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

generator: cti2yaml
cantera-version: 3.0.0
date: Sat, 27 Jan 2024 15:25:23 +0100
input-files: [JetA_39_434_15_QC.cti]

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

phases:
- name: gas
  thermo: ideal-gas
  elements: [N, H, O, C]
  species: [N2, H2, H, O2, O, H2O, OH, H2O2, HO2, CO, CO2, CH4, CH3, CH2O,
    C2H6, C2H5, C2H4, C2H2, NC3H7, C3H6, C2H3CHO, C4H6, C6H5, C5H6, NC5H10,
    CYC6H10, NC7H14, RCRESOLO, XYLENE, RXYLENE, RMCYC6, MCYC6, NC10H21,
    NC12H25, NC10H19, NC12H26, NC10H20, C4H8(L1), CH3O(L1)]
  species_qss: [CH2(S), HCO, C2H3, C2H, CH2CHO, HCCO, C3H5-A, C3H5O, PC4H9,
    C4H71-3, C4H71-4, C5H5, NC5H11, NC7H15, C7H7(L1)]
  kinetics: custom
  reactions: all
  state:
    T: 300.0
    P: 1.01325e+05

species:
- name: N2
  composition: {N: 2}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1050.0, 3500.0]
    data:
    - [3.73100682, -1.8315973e-03, 4.32324661e-06, -3.04378151e-09, 7.46071562e-13,
      -1062.87426, 2.16821198]
    - [2.81166073, 1.67067353e-03, -6.79997428e-07, 1.32881379e-10, -1.02767442e-14,
      -869.81158, 6.6483805]
  transport:
    model: gas
    geometry: linear
    diameter: 3.621
    well-depth: 97.53
    polarizability: 1.76
    rotational-relaxation: 4.0
- name: H2
  composition: {H: 2}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 700.0, 3500.0]
    data:
    - [2.64204438, 5.49529275e-03, -1.27163634e-05, 1.28749174e-08, -4.7002775e-12,
      -943.236613, -0.512231094]
    - [3.78199881, -1.0187326e-03, 1.24226233e-06, -4.19011899e-10, 4.75543794e-14,
      -1102.83023, -5.6052591]
  transport:
    model: gas
    geometry: linear
    diameter: 2.9200000000000004
    well-depth: 38.0
    polarizability: 0.7900000000000001
    rotational-relaxation: 280.0
- name: H
  composition: {H: 1}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 860.0, 3500.0]
    data:
    - [2.49950544, 2.99164057e-06, -5.92759783e-09, 4.87810185e-12, -1.45539326e-15,
      2.54737866e+04, -0.444574018]
    - [2.50031493, -7.73406872e-07, 6.39345384e-10, -2.12551804e-13, 2.44479207e-17,
      2.54736474e+04, -0.448357228]
  transport:
    model: gas
    geometry: atom
    diameter: 2.05
    well-depth: 145.0
- name: O2
  composition: {O: 2}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 700.0, 3500.0]
    data:
    - [3.74403921, -2.79740148e-03, 9.8012256e-06, -1.03259643e-08, 3.79931247e-12,
      -1060.69827, 3.82132645]
    - [2.82012408, 2.48211357e-03, -1.51202094e-06, 4.48556202e-10, -4.87305668e-14,
      -931.350148, 7.94914552]
  transport:
    model: gas
    geometry: linear
    diameter: 3.458
    well-depth: 107.4
    polarizability: 1.6
    rotational-relaxation: 3.8
- name: O
  composition: {O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 720.0, 3500.0]
    data:
    - [3.14799201, -3.11174063e-03, 6.18137893e-06, -5.63808794e-09, 1.94866014e-12,
      2.91309118e+04, 2.1344655]
    - [2.62549143, -2.08959648e-04, 1.33918549e-07, -3.85875908e-11, 4.38918703e-15,
      2.92061519e+04, 4.48358518]
  transport:
    model: gas
    geometry: atom
    diameter: 2.7500000000000004
    well-depth: 80.0
- name: H2O
  composition: {H: 2, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1420.0, 3500.0]
    data:
    - [4.06061172, -8.65807189e-04, 3.24409528e-06, -1.80243079e-09, 3.32483293e-13,
      -3.02831314e+04, -0.296150481]
    - [2.66777075, 3.05768849e-03, -9.00442411e-07, 1.43361552e-10, -1.00857817e-14,
      -2.98875645e+04, 6.91191131]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 2.6050000000000004
    well-depth: 572.4
    dipole: 1.8440005262719967
    rotational-relaxation: 4.0
- name: OH
  composition: {H: 1, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1700.0, 3500.0]
    data:
    - [3.91354631, -1.66275926e-03, 2.30920029e-06, -1.02359508e-09, 1.58829629e-13,
      3400.05047, 0.205474719]
    - [2.49867369, 1.66635279e-03, -6.28251516e-07, 1.28346806e-10, -1.05735894e-14,
      3881.10716, 7.78218863]
  transport:
    model: gas
    geometry: linear
    diameter: 2.7500000000000004
    well-depth: 80.0
