
  rate-constant: {A: 5.74e+07, b: 1.9, Ea: 2748.57}
- equation: CH2O + O <=> HCO + OH  # Reaction 30
  rate-constant: {A: 3.5e+13, b: 0.0, Ea: 3513.38}
- equation: CH2O + OH <=> H2O + HCO  # Reaction 31
  rate-constant: {A: 3.9e+10, b: 0.89, Ea: 406.31}
- equation: CH2O + HO2 <=> H2O2 + HCO  # Reaction 32
  rate-constant: {A: 4.11e+04, b: 2.5, Ea: 1.021033e+04}
- equation: CH4 + H <=> CH3 + H2  # Reaction 33
  rate-constant: {A: 1.3e+04, b: 3.0, Ea: 8037.76}
- equation: CH4 + OH <=> CH3 + H2O  # Reaction 34
  rate-constant: {A: 1.6e+07, b: 1.83, Ea: 2782.03}
- equation: CH4 + O <=> CH3 + OH  # Reaction 35
  rate-constant: {A: 1.9e+09, b: 1.44, Ea: 8675.91}
- equation: CH4 + O2 <=> CH3 + HO2  # Reaction 36
  rate-constant: {A: 3.98e+13, b: 0.0, Ea: 5.689054e+04}
- equation: CH3 + OH <=> H2O + S-CH2  # Reaction 37
  rate-constant: {A: 4.0e+13, b: 0.0, Ea: 2502.39}
- equation: CH3 + O <=> CH2O + H  # Reaction 38
  rate-constant: {A: 8.43e+13, b: 0.0, Ea: 0.0}
- equation: CH3 + T-CH2 <=> C2H4 + H  # Reaction 39
  rate-constant: {A: 4.22e+13, b: 0.0, Ea: 0.0}
- equation: CH3 + HO2 <=> CH3O + OH  # Reaction 40
  rate-constant: {A: 5.0e+12, b: 0.0, Ea: 0.0}
- equation: CH3 + O2 <=> CH2O + OH  # Reaction 41
  rate-constant: {A: 3.3e+11, b: 0.0, Ea: 8941.2}
- equation: 2 CH3 <=> C2H5 + H  # Reaction 42
  rate-constant: {A: 3.16e+13, b: 0.0, Ea: 1.469885e+04}
- equation: CH3 + H (+M) <=> CH4 (+M)  # Reaction 43
  type: falloff
  low-P-rate-constant: {A: 1.59e+33, b: -4.761, Ea: 2431.88}
  high-P-rate-constant: {A: 1.351e+14, b: 0.091, Ea: 87.72}
  Troe: {A: 0.834, T3: 36.8, T1: 778.0, T2: 2464.0}
  efficiencies: {CH4: 4.0, CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 16.0}
- equation: 2 CH3 (+M) <=> C2H6 (+M)  # Reaction 44
  type: falloff
  low-P-rate-constant: {A: 1.27e+41, b: -7.0, Ea: 2762.91}
  high-P-rate-constant: {A: 1.81e+13, b: 0.0, Ea: 0.0}
  Troe: {A: 0.62, T3: 73.0, T1: 1200.0, T2: 0.0}
  efficiencies: {C2H6: 3.0, CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: O2 + S-CH2 <=> CO + H + OH  # Reaction 45
  rate-constant: {A: 3.13e+13, b: 0.0, Ea: 0.0}
- equation: S-CH2 + M <=> T-CH2 + M  # Reaction 46
  type: three-body
  rate-constant: {A: 6.0e+12, b: 0.0, Ea: 0.0}
  efficiencies: {CO: 1.8, CO2: 3.6, H2: 2.4, H2O: 15.4}
- equation: OH + T-CH2 <=> CH2O + H  # Reaction 47
  rate-constant: {A: 2.5e+13, b: 0.0, Ea: 0.0}
- equation: O + T-CH2 <=> CO + 2 H  # Reaction 48
  rate-constant: {A: 8.0e+13, b: 0.0, Ea: 0.0}
- equation: O2 + T-CH2 <=> CO2 + H2  # Reaction 49
  rate-constant: {A: 2.63e+12, b: 0.0, Ea: 1491.4}
- equation: O2 + T-CH2 <=> CO + H + OH  # Reaction 50
  rate-constant: {A: 6.58e+12, b: 0.0, Ea: 1491.4}
