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


generator: cti2yaml
cantera-version: 3.0.0
date: Sat, 27 Jan 2024 15:25:22 +0100
input-files: [HYCHEM_27_268_12_AF.cti]

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

phases:
- name: gas
  thermo: ideal-gas
  elements: [N, Ar, H, O, C]
  species: [N2, H, H2, O, OH, H2O, H2O2, O2, HO2, CH2O, CO2, CO, CH3, CH4,
    C2H4, C2H6, CH2CO, C2H2, C3H6, AXC3H4, IXC4H8, C5H6, C6H5O, C6H4O2,
    C6H6, C6H5CH3, POSF10325]
  kinetics: custom
  reactions: all
  transport: mixture-averaged
  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
  note: '121286'
- name: H
  composition: {H: 1}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    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
  note: L7/88
- name: H2
  composition: {H: 2}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    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: 2.92
    well-depth: 38.0
    polarizability: 0.79
    rotational-relaxation: 280.0
  note: TPIS78
- name: O
  composition: {O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    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: 2.75
    well-depth: 80.0
  note: L1/90
- name: OH
  composition: {H: 1, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 6000.0]
    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: 2.75
    well-depth: 80.0
  note: S9/01
- name: H2O
  composition: {H: 2, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    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: 2.605
    well-depth: 572.4
    dipole: 1.844
    rotational-relaxation: 4.0
  note: L8/89
- name: H2O2
  composition: {H: 2, O: 2}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    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
  note: L7/88
- name: O2
  composition: {O: 2}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    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
  note: TPIS89
- name: HO2
  composition: {H: 1, O: 2}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    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
  note: L5/89
- name: CH2O
  composition: {H: 2, C: 1, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    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
  note: L8/88
- name: CO2
  composition: {C: 1, O: 2}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    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: 2.65
    rotational-relaxation: 2.1
  note: L7/88
- name: CO
  composition: {C: 1, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    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: 1.95
    rotational-relaxation: 1.8
  note: TPIS79
- name: CH3
  composition: {H: 3, C: 1}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    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
  note: L11/89
- name: CH4
  composition: {H: 4, C: 1}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    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: 3.746
    well-depth: 141.4
    polarizability: 2.6
    rotational-relaxation: 13.0
  note: L8/88
- name: C2H4
  composition: {H: 4, C: 2}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    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: 3.971
    well-depth: 280.8
    rotational-relaxation: 1.5
  note: L1/91
- name: C2H6
  composition: {H: 6, C: 2}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    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: 4.302
    well-depth: 252.3
    rotational-relaxation: 1.5
  note: L8/88
- name: CH2CO
  composition: {H: 2, C: 2, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    data:
    - [2.1358363, 0.0181188721, -1.73947474e-05, 9.34397568e-09, -2.01457615e-12,
      -7270.0, 12.215648]
    - [4.51129732, 9.00359745e-03, -4.16939635e-06, 9.23345882e-10, -7.94838201e-14,
      -7778.5, 0.632247205]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.97
    well-depth: 436.0
    rotational-relaxation: 2.0
  note: D05/90
- name: C2H2
  composition: {H: 2, C: 2}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    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: 4.1
    well-depth: 209.0
    rotational-relaxation: 2.5
  note: L1/91
- name: C3H6
  composition: {H: 6, C: 3}
  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: 4.982
    well-depth: 266.8
    rotational-relaxation: 1.0
  note: '120186'
- name: AXC3H4
  composition: {H: 4, C: 3}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 6000.0]
    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: 4.76
    well-depth: 252.0
    rotational-relaxation: 1.0
  note: L8/89
- name: IXC4H8
  composition: {H: 8, C: 4}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [2.6471405, 0.025902957, 8.1985354e-06, -2.2193259e-08, 8.895858e-12,
      -4037.3069, 12.676388]
    - [4.460947, 0.029611487, -1.3077129e-05, 2.6571934e-09, -2.0134713e-13,
      -5006.6758, 1.0671549]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.176
    well-depth: 357.0
    rotational-relaxation: 1.0
  note: T6/83
- name: C5H6
  composition: {H: 6, C: 5}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 6000.0]
    data:
    - [0.86108957, 0.014804031, 7.2108895e-05, -1.1338055e-07, 4.8689972e-11,
      1.4801755e+04, 21.353453]
    - [9.9757848, 0.018905543, -6.8411461e-06, 1.109934e-09, -6.6680236e-14,
      1.1081693e+04, -32.209454]
  transport:
    model: gas
    geometry: linear
    diameter: 5.18
    well-depth: 357.0
    rotational-relaxation: 1.0
  note: T1/90
- name: C6H5O
  composition: {H: 5, C: 6, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 6000.0]
    data:
    - [-0.466204455, 0.0413443975, 1.32412991e-05, -5.72872769e-08, 2.89763707e-11,
      4778.58391, 27.6990274]
    - [13.722172, 0.0174688771, -6.3550452e-06, 1.03492308e-09, -6.23410504e-14,