- name: H2O2
  composition: {H: 2, O: 2}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1800.0, 3500.0]
    data:
    - [3.34774224, 7.05005437e-03, -3.84522006e-06, 1.16720661e-09, -1.47618105e-13,
      -1.75784785e+04, 7.17868851]
    - [4.76869639, 3.89237848e-03, -1.21382349e-06, 1.92615285e-10, -1.2258199e-14,
      -1.8090022e+04, -0.511811777]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.458
    well-depth: 107.4
    rotational-relaxation: 3.8
- name: HO2
  composition: {H: 1, O: 2}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 700.0, 3500.0]
    data:
    - [3.61994299, 1.05805704e-03, 5.06678942e-06, -6.33800762e-09, 2.41597281e-12,
      315.898234, 6.44411482]
    - [3.02391889, 4.46390907e-03, -2.23146492e-06, 6.127108e-10, -6.64266237e-14,
      399.341609, 9.10699973]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.458
    well-depth: 107.4
    rotational-relaxation: 1.0
- name: CO
  composition: {C: 1, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 960.0, 3500.0]
    data:
    - [3.75723891, -2.14465241e-03, 5.42079004e-06, -4.17025963e-09, 1.11901127e-12,
      -1.4357553e+04, 2.79976799]
    - [2.79255381, 1.87486886e-03, -8.59711925e-07, 1.9120007e-10, -1.67855286e-14,
      -1.41723335e+04, 7.4144356]
  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: [200.0, 1450.0, 3500.0]
    data:
    - [2.31684347, 9.22755036e-03, -7.75654093e-06, 3.2822536e-09, -5.48722482e-13,
      -4.83626067e+04, 10.0786234]
    - [4.70876468, 2.62914704e-03, -9.30606462e-07, 1.4389292e-10, -7.62581413e-15,
      -4.90562639e+04, -2.34976452]
  transport:
    model: gas
    geometry: linear
    diameter: 3.763
    well-depth: 244.0
    polarizability: 2.6500000000000004
    rotational-relaxation: 2.1
- name: CH4
  composition: {C: 1, H: 4}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 700.0, 3500.0]
    data:
    - [5.2396731, -0.0146835107, 5.29732676e-05, -5.41668788e-08, 1.96318554e-11,
      -1.02526308e+04, -4.97649641]
    - [0.505346456, 0.0123697844, -4.99807911e-06, 1.04392761e-09, -8.62897368e-14,
      -9589.82503, 16.1752773]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.7460000000000004
    well-depth: 141.4
    polarizability: 2.6
    rotational-relaxation: 13.0
- name: CH3
  composition: {C: 1, H: 3}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1060.0, 3500.0]
    data:
    - [3.4782931, 3.54764774e-03, 1.47408439e-06, -1.94375954e-09, 5.2192123e-13,
      1.64399516e+04, 2.40875956]
    - [2.78805104, 6.15233477e-03, -2.21179349e-06, 3.74402648e-10, -2.48151348e-14,
      1.65862829e+04, 5.77899817]
  transport:
    model: gas
    geometry: linear
    diameter: 3.8
    well-depth: 144.0
- name: CH2(S)
  composition: {C: 1, H: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 970.0, 3500.0]
    data:
    - [4.18185434, -2.21134312e-03, 7.71527537e-06, -5.95950378e-09, 1.58314628e-12,
      5.03669407e+04, -0.703002582]
    - [2.75934299, 3.65468306e-03, -1.35589913e-06, 2.74980408e-10, -2.36795469e-14,
      5.06429079e+04, 6.11646381]
  transport:
    model: gas
    geometry: linear
    diameter: 3.8
    well-depth: 144.0
- name: CH2O
  composition: {C: 1, H: 2, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 700.0, 3500.0]
    data:
    - [4.3262128, -7.01151756e-03, 3.15176939e-05, -3.36478617e-08, 1.23454015e-11,
      -1.43270169e+04, 2.62028968]
    - [1.33335655, 0.0100905182, -5.12952555e-06, 1.25425205e-09, -1.19639106e-13,
      -1.3908017e+04, 15.9916142]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.59
    well-depth: 498.0
    rotational-relaxation: 2.0
- name: HCO
  composition: {C: 1, H: 1, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 770.0, 3500.0]
    data:
    - [4.03483979, -2.15836864e-03, 1.18233875e-05, -1.18459406e-08, 4.00593955e-12,
      3836.36392, 4.2000877]
    - [2.60049318, 5.29278258e-03, -2.69184211e-06, 7.21357799e-10, -7.43521409e-14,
      4057.2533, 10.7450933]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.59
    well-depth: 498.0
- name: C2H6
  composition: {C: 2, H: 6}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1800.0, 3500.0]