- equation: CH3O + O2 <=> CH2O + HO2  # Reaction 51
  rate-constant: {A: 4.28e-13, b: 7.6, Ea: -3537.28}
- equation: CH3O + M <=> CH2O + H + M  # Reaction 52
  type: three-body
  rate-constant: {A: 7.78e+13, b: 0.0, Ea: 1.351338e+04}
  efficiencies: {CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: C2H6 + H <=> C2H5 + H2  # Reaction 53
  rate-constant: {A: 540.0, b: 3.5, Ea: 5210.33}
- equation: C2H6 + O <=> C2H5 + OH  # Reaction 54
  rate-constant: {A: 1.4, b: 4.3, Ea: 2772.47}
- equation: C2H6 + OH <=> C2H5 + H2O  # Reaction 55
  rate-constant: {A: 2.2e+07, b: 1.9, Ea: 1123.33}
- equation: C2H6 + CH3 <=> C2H5 + CH4  # Reaction 56
  rate-constant: {A: 0.55, b: 4.0, Ea: 8293.5}
- equation: C2H6 (+M) <=> C2H5 + H (+M)  # Reaction 57
  type: falloff
  low-P-rate-constant: {A: 4.9e+42, b: -6.43, Ea: 1.072001e+05}
  high-P-rate-constant: {A: 8.85e+20, b: -1.23, Ea: 1.022228e+05}
  Troe: {A: 0.84, T3: 125.0, T1: 2219.0, T2: 6882.0}
  efficiencies: {C2H6: 3.0, CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: C2H5 + O2 <=> C2H4 + HO2  # Reaction 58
  rate-constant: {A: 7.5e+14, b: -1.0, Ea: 4799.95}
- equation: C2H5 (+M) <=> C2H4 + H (+M)  # Reaction 59
  type: falloff
  low-P-rate-constant: {A: 3.99e+33, b: -4.99, Ea: 4.0e+04}
  high-P-rate-constant: {A: 1.11e+10, b: 1.037, Ea: 3.676864e+04}
  Troe: {A: 0.168, T3: 1200.0, T1: 0.0, T2: 0.0}
  efficiencies: {CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: C2H4 + H <=> C2H3 + H2  # Reaction 60
  rate-constant: {A: 4.49e+07, b: 2.12, Ea: 1.336042e+04}
- equation: C2H4 + OH <=> C2H3 + H2O  # Reaction 61
  rate-constant: {A: 5.53e+05, b: 2.31, Ea: 2963.67}
- equation: C2H4 + O <=> CH3 + HCO  # Reaction 62
  rate-constant: {A: 2.25e+06, b: 2.08, Ea: 0.0}
- equation: C2H4 + O <=> CH2CHO + H  # Reaction 63
  rate-constant: {A: 1.21e+06, b: 2.08, Ea: 0.0}
- equation: C2H4 + M <=> C2H3 + H + M  # Reaction 64
  type: three-body
  rate-constant: {A: 2.6e+17, b: 0.0, Ea: 9.656812e+04}
  efficiencies: {CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: C2H4 + M <=> C2H2 + H2 + M  # Reaction 65
  type: three-body
  rate-constant: {A: 3.5e+16, b: 0.0, Ea: 7.153203e+04}
  efficiencies: {CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: C2H3 + H <=> C2H2 + H2  # Reaction 66
  rate-constant: {A: 4.0e+13, b: 0.0, Ea: 0.0}
- equation: C2H3 (+M) <=> C2H2 + H (+M)  # Reaction 67
  type: falloff
  low-P-rate-constant: {A: 1.51e+14, b: 0.1, Ea: 3.269001e+04}
  high-P-rate-constant: {A: 6.38e+09, b: 1.0, Ea: 3.762667e+04}
  Troe: {A: 0.3, T3: 1.0000000000000002e+30, T1: 0.0, T2: 0.0}
  efficiencies: {CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: C2H3 + O2 <=> CH2O + HCO  # Reaction 68
