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

generator: cti2yaml
cantera-version: 3.0.0
date: Thu, 01 Aug 2024 11:33:56 +0200
input-files: [C7H16_oO2_35_90_JW.cti]

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

phases:
- name: gas_skel
  thermo: ideal-gas
  elements: [N, O, H, C]
  species: [N2, O, O2, H2, H, OH, H2O2, H2O, HO2, HCO, CH2, CO, CH2O, CO2,
    CH3, CH4, C2H4, C2H5, C2H2, CH2CO, C3H4XA, C3H4XP, C3H5XA, C2H3, C3H3,
    C3H6, C5H10X1, C7H16, CH2GSG, C2H, HCCO, C2H5O, C3H2, PXC4H9, C7H15X2]
  kinetics: gas
  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, 1.40824e-03, -3.963222e-06, 5.641515e-09, -2.444855e-12,
      -1020.9, 3.950372]
    - [2.92664, 1.487977e-03, -5.684761e-07, 1.009704e-10, -6.753351e-15,
      -922.7977, 5.980528]
  transport:
    model: gas
    geometry: linear
    diameter: 3.621
    well-depth: 97.53
- name: O
  composition: {O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [2.946429, -1.638166e-03, 2.421032e-06, -1.602843e-09, 3.890696e-13,
      2.914764e+04, 2.963995]
    - [2.54206, -2.755062e-05, -3.102803e-09, 4.551067e-12, -4.368052e-16,
      2.92308e+04, 4.920308]
  transport:
    model: gas
    geometry: atom
    diameter: 2.7500000000000004
    well-depth: 80.0
- name: O2
  composition: {O: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.212936, 1.127486e-03, -5.75615e-07, 1.313877e-09, -8.768554e-13,
      -1005.249, 6.034738]
    - [3.697578, 6.135197e-04, -1.258842e-07, 1.775281e-11, -1.136435e-15,
      -1233.93, 3.189166]
  transport:
    model: gas
    geometry: linear
    diameter: 3.458
    well-depth: 107.4
- name: H2
  composition: {H: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.298124, 8.249442e-04, -8.143015e-07, -9.475434e-11, 4.134872e-13,
      -1012.521, -3.294094]
    - [2.991423, 7.000644e-04, -5.633829e-08, -9.231578e-12, 1.582752e-15,
      -835.034, -1.35511]
  transport:
    model: gas
    geometry: linear
    diameter: 2.9200000000000004
    well-depth: 38.0
- name: H
  composition: {H: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [2.50104422, 0.0, 0.0, 0.0, 0.0, 2.54747466e+04, -0.465341317]
    - [2.50104422, 0.0, 0.0, 0.0, 0.0, 2.54747466e+04, -0.465341317]
  transport:
    model: gas
    geometry: atom
    diameter: 2.05
    well-depth: 145.0
- name: OH
  composition: {H: 1, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.43586219, 2.02235804e-04, -1.13546412e-07, 2.42445149e-10, -7.43651031e-14,
      3743.21252, 2.45014127]
    - [3.69039275, -5.80802318e-04, 7.63303256e-07, -1.80262059e-10, 0.0,
      3678.72158, 1.15883087]
  transport:
    model: gas
    geometry: linear
    diameter: 2.7500000000000004
    well-depth: 80.0
- name: H2O2
  composition: {H: 2, O: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.388754, 6.569226e-03, -1.485013e-07, -4.625806e-09, 2.471515e-12,
      -1.766315e+04, 6.785363]
    - [4.573167, 4.336136e-03, -1.474689e-06, 2.348904e-10, -1.431654e-14,
      -1.800696e+04, 0.501137]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.458