    data:
    - [-0.241778723, 0.0253475709, -1.39645112e-05, 4.03257452e-09, -4.87754387e-13,
      -1.10391121e+04, 21.9572625]
    - [4.07959141, 0.0157445262, -5.96197393e-06, 1.06867182e-09, -7.61012341e-14,
      -1.25948053e+04, -1.43089411]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.35
    well-depth: 247.49999999999997
    rotational-relaxation: 1.5
- name: C2H5
  composition: {C: 2, H: 5}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1800.0, 3500.0]
    data:
    - [0.675421802, 0.0211542617, -1.20878017e-05, 3.6495118e-09, -4.59753237e-13,
      1.33457186e+04, 19.5628439]
    - [5.1979136, 0.01110428, -3.71281686e-06, 5.47665572e-10, -2.89412605e-14,
      1.17176215e+04, -4.91382512]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.35
    well-depth: 247.49999999999997
    rotational-relaxation: 1.5
- name: C2H4
  composition: {C: 2, H: 4}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1650.0, 3500.0]
    data:
    - [-0.0602932446, 0.020813397, -1.34307867e-05, 4.606383e-09, -6.51687481e-13,
      5511.51676, 21.0642172]
    - [4.60402718, 9.5059535e-03, -3.15129262e-06, 4.53052075e-10, -2.2394916e-14,
      3972.29102, -3.77420904]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.496
    well-depth: 238.4
    rotational-relaxation: 1.5
- name: C2H3
  composition: {C: 2, H: 3}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1450.0, 3500.0]
    data:
    - [1.23421214, 0.0156222204, -1.10171572e-05, 4.27989337e-09, -6.91541508e-13,
      3.46967692e+04, 16.8637048]
    - [4.18728376, 7.47581589e-03, -2.58984227e-06, 4.05265796e-10, -2.35022722e-14,
      3.38403785e+04, 1.51958752]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.7210000000000005
    well-depth: 265.3
    rotational-relaxation: 1.0
- name: C2H2
  composition: {C: 2, H: 2}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 790.0, 3500.0]
    data:
    - [0.770536982, 0.0237107994, -3.66622035e-05, 2.95989753e-08, -9.27579229e-12,
      2.64317975e+04, 14.090768]
    - [4.37267451, 5.47212836e-03, -2.03181547e-06, 3.75019136e-10, -2.77049085e-14,
      2.58626598e+04, -2.43835908]
  transport:
    model: gas
    geometry: linear
    diameter: 3.7210000000000005
    well-depth: 265.3
    rotational-relaxation: 2.5
- name: C2H
  composition: {C: 2, H: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1710.0, 3500.0]
    data:
    - [4.60873599, 1.42766785e-03, 8.54158643e-07, -6.83903344e-10, 1.21940589e-13,
      6.68801772e+04, -1.05894068]
    - [3.41788257, 4.21328989e-03, -1.58936946e-06, 2.68739191e-10, -1.73346358e-14,
      6.72874491e+04, 5.32512366]
  transport:
    model: gas
    geometry: linear
    diameter: 3.7210000000000005
    well-depth: 265.3
    rotational-relaxation: 2.5
- name: CH2CHO
  composition: {C: 2, H: 3, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1340.0, 3500.0]
    data:
    - [0.737868283, 0.0250454357, -2.20135026e-05, 1.00031294e-08, -1.80836357e-12,
      376.389339, 20.9962836]
    - [6.47703792, 7.91358605e-03, -2.83605892e-06, 4.62112658e-10, -2.832313e-14,
      -1161.70812, -8.37157284]
  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, 1220.0, 3500.0]
    data:
    - [3.33028661, 0.0120351629, -1.14247949e-05, 5.70731267e-09, -1.13618105e-12,
      2.00087543e+04, 7.53650387]
    - [5.81420512, 3.8911678e-03, -1.41168609e-06, 2.35668534e-10, -1.49424973e-14,
      1.94026782e+04, -4.94089645]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 2.5
    well-depth: 150.0
    rotational-relaxation: 1.0
- name: NC3H7
  composition: {C: 3, H: 7}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1590.0, 3500.0]
    data:
    - [-0.137086177, 0.0350892007, -2.30432453e-05, 8.14967014e-09, -1.19478101e-12,
      1.08484352e+04, 26.1969991]
    - [7.21724981, 0.0165877265, -5.58902439e-06, 8.31338517e-10, -4.40999327e-14,
      8509.75634, -12.6938766]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.81
    well-depth: 303.4
    rotational-relaxation: 1.0
- name: C3H6
  composition: {C: 3, H: 6}
  thermo:
    model: NASA7
    temperature-ranges: [298.0, 1800.0, 3500.0]