      287.274751, -48.818168]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.29
    well-depth: 464.8
    polarizability: 10.32
  note: T05/02
- name: C6H4O2
  composition: {H: 4, C: 6, O: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [-0.95193005, 0.057842445, -3.8214439e-05, 4.6312656e-09, 3.6296651e-12,
      -1.7611047e+04, 29.239513]
    - [11.73084, 0.023614995, -1.0234576e-05, 1.9532174e-09, -1.2746022e-13,
      -2.108577e+04, -36.300453]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.425
    well-depth: 485.0
    dipole: 0.4
    rotational-relaxation: 1.0
  note: PUML96
- name: C6H6
  composition: {H: 6, C: 6}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 3000.0]
    data:
    - [-4.8437734, 0.058427613, -2.9485855e-05, -6.939044e-09, 8.2125253e-12,
      9181.7773, 43.889832]
    - [9.1381245, 0.023854433, -8.8127726e-06, 1.2099021e-09, -1.8221503e-14,
      5204.3462, -29.115665]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.29
    well-depth: 464.8
    polarizability: 10.32
  note: D11/99
- name: C6H5CH3
  composition: {H: 8, C: 7}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 6000.0]
    data:
    - [1.6152663, 0.021099438, 8.5366018e-05, -1.3261066e-07, 5.5956604e-11,
      4075.63, 20.28221]
    - [12.940034, 0.026691287, -9.6838505e-06, 1.5738629e-09, -9.4663601e-14,
      -697.64908, -46.728785]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.68
    well-depth: 495.3
    dipole: 0.43
    polarizability: 12.3
    rotational-relaxation: 1.0
  note: L6/87
- name: POSF10325
  composition: {H: 22, C: 11}
  thermo:
    model: NASA7
    temperature-ranges: [298.0, 1000.0, 3000.0]
    data:
    - [3.1685777, 0.071203448, 8.6995955e-05, -1.6861206e-07, 7.598637e-11,
      -4.0446344e+04, 20.533686]
    - [23.228163, 0.066188388, -2.41585e-05, 3.5865497e-09, -1.0226898e-13,
      -4.8778816e+04, -95.818108]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 6.834
    well-depth: 750.46
    rotational-relaxation: 1.0
  note: P12/09
- name: CH2
  composition: {H: 2, C: 1}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    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
  note: LS/93
- name: HCO
  composition: {H: 1, C: 1, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    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
  note: L12/89
- name: CH2D
  composition: {H: 2, C: 1}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    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
  note: LS/93
- name: CH3O
  composition: {H: 3, C: 1, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 6000.0]
    data:
    - [3.71180502, -2.80463306e-03, 3.76550971e-05, -4.73072089e-08, 1.8658842e-11,
      1295.6976, 6.57240864]
    - [4.75779238, 7.44142474e-03, -2.69705176e-06, 4.38090504e-10, -2.63537098e-14,
      378.11194, -1.96680028]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.69
    well-depth: 417.0
    dipole: 1.7
    rotational-relaxation: 2.0
  note: IU1/03
- name: C2H5
  composition: {H: 5, C: 2}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    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: 4.302
    well-depth: 252.3
    rotational-relaxation: 1.5
  note: L12/92
- name: HCCO
  composition: {H: 1, C: 2, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 4000.0]
    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
  note: SRIC91
- name: C2H3
  composition: {H: 3, C: 2}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 3500.0]
    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: 4.1
    well-depth: 209.0
    rotational-relaxation: 1.0
  note: L2/92
- name: CH2CHO
  composition: {H: 3, C: 2, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [3.4090624, 0.010738574, 1.8914925e-06, -7.1585831e-09, 2.8673851e-12,
      62.0, 9.5714535]
    - [5.9756699, 8.1305914e-03, -2.7436245e-06, 4.0703041e-10, -2.1760171e-14,
      -969.5, -5.0320879]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.97
    well-depth: 436.0
    rotational-relaxation: 2.0
  note: D05/83
- name: AXC3H5
  composition: {H: 5, C: 3}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 3000.0]
    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: 4.982
    well-depth: 266.8
    rotational-relaxation: 1.0
  note: PD5/98
- name: C6H5
  composition: {H: 5, C: 6}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 3000.0]
    data:
    - [-3.6931453, 0.052178968, -2.5558427e-05, -7.0661121e-09, 7.5833975e-12,
      3.977959e+04, 41.332535]
    - [8.597311, 0.02224163, -8.7199978e-06, 1.3788785e-09, -5.3146056e-14,
      3.6261047e+04, -22.954643]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.29
    well-depth: 464.8
    polarizability: 10.32
  note: D11/99
- name: C6H5CH2
  composition: {H: 7, C: 7}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1000.0, 6000.0]
    data:
    - [0.4811154, 0.038512832, 3.2861492e-05, -7.6972721e-08, 3.5423068e-11,
      2.3307027e+04, 23.54882]
    - [14.04398, 0.023493873, -8.5375367e-06, 1.3890841e-09, -8.361442e-14,
      1.8564203e+04, -51.665589]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.68
    well-depth: 495.3
    dipole: 0.43
    polarizability: 12.3
    rotational-relaxation: 1.0
  note: T08/90
- name: C6H5CHO
  composition: {H: 6, C: 7, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [298.15, 1000.0, 5000.0]
    data:
    - [-3.1627334, 0.066369245, -3.4816353e-05, -6.2999377e-09, 8.5807101e-12,
      -6116.9349, 40.231735]
    - [13.650737, 0.025680419, -1.0466729e-05, 1.941343e-09, -1.3483792e-13,
      -1.1019744e+04, -47.965796]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.47
    well-depth: 593.0
    dipole: 2.8
    rotational-relaxation: 1.0
  note: L3/86

reactions:
- equation: 2 O <=> O2  # Reaction 1
  rate-constant: {A: 0.0, b: 0, Ea: 0}
  negative-A: true