    well-depth: 107.4
- name: H2O
  composition: {H: 2, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.386842, 3.474982e-03, -6.354696e-06, 6.968581e-09, -2.506588e-12,
      -3.020811e+04, 2.590233]
    - [2.672146, 3.056293e-03, -8.73026e-07, 1.200996e-10, -6.391618e-15,
      -2.989921e+04, 6.862817]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 2.6050000000000004
    well-depth: 572.4
- name: HO2
  composition: {H: 1, O: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.18310656, 3.6676795e-03, -9.32385122e-07, -3.25852919e-10, 1.51139912e-13,
      809.181013, 8.39371099]
    - [3.00201579, 4.38552424e-03, -1.97594219e-06, 3.32090097e-10, 0.0,
      844.944001, 9.26704616]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.458
    well-depth: 107.4
- name: HCO
  composition: {C: 1, H: 1, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [2.89833, 6.199147e-03, -9.623084e-06, 1.089825e-08, -4.574885e-12,
      4159.922, 8.983614]
    - [3.557271, 3.345573e-03, -1.335006e-06, 2.470573e-10, -1.713851e-14,
      3916.324, 5.552299]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.59
    well-depth: 498.0
- name: CH2
  composition: {C: 1, H: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.762237, 1.159819e-03, 2.489585e-07, 8.800836e-10, -7.332435e-13,
      4.536791e+04, 1.712578]
    - [3.636408, 1.933057e-03, -1.687016e-07, -1.009899e-10, 1.808256e-14,
      4.534134e+04, 2.156561]
  transport:
    model: gas
    geometry: linear
    diameter: 3.8
    well-depth: 144.0
- name: CO
  composition: {C: 1, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.262452, 1.511941e-03, -3.881755e-06, 5.581944e-09, -2.474951e-12,
      -1.431054e+04, 4.848897]
    - [3.025078, 1.442689e-03, -5.630828e-07, 1.018581e-10, -6.910952e-15,
      -1.426835e+04, 6.108218]
  transport:
    model: gas
    geometry: linear
    diameter: 3.65
    well-depth: 98.1
- name: CH2O
  composition: {C: 1, H: 2, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [1.652731, 0.01263144, -1.888168e-05, 2.050031e-08, -8.413237e-12,
      -1.48654e+04, 13.78482]
    - [2.995606, 6.681321e-03, -2.628955e-06, 4.737153e-10, -3.212517e-14,
      -1.532037e+04, 6.912572]
  transport:
    model: gas
    geometry: linear
    diameter: 3.59
    well-depth: 498.0
- name: CO2
  composition: {C: 1, O: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [2.275725, 9.922072e-03, -1.040911e-05, 6.866687e-09, -2.11728e-12,
      -4.837314e+04, 10.18849]
    - [4.453623, 3.140169e-03, -1.278411e-06, 2.393997e-10, -1.669033e-14,
      -4.896696e+04, -0.9553959]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.763
    well-depth: 244.0
- name: CH3
  composition: {C: 1, H: 3}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [2.430443, 0.0111241, -1.68022e-05, 1.621829e-08, -5.864953e-12, 1.642378e+04,
      6.789794]
    - [2.844052, 6.137974e-03, -2.230345e-06, 3.785161e-10, -2.452159e-14,
      1.643781e+04, 5.452697]
  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:
    - [0.7787415, 0.01747668, -2.783409e-05, 3.049708e-08, -1.223931e-11,
      -9825.229, 13.72219]
    - [1.683479, 0.01023724, -3.875129e-06, 6.785585e-10, -4.503423e-14,
      -1.008079e+04, 9.623395]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.7460000000000004
    well-depth: 141.4
- name: C2H4
  composition: {C: 2, H: 4}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [-0.861488, 0.02796163, -3.388677e-05, 2.785152e-08, -9.737879e-12,
      5573.046, 24.21149]
    - [3.528419, 0.01148518, -4.418385e-06, 7.844601e-10, -5.266848e-14,
      4428.289, 2.230389]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.496
    well-depth: 238.4
- name: C2H5
  composition: {C: 2, H: 5}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [2.690702, 8.719133e-03, 4.419839e-06, 9.338703e-10, -3.927773e-12,
      1.28704e+04, 12.1382]
    - [7.19048, 6.484077e-03, -6.428065e-07, -2.347879e-10, 3.880877e-14,
      1.067455e+04, -14.78089]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.35
    well-depth: 247.49999999999997
- name: C2H2
  composition: {C: 2, H: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [2.013562, 0.01519045, -1.616319e-05, 9.078992e-09, -1.912746e-12,
      2.612444e+04, 8.805378]
    - [4.43677, 5.376039e-03, -1.912817e-06, 3.286379e-10, -2.15671e-14,
      2.566766e+04, -2.800338]
  transport:
    model: gas
    geometry: linear
    diameter: 3.7210000000000005
    well-depth: 265.3
- name: CH2CO
  composition: {C: 2, H: 2, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [2.974971, 0.01211871, -2.345046e-06, -6.466685e-09, 3.905649e-12,
      -7632.637, 8.673553]
    - [6.038817, 5.80484e-03, -1.920954e-06, 2.794485e-10, -1.458868e-14,
      -8583.402, -7.657581]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.97
    well-depth: 436.0
- name: C3H4XA
  composition: {C: 3, H: 4}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [2.539831, 0.01633437, -1.76495e-06, -4.647365e-09, 1.729131e-12,
      2.251243e+04, 9.935702]
    - [1.97418459, 0.0205280021, -1.01844059e-05, 1.87323627e-09, 0.0, 2.25034216e+04,
      12.1178939]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.29
    well-depth: 324.8
- name: C3H4XP
  composition: {C: 3, H: 4}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.02973, 0.01498961, -1.3985e-06, -3.969619e-09, 1.388217e-12, 2.148408e+04,
      8.004594]
    - [1.76237742, 0.0205568619, -1.0119163e-05, 1.8393617e-09, 0.0, 2.17000925e+04,
      13.9629625]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.29
    well-depth: 324.8
- name: C3H5XA
  composition: {C: 3, H: 5}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [-0.529131958, 0.03345591, -2.53401027e-05, 1.02865754e-08, -1.7325834e-12,
      1.93834226e+04, 25.3067131]
    - [3.66851913, 0.0196203316, -8.52931569e-06, 1.38113234e-09, 0.0, 1.83798091e+04,
      4.27588674]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.22
    well-depth: 316.0
- name: C2H3