    data:
    - [-0.085598719, 0.0308112255, -1.84574096e-05, 5.68686491e-09, -7.13747674e-13,
      1925.67819, 24.0935688]
    - [6.31755201, 0.0165820017, -6.59972302e-06, 1.29512916e-09, -1.03784375e-13,
      -379.456071, -10.5616188]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.14
    well-depth: 307.8
    rotational-relaxation: 1.0
- name: C3H5-A
  composition: {C: 3, H: 5}
  thermo:
    model: NASA7
    temperature-ranges: [298.0, 1600.0, 3500.0]
    data:
    - [-0.357888096, 0.0327028536, -2.40053581e-05, 9.07345729e-09, -1.37016487e-12,
      2.00235695e+04, 24.2845603]
    - [8.53877792, 0.0104611885, -3.15379708e-06, 3.85306883e-10, -1.26413688e-14,
      1.71766363e+04, -22.8181758]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.22
    well-depth: 316.0
    rotational-relaxation: 1.0
- name: C3H5O
  composition: {C: 3, H: 5, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1610.0, 3500.0]
    data:
    - [0.927196847, 0.0340908988, -2.40959865e-05, 8.77622923e-09, -1.28545208e-12,
      1.04088818e+04, 22.3747992]
    - [9.11079978, 0.013758966, -5.15319199e-06, 9.32421983e-10, -6.74695911e-14,
      7773.7617, -21.0036658]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.820000000000001
    well-depth: 411.0
    rotational-relaxation: 1.0
- name: C2H3CHO
  composition: {C: 3, H: 4, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1600.0, 3500.0]
    data:
    - [0.818908044, 0.0322215131, -2.33838148e-05, 8.71820988e-09, -1.30539747e-12,
      -9681.68587, 23.6968522]
    - [9.22597838, 0.0112038372, -3.67974366e-06, 5.08180254e-10, -2.25803378e-14,
      -1.23719484e+04, -20.813756]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.958000000000001
    well-depth: 428.8
    dipole: 2.900000827651188
    rotational-relaxation: 1.0
- name: PC4H9
  composition: {C: 4, H: 9}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 950.0, 3500.0]
    data:
    - [-0.276188368, 0.049413138, -3.9379274e-05, 2.08221901e-08, -5.13033779e-12,
      6858.07273, 27.9243294]
    - [3.94763005, 0.0316286394, -1.12984867e-05, 1.11637451e-09, 5.54031595e-14,
      6055.54723, 7.76350068]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.24
    well-depth: 352.0
    rotational-relaxation: 1.0
- name: C4H71-3
  composition: {C: 4, H: 7}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1420.0, 3500.0]
    data:
    - [-1.12550124, 0.0464823652, -3.45124591e-05, 1.3738192e-08, -2.28751273e-12,
      1.46387978e+04, 30.5571711]
    - [8.33017753, 0.0198466503, -6.37614062e-06, 5.28652771e-10, 3.81103731e-14,
      1.1953385e+04, -18.3767118]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.720000000000001
    well-depth: 357.1
    rotational-relaxation: 1.0
- name: C4H71-4
  composition: {C: 4, H: 7}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1530.0, 3500.0]
    data:
    - [-0.329329051, 0.0423733221, -2.85167051e-05, 1.01973763e-08, -1.546396e-12,
      2.25881131e+04, 28.1156134]
    - [8.45916998, 0.0193968541, -5.99075606e-06, 3.82147973e-10, 5.73994806e-14,
      1.98988324e+04, -18.0212793]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.720000000000001
    well-depth: 357.1
    rotational-relaxation: 1.0
- name: C4H6
  composition: {C: 4, H: 6}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1800.0, 3500.0]
    data:
    - [0.465225109, 0.0346661815, -2.14437338e-05, 6.84964885e-09, -8.89456944e-13,
      1.17919599e+04, 23.1239087]
    - [9.30872521, 0.0150139591, -5.06688177e-06, 7.84148096e-10, -4.70262839e-14,
      8608.29987, -24.7389586]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 4.720000000000001
    well-depth: 357.0
    rotational-relaxation: 1.0
- name: C6H5
  composition: {C: 6, H: 5}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1390.0, 3500.0]
    data:
    - [-6.76261385, 0.0695132669, -6.22206553e-05, 2.78054854e-08, -4.87825263e-12,
      3.99884457e+04, 54.7375207]
    - [11.2331261, 0.017726965, -6.33615685e-06, 1.00236866e-09, -5.75481757e-14,
      3.498563e+04, -38.0075864]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.349000000000001
    well-depth: 412.3