  rate-constant: {A: 1.7e+29, b: -5.312, Ea: 6503.11}
- equation: C2H3 + O2 <=> CH2CHO + O  # Reaction 69
  rate-constant: {A: 7.0e+14, b: -0.611, Ea: 5262.43}
- equation: C2H3 + O2 <=> C2H2 + HO2  # Reaction 70
  rate-constant: {A: 5.19e+15, b: -1.26, Ea: 3312.62}
- equation: C2H2 + O <=> H + HCCO  # Reaction 71
  rate-constant: {A: 4.0e+14, b: 0.0, Ea: 1.065966e+04}
- equation: C2H2 + O <=> CO + T-CH2  # Reaction 72
  rate-constant: {A: 1.6e+14, b: 0.0, Ea: 9894.84}
- equation: C2H2 + O2 <=> CH2O + CO  # Reaction 73
  rate-constant: {A: 4.6e+15, b: -0.54, Ea: 4.493308e+04}
- equation: C2H2 + OH <=> CH2CO + H  # Reaction 74
  rate-constant: {A: 1.9e+07, b: 1.7, Ea: 999.04}
- equation: CH2CO + H <=> CH3 + CO  # Reaction 75
  rate-constant: {A: 1.5e+09, b: 1.43, Ea: 2688.81}
- equation: CH2CO + O <=> CO2 + T-CH2  # Reaction 76
  rate-constant: {A: 2.0e+13, b: 0.0, Ea: 2294.46}
- equation: CH2CO + O <=> HCCO + OH  # Reaction 77
  rate-constant: {A: 1.0e+13, b: 0.0, Ea: 2000.48}
- equation: H + HCCO <=> CO + S-CH2  # Reaction 78
  rate-constant: {A: 1.5e+14, b: 0.0, Ea: 0.0}
- equation: HCCO + O <=> 2 CO + H  # Reaction 79
  rate-constant: {A: 9.64e+13, b: 0.0, Ea: 0.0}
- equation: HCCO + O2 <=> 2 CO + OH  # Reaction 80
  rate-constant: {A: 2.88e+07, b: 1.7, Ea: 1001.43}
- equation: HCCO + O2 <=> CO + CO2 + H  # Reaction 81
  rate-constant: {A: 1.4e+07, b: 1.7, Ea: 1001.43}
- equation: CH2OH + H <=> CH3 + OH  # Reaction 82
  rate-constant: {A: 2.5e+17, b: -0.93, Ea: 5126.91}
- equation: CH2OH + OH <=> CH2O + H2O  # Reaction 83
  rate-constant: {A: 2.4e+13, b: 0.0, Ea: 0.0}
- equation: CH2OH + O2 <=> CH2O + HO2  # Reaction 84
  rate-constant: {A: 5.0e+12, b: 0.0, Ea: 0.0}
- equation: CH2OH + M <=> CH2O + H + M  # Reaction 85
  type: three-body
  rate-constant: {A: 5.0e+13, b: 0.0, Ea: 2.51195e+04}
  efficiencies: {CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: CH3O + M <=> CH2OH + M  # Reaction 86
  type: three-body
  rate-constant: {A: 1.0e+14, b: 0.0, Ea: 1.912046e+04}
  efficiencies: {CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: CH2CO + OH <=> CH2OH + CO  # Reaction 87
  rate-constant: {A: 1.02e+13, b: 0.0, Ea: 0.0}
- equation: CH3OH + OH <=> CH2OH + H2O  # Reaction 88
  rate-constant: {A: 1.44e+06, b: 2.0, Ea: -838.91}
- equation: CH3OH + OH <=> CH3O + H2O  # Reaction 89
  rate-constant: {A: 4.4e+06, b: 2.0, Ea: 1505.74}
- equation: CH3OH + H <=> CH2OH + H2  # Reaction 90
  rate-constant: {A: 1354.0, b: 3.2, Ea: 3490.68}
- equation: CH3OH + O <=> CH2OH + OH  # Reaction 91
  rate-constant: {A: 3.88e+05, b: 2.5, Ea: 3080.78}
- equation: CH3OH (+M) <=> CH3 + OH (+M)  # Reaction 92
  type: falloff