  composition: {C: 2, H: 3}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [2.459276, 7.371476e-03, 2.109873e-06, -1.321642e-09, -1.184784e-12,
      3.335225e+04, 11.5562]
    - [5.933468, 4.017746e-03, -3.96674e-07, -1.441267e-10, 2.378644e-14,
      3.185435e+04, -8.530313]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.7210000000000005
    well-depth: 265.3
- name: C3H3
  composition: {C: 3, H: 3}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [4.7542, 0.01108028, 2.793323e-07, -5.479212e-09, 1.949629e-12, 3.988883e+04,
      0.5854549]
    - [8.831047, 4.357195e-03, -4.109067e-07, -2.368723e-10, 4.37652e-14,
      3.84742e+04, -21.77919]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.29
    well-depth: 324.8
- name: C3H6
  composition: {C: 3, H: 6}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [0.394615444, 0.0289107662, -1.54886808e-05, 3.88814209e-09, -3.37890352e-13,
      1066.88164, 21.9003736]
    - [1.68134957, 0.0249690718, -1.11276041e-05, 1.84413526e-09, 0.0, 740.726095,
      15.3699482]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.14
    well-depth: 307.8
- name: C5H10X1
  composition: {C: 5, H: 10}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [-1.06223481, 0.0574218294, -3.7448689e-05, 1.27364989e-08, -1.79609789e-12,
      -4465.46666, 32.273979]
    - [3.98580522, 0.0412429986, -1.84390497e-05, 3.06155241e-09, 0.0, -5701.12071,
      6.85332264]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.489000000000001
    well-depth: 386.2
- name: C7H16
  composition: {C: 7, H: 16}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [-1.26836187, 0.085435582, -5.25346786e-05, 1.62945721e-08, -2.02394925e-12,
      -2.56586565e+04, 35.3732912]
    - [5.14079241, 0.0653078671, -2.94827624e-05, 4.93726726e-09, 0.0, -2.7253389e+04,
      2.98195967]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 6.253
    well-depth: 459.6
- name: CH2GSG
  composition: {C: 1, H: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.971265, -1.699089e-04, 1.025369e-06, 2.492551e-09, -1.981266e-12,
      4.989368e+04, 0.05753207]
    - [3.552889, 2.066788e-03, -1.914116e-07, -1.104673e-10, 2.02135e-14,
      4.984975e+04, 1.68657]
  transport:
    model: gas
    geometry: linear
    diameter: 3.8
    well-depth: 144.0
- name: C2H
  composition: {C: 2, H: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [2.737704, 8.048446e-03, -9.24431e-06, 6.525259e-09, -1.93958e-12,
      6.683813e+04, 7.30022]
    - [3.986367, 3.143123e-03, -1.267243e-06, 2.924363e-10, -2.71632e-14,
      6.655884e+04, 1.191063]
  transport:
    model: gas
    geometry: linear
    diameter: 3.7210000000000005
    well-depth: 265.3
- name: HCCO
  composition: {C: 2, H: 1, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [5.047965, 4.453478e-03, 2.268283e-07, -1.482095e-09, 2.250742e-13,
      1.965892e+04, 0.4818439]
    - [6.758073, 2.0004e-03, -2.027607e-07, -1.041132e-10, 1.965165e-14,
      1.901513e+04, -9.071262]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 2.5
    well-depth: 150.0