    rotational-relaxation: 1.0
- name: C5H6
  composition: {C: 5, H: 6}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1630.0, 3500.0]
    data:
    - [-4.05866643, 0.0560992486, -4.29495178e-05, 1.64197154e-08, -2.47082363e-12,
      1.51874796e+04, 41.0783319]
    - [13.5786764, 0.0128174257, -3.11961936e-06, 1.29368392e-10, 2.76958521e-14,
      9437.70579, -52.6289052]
  transport:
    model: gas
    geometry: linear
    diameter: 5.200000000000001
    well-depth: 408.0
    rotational-relaxation: 1.0
- name: C5H5
  composition: {C: 5, H: 5}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 700.0, 3500.0]
    data:
    - [-2.58737429, 0.0645817609, -9.35063844e-05, 7.97943354e-08, -2.77400895e-11,
      3.00355619e+04, 30.9448125]
    - [4.0165258, 0.0268451889, -1.26423017e-05, 2.78092329e-09, -2.35299432e-13,
      2.91110159e+04, 1.44025771]
  transport:
    model: gas
    geometry: linear
    diameter: 5.200000000000001
    well-depth: 408.0
    rotational-relaxation: 1.0
- name: NC5H11
  composition: {C: 5, H: 11}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1800.0, 3500.0]
    data:
    - [-3.57520449, 0.0608933039, -3.60055276e-05, 1.07428812e-08, -1.3008857e-12,
      2051.7005, 47.9797395]
    - [6.93193785, 0.0375440987, -1.65478566e-05, 3.53633643e-09, -2.99976701e-13,
      -1730.87074, -8.88710672]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.640000000000001
    well-depth: 392.0
    rotational-relaxation: 1.0
- name: NC5H10
  composition: {C: 5, H: 10}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1800.0, 3500.0]
    data:
    - [-0.689551964, 0.0546638348, -3.33910611e-05, 1.03751453e-08, -1.30620882e-12,
      -5970.63504, 30.3853541]
    - [11.1929736, 0.0282582223, -1.13863841e-05, 2.22526491e-09, -1.74280993e-13,
      -1.02483443e+04, -33.9253533]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.200000000000001
    well-depth: 408.0
    rotational-relaxation: 1.0
- name: CYC6H10
  composition: {C: 6, H: 10}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1800.0, 3500.0]
    data:
    - [-6.01517655, 0.0746974737, -4.97438791e-05, 1.64210093e-08, -2.15243611e-12,
      -1675.89399, 52.1114707]
    - [15.1624858, 0.0276360017, -1.05259858e-05, 1.89586361e-09, -1.35054773e-13,
      -9299.85245, -62.5064559]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.23
    well-depth: 468.5
    polarizability: 10.300000000000002
    rotational-relaxation: 1.0
- name: NC7H15
  composition: {C: 7, H: 15}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1800.0, 3500.0]
    data:
    - [-1.03213606, 0.080898377, -4.96873411e-05, 1.54242764e-08, -1.93065725e-12,
      -2242.54435, 38.1680705]
    - [15.8938298, 0.0432851195, -1.83429598e-05, 3.81524632e-09, -3.18291961e-13,
      -8335.89206, -53.4387877]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 6.31
    well-depth: 459.98
    rotational-relaxation: 1.0
- name: NC7H14
  composition: {C: 7, H: 14}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1800.0, 3500.0]
    data:
    - [-1.22797309, 0.0792825302, -4.98360912e-05, 1.58931983e-08, -2.04231877e-12,
      -1.17316124e+04, 36.2789089]
    - [18.2668105, 0.0359607889, -1.37346402e-05, 2.52229049e-09, -1.8524824e-13,
      -1.87497345e+04, -69.2309266]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 6.31
    well-depth: 459.98
    rotational-relaxation: 1.0
- name: RCRESOLO
  composition: {C: 7, H: 7, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1150.0, 3500.0]
    data:
    - [-6.60757189, 0.0915233042, -9.24834753e-05, 5.05720227e-08, -1.09413374e-11,
      482.664709, 56.2014116]
    - [12.7824814, 0.0240796407, -4.51347945e-06, -4.25076337e-10, 1.44988489e-13,
      -3977.04754, -40.0543783]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.640000000000001
    well-depth: 621.1
    rotational-relaxation: 1.0
- name: XYLENE
  composition: {C: 8, H: 10}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1800.0, 3500.0]
    data:
    - [-3.92128796, 0.0769196357, -5.10898211e-05, 1.71261893e-08, -2.29068282e-12,
      315.918887, 43.9545364]