  low-P-rate-constant: {A: 2.95e+44, b: -7.35, Ea: 9.546009e+04}
  high-P-rate-constant: {A: 1.9e+16, b: 0.0, Ea: 9.172992e+04}
  Troe: {A: 0.414, T3: 280.0, T1: 5500.0, T2: 0.0}
  efficiencies: {CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: CH2CHO <=> CH2CO + H  # Reaction 93
  rate-constant: {A: 1.047e+37, b: -7.189, Ea: 4.434034e+04}
- equation: CH2CHO + O2 <=> CH2O + CO + OH  # Reaction 94
  rate-constant: {A: 3.0e+10, b: 0.0, Ea: 0.0}
- equation: CH2CHO + CH3 <=> C2H5 + CO + H  # Reaction 95
  rate-constant: {A: 4.9e+14, b: -0.5, Ea: 0.0}
- equation: CH2CHO + HO2 <=> CH2O + HCO + OH  # Reaction 96
  rate-constant: {A: 7.0e+12, b: 0.0, Ea: 0.0}
- equation: C3H4 + O <=> C2H4 + CO  # Reaction 97
  rate-constant: {A: 2.0e+07, b: 1.8, Ea: 1000.0}
- equation: C2H2 + CH3 <=> C3H4 + H  # Reaction 98
  rate-constant: {A: 2.56e+09, b: 1.1, Ea: 1.364388e+04}
- equation: C3H4 + H (+M) <=> C3H5 (+M)  # Reaction 99
  type: falloff
  low-P-rate-constant: {A: 3.0e+24, b: -2.0, Ea: 0.0}
  high-P-rate-constant: {A: 4.0e+13, b: 0.0, Ea: 0.0}
  Troe: {A: 0.8, T3: 1.0000000000000002e+30, T1: 0.0, T2: 0.0}
- equation: C3H4 + O2 <=> CH3 + CO + HCO  # Reaction 100
  rate-constant: {A: 4.0e+14, b: 0.0, Ea: 4.1826e+04}
- equation: C3H6 + OH <=> C3H5 + H2O  # Reaction 101
  rate-constant: {A: 3.1e+06, b: 2.0, Ea: -298.28}
- equation: C3H6 + O <=> CH2CO + CH3 + H  # Reaction 102
  rate-constant: {A: 1.2e+08, b: 1.65, Ea: 327.44}
- equation: C3H6 + H <=> C3H5 + H2  # Reaction 103
  rate-constant: {A: 1.7e+05, b: 2.5, Ea: 2492.83}
- equation: C3H5 + H (+M) <=> C3H6 (+M)  # Reaction 104
  type: falloff
  low-P-rate-constant: {A: 1.33e+60, b: -12.0, Ea: 5967.97}
  high-P-rate-constant: {A: 2.0e+14, b: 0.0, Ea: 0.0}
  Troe: {A: 0.02, T3: 1097.0, T1: 1097.0, T2: 6860.0}
  efficiencies: {CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: C3H5 + HO2 <=> C3H6 + O2  # Reaction 105
  rate-constant: {A: 2.66e+12, b: 0.0, Ea: 0.0}
- equation: C3H5 + HO2 <=> C2H3 + CH2O + OH  # Reaction 106
  rate-constant: {A: 3.0e+12, b: 0.0, Ea: 0.0}
- equation: C2H3 + CH3 (+M) <=> C3H6 (+M)  # Reaction 107
  type: falloff
  low-P-rate-constant: {A: 4.27e+58, b: -11.94, Ea: 9771.03}
  high-P-rate-constant: {A: 2.5e+13, b: 0.0, Ea: 0.0}
  Troe: {A: 0.175, T3: 1341.0, T1: 6.0e+04, T2: 1.014e+04}
  efficiencies: {CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: C3H6 + H <=> C2H4 + CH3  # Reaction 108
  rate-constant: {A: 1.6e+22, b: -2.39, Ea: 1.118547e+04}
- equation: C3H8 (+M) <=> C2H5 + CH3 (+M)  # Reaction 109
  type: falloff
  low-P-rate-constant: {A: 7.83e+18, b: 0.0, Ea: 6.497992e+04}
  high-P-rate-constant: {A: 1.1e+17, b: 0.0, Ea: 8.439293e+04}
  Troe: {A: 0.76, T3: 1900.0, T1: 38.0, T2: 0.0}