- name: C2H5O
  composition: {C: 2, H: 5, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [0.494420708, 0.0271774434, -1.6590901e-05, 5.152042e-09, -6.48496915e-13,
      -3352.52925, 22.8079378]
    - [2.46262349, 0.0209503959, -9.3929175e-06, 1.56440627e-09, 0.0, -3839.32658,
      12.8738847]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.41
    well-depth: 470.6
- name: C3H2
  composition: {C: 3, H: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.166714, 0.02482572, -4.591637e-05, 4.268019e-08, -1.482152e-11,
      6.350421e+04, 8.869446]
    - [7.670981, 2.748749e-03, -4.370943e-07, -6.455599e-11, 1.663887e-14,
      6.259722e+04, -12.3689]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.1
    well-depth: 209.0
- name: PXC4H9
  composition: {C: 4, H: 9}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [-0.437779725, 0.0478972364, -3.14023159e-05, 1.09786472e-08, -1.62010664e-12,
      7689.45248, 28.6852732]
    - [3.8181233, 0.0340790489, -1.49135433e-05, 2.43205247e-09, 0.0, 6659.01304,
      7.30417607]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.24
    well-depth: 352.0
- name: C7H15X2
  composition: {C: 7, H: 15}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [-0.0379155767, 0.075672657, -4.07473634e-05, 9.32678943e-09, -4.92360745e-13,
      -2356.05303, 33.7321506]
    - [3.74721159, 0.0649345162, -3.01341025e-05, 5.17418142e-09, 0.0, -3370.18357,
      14.2780413]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 6.253
    well-depth: 459.6

reactions:
- equation: H2 + O => H + OH  # Reaction 1
  rate-constant: {A: 5.08e+04, b: 2.67, Ea: 6292.07}
- equation: H + OH => H2 + O  # Reaction 2
  rate-constant: {A: 2.231e+04, b: 2.67, Ea: 4196.94}
- equation: H + O + M => OH + M  # Reaction 3
  type: three-body
  rate-constant: {A: 4.72e+18, b: -1.0, Ea: 0.0}
  efficiencies: {CO: 1.9, CO2: 3.8, H2O: 12.0}
- equation: 2 OH (+M) <=> H2O2 (+M)  # Reaction 4
  type: falloff
  low-P-rate-constant: {A: 3.041e+30, b: -4.63, Ea: 2049.0}
  high-P-rate-constant: {A: 1.236e+14, b: -0.37, Ea: 0.0}
  Troe: {A: 0.47, T3: 100.0, T1: 2000.0, T2: 1.0e+15}
  efficiencies: {CO: 1.9, CO2: 3.8, H2O: 12.0}
- equation: H2 + OH => H + H2O  # Reaction 5
  rate-constant: {A: 2.16e+08, b: 1.51, Ea: 3429.97}
- equation: H + H2O => H2 + OH  # Reaction 6
  rate-constant: {A: 9.352e+08, b: 1.51, Ea: 1.858007e+04}
- equation: H2O + M => H + OH + M  # Reaction 7
  type: three-body
  rate-constant: {A: 1.837e+27, b: -3.0, Ea: 1.2259989999999998e+05}
  efficiencies: {CO: 1.9, CO2: 3.8, H2O: 12.0}
- equation: H + OH + M => H2O + M  # Reaction 8
  type: three-body
  rate-constant: {A: 2.25e+22, b: -2.0, Ea: 0.0}
  efficiencies: {CO: 1.9, CO2: 3.8, H2O: 12.0}
- equation: H2O + O => 2 OH  # Reaction 9
  rate-constant: {A: 2.97e+06, b: 2.02, Ea: 1.34001e+04}
- equation: 2 OH => H2O + O  # Reaction 10
  rate-constant: {A: 3.013e+05, b: 2.02, Ea: -3849.9}
- equation: H + O2 (+M) <=> HO2 (+M)  # Reaction 11
  type: falloff
  low-P-rate-constant: {A: 3.5e+16, b: -0.41, Ea: -1115.92}