    - [20.0142025, 0.023729657, -6.76483884e-06, 7.09529215e-10, -1.05911394e-14,
      -8300.85767, -85.5893311]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.96
    well-depth: 523.6
    rotational-relaxation: 1.0
- name: RXYLENE
  composition: {C: 8, H: 9}
  thermo:
    model: NASA7
    temperature-ranges: [200.0, 1620.0, 3500.0]
    data:
    - [-3.85447699, 0.0815484138, -6.1287436e-05, 2.33011616e-08, -3.51034102e-12,
      1.98514059e+04, 42.0634392]
    - [20.4972497, 0.0214206934, -5.61362086e-06, 3.90126528e-10, 2.53125355e-14,
      1.19614465e+04, -87.1674754]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.96
    well-depth: 523.6
    rotational-relaxation: 1.0
- name: RMCYC6
  composition: {C: 7, H: 13}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1800.0, 3500.0]
    data:
    - [-9.95790329, 0.0991745477, -6.63714701e-05, 2.18705768e-08, -2.85297798e-12,
      3925.47162, 74.3253244]
    - [17.3339062, 0.0385260822, -1.58310821e-05, 3.15191459e-09, -2.53163787e-13,
      -5899.5798, -73.383642]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.68
    well-depth: 495.30000000000007
    dipole: 0.4300001227206934
    polarizability: 12.300000000000002
    rotational-relaxation: 1.0
- name: MCYC6
  composition: {C: 7, H: 14}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1800.0, 3500.0]
    data:
    - [-10.1006358, 0.10321827, -6.84441744e-05, 2.23157154e-08, -2.88158149e-12,
      -1.95313967e+04, 71.0947481]
    - [16.7194568, 0.0436180644, -1.87773363e-05, 3.92059022e-09, -3.26702983e-13,
      -2.918663e+04, -74.0611878]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.68
    well-depth: 495.30000000000007
    dipole: 0.4300001227206934
    polarizability: 12.300000000000002
    rotational-relaxation: 1.0
- name: NC10H21
  composition: {C: 10, H: 21}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1800.0, 3500.0]
    data:
    - [-1.81057271, 0.117737178, -7.42226562e-05, 2.3629805e-08, -3.02215208e-12,
      -1.0890054e+04, 49.0624204]
    - [26.3212692, 0.0552219738, -2.21266526e-05, 4.33498891e-09, -3.42316503e-13,
      -2.10175171e+04, -103.192977]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 7.15
    well-depth: 540.98
    rotational-relaxation: 1.0
- name: NC12H25
  composition: {C: 12, H: 25}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1800.0, 3500.0]
    data:
    - [-2.06085145, 0.141179787, -8.91506513e-05, 2.83740186e-08, -3.62710595e-12,
      -1.66984825e+04, 51.116166]
    - [31.7005579, 0.0661544325, -2.6629523e-05, 5.21804509e-09, -4.10998518e-13,
      -2.88525898e+04, -131.607624]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 7.6
    well-depth: 580.0
    rotational-relaxation: 1.0
- name: NC10H19
  composition: {C: 10, H: 19}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1800.0, 3500.0]
    data:
    - [-0.961360662, 0.0527258341, -3.24481586e-05, 1.00208317e-08, -1.24754133e-12,
      1.10460408e+04, 30.5532839]
    - [9.8828739, 0.028627535, -1.23662428e-05, 2.58308509e-09, -2.14520963e-13,
      7142.11639, -28.1379758]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 7.15
    well-depth: 540.98
    rotational-relaxation: 1.0
- name: NC12H26
  composition: {C: 12, H: 26}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1800.0, 3500.0]
    data:
    - [-2.66627705, 0.147343892, -9.43301934e-05, 3.05488933e-08, -3.97016449e-12,
      -4.00651514e+04, 53.203335]
    - [36.1414095, 0.0611045883, -2.24641073e-05, 3.9318244e-09, -2.73349362e-13,
      -5.40359186e+04, -156.83196]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 7.6
    well-depth: 580.0
    rotational-relaxation: 1.0
- name: NC10H20
  composition: {C: 10, H: 20}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1800.0, 3500.0]
    data:
    - [-2.3141771, 0.11697313, -7.49614029e-05, 2.42311952e-08, -3.14284562e-12,
      -2.023337e+04, 48.8909878]
    - [28.2971791, 0.0489478938, -1.82737062e-05, 3.23575201e-09, -2.26811843e-13,
      -3.12534582e+04, -116.784058]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 7.15
    well-depth: 540.98
    rotational-relaxation: 1.0
- name: C7H7(L1)