- equation: C3H8 + O2 <=> HO2 + I-C3H7  # Reaction 110
  rate-constant: {A: 4.0e+13, b: 0.0, Ea: 4.75e+04}
- equation: C3H8 + O2 <=> HO2 + N-C3H7  # Reaction 111
  rate-constant: {A: 4.0e+13, b: 0.0, Ea: 5.093212e+04}
- equation: C3H8 + H <=> H2 + I-C3H7  # Reaction 112
  rate-constant: {A: 1.3e+06, b: 2.4, Ea: 4471.08}
- equation: C3H8 + H <=> H2 + N-C3H7  # Reaction 113
  rate-constant: {A: 1.33e+06, b: 2.54, Ea: 6761.47}
- equation: C3H8 + O <=> I-C3H7 + OH  # Reaction 114
  rate-constant: {A: 4.76e+04, b: 2.71, Ea: 2107.31}
- equation: C3H8 + O <=> N-C3H7 + OH  # Reaction 115
  rate-constant: {A: 1.9e+05, b: 2.68, Ea: 3718.45}
- equation: C3H8 + OH <=> H2O + N-C3H7  # Reaction 116
  rate-constant: {A: 1.0e+10, b: 1.0, Ea: 1599.9}
- equation: C3H8 + HO2 <=> H2O2 + I-C3H7  # Reaction 117
  rate-constant: {A: 9640.0, b: 2.6, Ea: 1.39173e+04}
- equation: C3H8 + HO2 <=> H2O2 + N-C3H7  # Reaction 118
  rate-constant: {A: 4.76e+04, b: 2.55, Ea: 1.64914e+04}
- equation: C3H6 + H (+M) <=> I-C3H7 (+M)  # Reaction 119
  type: falloff
  low-P-rate-constant: {A: 8.7e+42, b: -7.5, Ea: 4732.07}
  high-P-rate-constant: {A: 1.33e+13, b: 0.0, Ea: 1560.71}
  Troe: {A: 1.0, T3: 1000.0, T1: 645.4, T2: 6844.0}
  efficiencies: {CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: I-C3H7 + O2 <=> C3H6 + HO2  # Reaction 120
  rate-constant: {A: 1.3e+11, b: 0.0, Ea: 0.0}
- equation: N-C3H7 (+M) <=> C2H4 + CH3 (+M)  # Reaction 121
  type: falloff
  low-P-rate-constant: {A: 5.49e+49, b: -10.0, Ea: 3.578011e+04}
  high-P-rate-constant: {A: 1.23e+13, b: -0.1, Ea: 3.021033e+04}
  Troe: {A: -1.17, T3: 251.0, T1: 0.0, T2: 1185.0}
- equation: C3H6 + H (+M) <=> N-C3H7 (+M)  # Reaction 122
  type: falloff
  low-P-rate-constant: {A: 6.26e+38, b: -6.66, Ea: 7000.0}
  high-P-rate-constant: {A: 1.33e+13, b: 0.0, Ea: 3260.04}
  Troe: {A: 1.0, T3: 1000.0, T1: 1310.0, T2: 4.81e+04}
  efficiencies: {CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: N-C3H7 + O2 <=> C3H6 + HO2  # Reaction 123
  rate-constant: {A: 3.5e+16, b: -1.6, Ea: 3500.0}
- equation: N-C3H7 + O2 <=> C3H6OOH  # Reaction 124
  rate-constant: {A: 2.0e+12, b: 0.0, Ea: 0.0}
- equation: C3H6OOH <=> C3H6 + HO2  # Reaction 125
  rate-constant: {A: 2.5e+35, b: -8.3, Ea: 2.2e+04}
- equation: C3H6OOH + O2 <=> OC3H5OOH + OH  # Reaction 126
  rate-constant: {A: 1.5e+08, b: 0.0, Ea: -7000.0}
- equation: OC3H5OOH <=> CH2CHO + CH2O + OH  # Reaction 127
  rate-constant: {A: 1.0e+15, b: 0.0, Ea: 4.3e+04}
- equation: C4H8 <=> C3H5 + CH3  # Reaction 128
  rate-constant: {A: 1.0e+16, b: 0.0, Ea: 7.289675e+04}
- equation: C4H8 + H <=> C2H3 + C2H4 + H2  # Reaction 129
  rate-constant: {A: 6.6e+05, b: 2.54, Ea: 6763.86}