  high-P-rate-constant: {A: 1.475e+12, b: 0.6, Ea: 0.0}
  Troe: {A: 0.5, T3: 0.0, T1: 1.0000000000000002e+30, T2: 1.0e+100}
  efficiencies: {CO: 1.9, CO2: 3.8, H2O: 12.0}
- equation: H + O2 => O + OH  # Reaction 12
  rate-constant: {A: 1.97e+14, b: 0.0, Ea: 1.653991e+04}
- equation: O + OH => H + O2  # Reaction 13
  rate-constant: {A: 1.555e+13, b: 0.0, Ea: 424.95}
- equation: HO2 + OH => H2O + O2  # Reaction 14
  rate-constant: {A: 2.89e+13, b: 0.0, Ea: -500.0}
- equation: H2O + O2 => HO2 + OH  # Reaction 15
  rate-constant: {A: 6.888e+15, b: -0.33, Ea: 7.214006e+04}
- equation: H + HO2 => 2 OH  # Reaction 16
  rate-constant: {A: 7.08e+13, b: 0.0, Ea: 299.95}
- equation: 2 OH => H + HO2  # Reaction 17
  rate-constant: {A: 1.352e+14, b: -0.33, Ea: 3.957003e+04}
- equation: HO2 + O => O2 + OH  # Reaction 18
  rate-constant: {A: 3.25e+13, b: 0.0, Ea: 0.0}
- equation: O2 + OH => HO2 + O  # Reaction 19
  rate-constant: {A: 7.857e+14, b: -0.33, Ea: 5.539006e+04}
- equation: H2O2 + OH => H2O + HO2  # Reaction 20
  rate-constant: {A: 5.8e+14, b: 0.0, Ea: 9559.990000000002}
  duplicate: true
- equation: H2O + HO2 => H2O2 + OH  # Reaction 21
  rate-constant: {A: 9.771e+13, b: 0.33, Ea: 4.102008e+04}
  duplicate: true
- equation: H2O2 + OH => H2O + HO2  # Reaction 22
  rate-constant: {A: 1.0e+12, b: 0.0, Ea: 0.0}
  duplicate: true
- equation: CH2GSG + H2 => CH3 + H  # Reaction 23
  rate-constant: {A: 7.0e+13, b: 0.0, Ea: 0.0}
- equation: CH2GSG + O2 => CO + H + OH  # Reaction 24
  rate-constant: {A: 7.0e+13, b: 0.0, Ea: 0.0}
- equation: CH3 + OH => CH2GSG + H2O  # Reaction 25
  rate-constant: {A: 2.65e+13, b: 0.0, Ea: 2185.95}
- equation: CH3 + H (+M) <=> CH4 (+M)  # Reaction 26
  type: falloff
  low-P-rate-constant: {A: 3.31e+30, b: -4.0, Ea: 2108.03}
  high-P-rate-constant: {A: 2.138e+15, b: -0.4, Ea: 0.0}
  Troe: {A: 0.0, T3: 0.0, T1: 0.0, T2: 40.0}
  efficiencies: {CO: 2.0, CO2: 3.0, H2O: 5.0}
- equation: CH2 + H2O => CH3 + OH  # Reaction 27
  rate-constant: {A: 2.623e+06, b: 2.0, Ea: 1.296009e+04}
- equation: CH3 + O => CH2O + H  # Reaction 28
  rate-constant: {A: 8.0e+13, b: 0.0, Ea: 0.0}
- equation: CH3 + HO2 => CH4 + O2  # Reaction 29
  rate-constant: {A: 3.6e+12, b: 0.0, Ea: 0.0}
- equation: CH3 + OH => CH2O + H2  # Reaction 30
  rate-constant: {A: 2.25e+13, b: 0.0, Ea: 4299.95}
- equation: CH4 + H => CH3 + H2  # Reaction 31
  rate-constant: {A: 1.727e+04, b: 3.0, Ea: 8223.95}
- equation: CH3 + H2 => CH4 + H  # Reaction 32
  rate-constant: {A: 661.0, b: 3.0, Ea: 7744.02}
- equation: CH4 + OH => CH3 + H2O  # Reaction 33
  rate-constant: {A: 1.93e+05, b: 2.4, Ea: 2106.12}
- equation: CO + HO2 => CO2 + OH  # Reaction 34
  rate-constant: {A: 3.01e+13, b: 0.0, Ea: 2.3e+04}
- equation: CO + OH => CO2 + H  # Reaction 35
  rate-constant: {A: 1.4e+05, b: 1.95, Ea: -1347.04}
- equation: CO2 + H => CO + OH  # Reaction 36
  rate-constant: {A: 1.568e+07, b: 1.95, Ea: 2.098996e+04}
- equation: HCO + O2 => CO + HO2  # Reaction 37
  rate-constant: {A: 7.58e+12, b: 0.0, Ea: 409.89}