  composition: {C: 7, H: 7}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [-3.238063774, 0.06967253823, -5.385155011e-05, 2.085027871e-08, -3.184369195e-12,
      2.359304827e+04, 38.4624967]
    - [16.94431861, 0.01837297402, -5.286971076e-06, 5.048283766e-10, 3.791066492e-15,
      1.730383421e+04, -67.9676737]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.68
    well-depth: 495.30000000000007
    rotational-relaxation: 1.0
- name: C4H8(L1)
  composition: {C: 4, H: 8}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [-0.6914898865, 0.044446009, -2.78211951e-05, 8.866134389e-09, -1.14115556e-12,
      -1596.681841, 28.8948525]
    - [9.20632141, 0.02151036161, -8.182775312e-06, 1.469771518e-09, -1.036437396e-13,
      -4947.750275, -24.17091318]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 5.089
    well-depth: 344.5
    dipole: 0.5000001426984807
    rotational-relaxation: 1.0
- name: CH3O(L1)
  composition: {C: 1, H: 3, O: 1}
  thermo:
    model: NASA7
    temperature-ranges: [300.0, 1000.0, 5000.0]
    data:
    - [0.8896611586, 0.01701197634, -1.138073494e-05, 3.882809368e-09, -5.328415116e-13,
      1603.16063, 18.50011467]
    - [5.342718035, 6.431165838e-03, -2.067242046e-06, 2.694926582e-10,
      -9.942873055e-15, 128.482016, -5.269049714]
  transport:
    model: gas
    geometry: nonlinear
    diameter: 3.6900000000000004
    well-depth: 417.0
    dipole: 1.7000004851748343
    rotational-relaxation: 2.0

reactions:
- equation: 'NC12H26 + 18.5 O2 => 12.0 CO2 + 13.0 H2O '  # Reaction 1
  rate-constant: {A: 0.0, b: 0.0, Ea: 0.0}
  
reactions_skeletal:
- equation: H2 + O <=> H + OH  # Reaction 2
  rate-constant: {A: 5.08e+04, b: 2.67, Ea: 6292.0}
- equation: H2 + OH <=> H + H2O  # Reaction 3
  rate-constant: {A: 4.38e+13, b: 0.0, Ea: 6990.0}
- equation: H + O2 <=> O + OH  # Reaction 4
  rate-constant: {A: 1.14e+14, b: 0.0, Ea: 1.5286e+04}
- equation: H + OH + M <=> H2O + M  # Reaction 5
  type: three-body
  rate-constant: {A: 3.5e+22, b: -2.0, Ea: 0.0}
  efficiencies: {C2H6: 3.0, CH4: 2.0, H2: 0.73, H2O: 3.65}
- equation: H2O + O <=> 2 OH  # Reaction 6
  rate-constant: {A: 6.7e+07, b: 1.704, Ea: 1.49868e+04}
- equation: H2O2 (+M) <=> 2 OH (+M)  # Reaction 7
  type: falloff
  low-P-rate-constant: {A: 2.49e+24, b: -2.3, Ea: 4.8749e+04}
  high-P-rate-constant: {A: 2.0e+12, b: 0.9, Ea: 4.8749e+04}
  Troe: {A: 0.43, T3: 1.0e-30, T1: 1.0000000000000002e+30, T2: 0.0}
  efficiencies: {CO: 2.8, CO2: 1.6, H2: 3.7, H2O: 7.65, H2O2: 7.7, N2: 1.5,
    O2: 1.2}
- equation: H + H2O2 <=> H2O + OH  # Reaction 8
  rate-constant: {A: 2.41e+13, b: 0.0, Ea: 3970.0}
- equation: H + H2O2 <=> H2 + HO2  # Reaction 9
  rate-constant: {A: 2.15e+10, b: 1.0, Ea: 6000.0}
- equation: H2O2 + OH <=> H2O + HO2  # Reaction 10
  rate-constant: {A: 1.74e+12, b: 0.0, Ea: 318.0}
  duplicate: true
- equation: H2O2 + OH <=> H2O + HO2  # Reaction 11
  rate-constant: {A: 7.59e+13, b: 0.0, Ea: 7269.0}
  duplicate: true
- equation: H + HO2 <=> 2 OH  # Reaction 12
  rate-constant: {A: 7.079e+13, b: 0.0, Ea: 295.0}
- equation: H + HO2 <=> H2 + O2  # Reaction 13
  rate-constant: {A: 1.1402e+10, b: 1.083, Ea: 553.78}
- equation: HO2 + O <=> O2 + OH  # Reaction 14
  rate-constant: {A: 3.25e+13, b: 0.0, Ea: 0.0}
- equation: HO2 + OH <=> H2O + O2  # Reaction 15
  rate-constant: {A: 7.0e+12, b: 0.0, Ea: -1092.96}
  duplicate: true
- equation: HO2 + OH <=> H2O + O2  # Reaction 16
  rate-constant: {A: 4.5e+14, b: 0.0, Ea: 1.09296e+04}
  duplicate: true
- equation: 2 HO2 <=> H2O2 + O2  # Reaction 17
  rate-constant: {A: 1.0e+14, b: 0.0, Ea: 1.104088e+04}
  duplicate: true
- equation: 2 HO2 <=> H2O2 + O2  # Reaction 18
  rate-constant: {A: 1.9e+11, b: 0.0, Ea: -1408.92}
  duplicate: true
- equation: H + O2 (+M) <=> HO2 (+M)  # Reaction 19
  type: falloff
  low-P-rate-constant: {A: 1.74e+19, b: -1.23, Ea: 0.0}
  high-P-rate-constant: {A: 4.65e+12, b: 0.44, Ea: 0.0}
  Troe: {A: 0.67, T3: 1.0e-30, T1: 1.0000000000000002e+30, T2: 1.0e+30}
  efficiencies: {C2H6: 3.0, CH4: 2.0, CO: 1.9, CO2: 3.8, H2: 1.3, H2O: 10.0}
- equation: CO + O (+M) <=> CO2 (+M)  # Reaction 20
  type: falloff