- equation: HCO + M => CO + H + M  # Reaction 38
  type: three-body
  rate-constant: {A: 1.86e+17, b: -1.0, Ea: 1.7e+04}
  efficiencies: {CO: 1.9, CO2: 3.8, H2O: 6.0}
- equation: CO + H + M => HCO + M  # Reaction 39
  type: three-body
  rate-constant: {A: 6.467e+13, b: 0.0, Ea: -441.92}
  efficiencies: {CO: 1.9, CO2: 3.8, H2O: 6.0}
- equation: H + HCO => CO + H2  # Reaction 40
  rate-constant: {A: 7.34e+13, b: 0.0, Ea: 0.0}
- equation: HCO + OH => CO + H2O  # Reaction 41
  rate-constant: {A: 1.02e+14, b: 0.0, Ea: 0.0}
- equation: CH2O + M => H + HCO + M  # Reaction 42
  type: three-body
  rate-constant: {A: 6.283e+29, b: -3.57, Ea: 9.320005e+04}
- equation: CH2O + OH => H2O + HCO  # Reaction 43
  rate-constant: {A: 3.43e+09, b: 1.18, Ea: -446.94}
- equation: C2H2 + O => H + HCCO  # Reaction 44
  rate-constant: {A: 1.43e+07, b: 2.0, Ea: 1900.1}
- equation: C2H2 + OH => CH2CO + H  # Reaction 45
  rate-constant: {A: 2.19e-04, b: 4.5, Ea: -1000.0}
- equation: C2H2 + O => CH2 + CO  # Reaction 46
  rate-constant: {A: 6.12e+06, b: 2.0, Ea: 1900.1}
- equation: C2H2 + CH3 => C3H4XP + H  # Reaction 47
  rate-constant: {A: 1.211e+17, b: -1.2, Ea: 1.667997e+04}
- equation: C3H4XP + H => C2H2 + CH3  # Reaction 48
  rate-constant: {A: 1.0e+14, b: 0.0, Ea: 4000.0}
- equation: C3H5XA => C2H2 + CH3  # Reaction 49
  rate-constant: {A: 2.397e+48, b: -9.9, Ea: 8.208007e+04}
- equation: C2H + H2O => C2H2 + OH  # Reaction 50
  rate-constant: {A: 4671.0, b: 3.08, Ea: 684.99}
- equation: C2H3 + H => C2H2 + H2  # Reaction 51
  rate-constant: {A: 2.0e+13, b: 0.0, Ea: 2500.0}
- equation: C2H3 (+M) => C2H2 + H (+M)  # Reaction 52
  type: falloff
  low-P-rate-constant: {A: 1.164e+39, b: -6.821, Ea: 4.449163e+04}
  high-P-rate-constant: {A: 1.606e+10, b: 1.028, Ea: 4.050359e+04}
  Troe: {A: 1.0, T3: 0.0, T1: 675.0, T2: 1.0e+15}
  efficiencies: {CO: 2.0, CO2: 3.0, H2O: 5.0}
- equation: C2H3 + O2 => CH2O + HCO  # Reaction 53
  rate-constant: {A: 1.7e+29, b: -5.31, Ea: 6500.0}
- equation: C2H4 + CH3 => C2H3 + CH4  # Reaction 54
  rate-constant: {A: 6.62, b: 3.7, Ea: 9500.0}
- equation: C2H4 + H (+M) <=> C2H5 (+M)  # Reaction 55
  type: falloff
  low-P-rate-constant: {A: 1.112e+34, b: -5.0, Ea: 4447.9}
  high-P-rate-constant: {A: 1.081e+12, b: 0.45, Ea: 1821.94}
  Troe: {A: 1.0, T3: 0.0, T1: 95.0, T2: 200.0}
- equation: C2H4 + H => C2H3 + H2  # Reaction 56
  rate-constant: {A: 8.42e-03, b: 4.62, Ea: 2582.93}
- equation: C2H3 + H2 => C2H4 + H  # Reaction 57
  rate-constant: {A: 0.5723, b: 3.79, Ea: 3233.03}
- equation: C2H4 + OH => C2H3 + H2O  # Reaction 58
  rate-constant: {A: 2.05e+13, b: 0.0, Ea: 5950.05}
- equation: C2H5 + O2 => C2H4 + HO2  # Reaction 59
  rate-constant: {A: 1.22e+30, b: -5.76, Ea: 1.00999e+04}
- equation: C2H5 + HO2 => C2H5O + OH  # Reaction 60
  rate-constant: {A: 3.2e+13, b: 0.0, Ea: 0.0}
- equation: HCCO + O2 => CO2 + HCO  # Reaction 61
  rate-constant: {A: 2.4e+11, b: 0.0, Ea: -853.97}
- equation: H + HCCO => CH2GSG + CO  # Reaction 62
  rate-constant: {A: 1.1e+14, b: 0.0, Ea: 0.0}
- equation: HCCO + O => 2 CO + H  # Reaction 63
  rate-constant: {A: 8.0e+13, b: 0.0, Ea: 0.0}
- equation: CH2CO + H => H2 + HCCO  # Reaction 64
  rate-constant: {A: 2.0e+14, b: 0.0, Ea: 8000.0}
- equation: C2H5O + M => CH2O + CH3 + M  # Reaction 65
  type: three-body
  rate-constant: {A: 1.35e+38, b: -6.96, Ea: 2.379995e+04}
- equation: C3H2 + O2 => CO + H + HCCO  # Reaction 66
  rate-constant: {A: 5.0e+13, b: 0.0, Ea: 0.0}
- equation: C3H3 + H => C3H2 + H2  # Reaction 67
  rate-constant: {A: 5.0e+13, b: 0.0, Ea: 0.0}
- equation: C3H2 + H2O => C3H3 + OH  # Reaction 68
  rate-constant: {A: 1.343e+15, b: 0.0, Ea: 1.567997e+04}
- equation: C3H4XA + H => C3H3 + H2  # Reaction 69
  rate-constant: {A: 2.0e+07, b: 2.0, Ea: 5000.0}
- equation: C3H4XP + H => C3H3 + H2  # Reaction 70
  rate-constant: {A: 2.0e+07, b: 2.0, Ea: 5000.0}
- equation: C3H3 + H2 => C3H4XP + H  # Reaction 71
  rate-constant: {A: 1.296e+07, b: 1.81, Ea: 2.096009e+04}
- equation: C3H4XP => C2H + CH3  # Reaction 72
  rate-constant: {A: 4.2e+16, b: 0.0, Ea: 1.0e+05}
- equation: C3H5XA => C3H4XA + H  # Reaction 73
  rate-constant: {A: 6.663e+15, b: -0.43, Ea: 6.321989e+04}
- equation: C3H4XA + H => C3H5XA  # Reaction 74
  rate-constant: {A: 2.4e+11, b: 0.69, Ea: 3006.93}
- equation: 2 C3H5XA => C3H4XA + C3H6  # Reaction 75
  rate-constant: {A: 1.0e+12, b: 0.0, Ea: 0.0}
- equation: C3H5XA + CH2O => C3H6 + HCO  # Reaction 76
  rate-constant: {A: 6.3e+08, b: 1.9, Ea: 1.819001e+04}
- equation: C3H5XA + H => C3H6  # Reaction 77
  rate-constant: {A: 4.887e+56, b: -12.25, Ea: 2.8080070000000003e+04}
- equation: C3H6 + H => C3H5XA + H2  # Reaction 78
  rate-constant: {A: 1.73e+05, b: 2.5, Ea: 2492.11}
- equation: C3H6 + H => C2H4 + CH3  # Reaction 79
  rate-constant: {A: 4.83e+33, b: -5.81, Ea: 1.85e+04}
- equation: C3H6 + OH => C3H5XA + H2O  # Reaction 80
  rate-constant: {A: 3.12e+06, b: 2.0, Ea: -298.04}
- equation: C2H3 + CH3 => C3H6  # Reaction 81
  rate-constant: {A: 4.712e+59, b: -13.19, Ea: 2.953991e+04}
- equation: PXC4H9 => C2H4 + C2H5  # Reaction 82
  rate-constant: {A: 7.497e+17, b: -1.41, Ea: 2.958007e+04}
- equation: C5H10X1 => C2H5 + C3H5XA  # Reaction 83
  rate-constant: {A: 9.173e+20, b: -1.63, Ea: 7.398996e+04}
- equation: C2H5 + C3H5XA => C5H10X1  # Reaction 84
  rate-constant: {A: 4.0e+12, b: 0.0, Ea: -596.08}
- equation: C7H15X2 => C3H6 + PXC4H9  # Reaction 85
  rate-constant: {A: 5.313e+17, b: -1.411, Ea: 3.143284e+04}
- equation: C7H15X2 => C2H5 + C5H10X1  # Reaction 86
  rate-constant: {A: 1.368e+17, b: -1.394, Ea: 2.985899e+04}
- equation: C7H16 + HO2 => C7H15X2 + H2O2  # Reaction 87
  rate-constant: {A: 7.741e+12, b: 0.203, Ea: 1.763695e+04}
- equation: C7H16 + O2 => C7H15X2 + HO2  # Reaction 88
  rate-constant: {A: 2.956e+13, b: 0.195, Ea: 5.011424e+04}
- equation: C7H16 + OH => C7H15X2 + H2O  # Reaction 89
  rate-constant: {A: 7.518e+08, b: 1.494, Ea: 260.52}
- equation: C7H16 + H => C7H15X2 + H2  # Reaction 90
  rate-constant: {A: 1.749e+06, b: 2.6, Ea: 4361.85}