  low-P-rate-constant: {A: 1.17e+24, b: -2.79, Ea: 4191.0}
  high-P-rate-constant: {A: 1.362e+10, b: 0.0, Ea: 2384.0}
  efficiencies: {CO: 1.75, CO2: 3.6, H2: 2.0, H2O: 12.0}
- equation: CO + OH <=> CO2 + H  # Reaction 21
  rate-constant: {A: 7.015e+04, b: 2.053, Ea: -355.7}
  duplicate: true
- equation: CO + OH <=> CO2 + H  # Reaction 22
  rate-constant: {A: 5.757e+12, b: -0.664, Ea: 331.8}
  duplicate: true
- equation: CH3 + H (+M) <=> CH4 (+M)  # Reaction 23
  type: falloff
  low-P-rate-constant: {A: 2.48e+33, b: -4.76, Ea: 2440.0}
  high-P-rate-constant: {A: 1.27e+16, b: -0.63, Ea: 383.0}
  Troe: {A: 0.783, T3: 74.0, T1: 2941.0, T2: 6964.0}
  efficiencies: {C2H6: 3.0, CH4: 2.0, CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: CH4 + H <=> CH3 + H2  # Reaction 24
  rate-constant: {A: 6.14e+05, b: 2.5, Ea: 9587.0}
- equation: CH4 + O <=> CH3 + OH  # Reaction 25
  rate-constant: {A: 1.02e+09, b: 1.5, Ea: 8600.0}
- equation: CH4 + OH <=> CH3 + H2O  # Reaction 26
  rate-constant: {A: 5.83e+04, b: 2.6, Ea: 2190.0}
- equation: CH4 + HO2 <=> CH3 + H2O2  # Reaction 27
  rate-constant: {A: 11.3, b: 3.74, Ea: 2.101e+04}
- equation: CH3 + HO2 <=> CH4 + O2  # Reaction 28
  rate-constant: {A: 1.16e+05, b: 2.23, Ea: -3022.0}
- equation: CH2(S) + O2 => CO + H + OH  # Reaction 29
  rate-constant: {A: 2.8e+13, b: 0.0, Ea: 0.0}
- equation: CH2(S) + O2 <=> CO + H2O  # Reaction 30
  rate-constant: {A: 1.2e+13, b: 0.0, Ea: 0.0}
- equation: CH2(S) + H2 <=> CH3 + H  # Reaction 31
  rate-constant: {A: 7.0e+13, b: 0.0, Ea: 0.0}
- equation: CH3 + O2 <=> CH2O + OH  # Reaction 32
  rate-constant: {A: 2.641, b: 3.283, Ea: 8105.0}
- equation: CH3 + O <=> CH2O + H  # Reaction 33
  rate-constant: {A: 5.54e+13, b: 0.05, Ea: -136.0}
- equation: CH3 + OH <=> CH2(S) + H2O  # Reaction 34
  rate-constant: {A: 5.282e+17, b: -1.518, Ea: 1772.0}
- equation: CH3 + OH <=> CH3O(L1) + H  # Reaction 35
  rate-constant: {A: 4.686e+10, b: 0.833, Ea: 3566.0}
- equation: CH3 + OH <=> CH3O(L1) + H  # Reaction 36
  rate-constant: {A: 1.23e+09, b: 1.011, Ea: 1.195e+04}
- equation: CH3 + HO2 <=> CH3O(L1) + OH  # Reaction 37
  rate-constant: {A: 1.0e+12, b: 0.269, Ea: -687.5}
- equation: CH3O(L1) + O2 <=> CH2O + HO2  # Reaction 38
  rate-constant: {A: 4.308104e+23, b: -2.343044, Ea: 1.997413e+04}
  duplicate: true
- equation: CH3O(L1) + O2 <=> CH2O + HO2  # Reaction 39
  rate-constant: {A: 2.45922e-08, b: 6.219929, Ea: -1183.794}
- equation: CH3 + CH3O(L1) <=> CH2O + CH4  # Reaction 40
  rate-constant: {A: 6.73759e+23, b: -3.280071, Ea: 4317.206}
- equation: CH2O + O <=> HCO + OH  # Reaction 41
  rate-constant: {A: 6.26e+09, b: 1.15, Ea: 2260.0}
- equation: CH2O + H <=> H2 + HCO  # Reaction 42
  rate-constant: {A: 5.74e+07, b: 1.9, Ea: 2740.0}
- equation: CH2O + OH <=> H2O + HCO  # Reaction 43
  rate-constant: {A: 7.82e+07, b: 1.63, Ea: -1055.0}
- equation: CH2O + HO2 <=> H2O2 + HCO  # Reaction 44
  rate-constant: {A: 1.88e+04, b: 2.7, Ea: 1.152e+04}
- equation: CH2O + CH3 <=> CH4 + HCO  # Reaction 45
  rate-constant: {A: 38.3, b: 3.36, Ea: 4312.0}
- equation: HCO + M <=> CO + H + M  # Reaction 46
  type: three-body
  rate-constant: {A: 5.7e+11, b: 0.66, Ea: 1.487e+04}
  efficiencies: {C2H6: 3.0, CH4: 2.0, CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: HCO + O2 <=> CO + HO2  # Reaction 47
  rate-constant: {A: 7.58e+12, b: 0.0, Ea: 410.0}
- equation: H + HCO <=> CO + H2  # Reaction 48
  rate-constant: {A: 7.34e+13, b: 0.0, Ea: 0.0}
- equation: HCO + OH <=> CO + H2O  # Reaction 49
  rate-constant: {A: 3.011e+13, b: 0.0, Ea: 0.0}
- equation: CH3 + HCO <=> CH4 + CO  # Reaction 50
  rate-constant: {A: 2.65e+13, b: 0.0, Ea: 0.0}
- equation: HCO + HO2 => CO2 + H + OH  # Reaction 51
  rate-constant: {A: 3.0e+13, b: 0.0, Ea: 0.0}
- equation: CH2O + H (+M) <=> CH3O(L1) (+M)  # Reaction 52
  type: falloff
  low-P-rate-constant: {A: 1.27e+32, b: -4.82, Ea: 6530.0}
  high-P-rate-constant: {A: 5.4e+11, b: 0.454, Ea: 3600.0}
  Troe: {A: 0.7187, T3: 103.00000000000001, T1: 1291.0, T2: 4160.0}
  efficiencies: {C2H6: 3.0, CH4: 2.0, CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: CH3O(L1) (+M) <=> CH2O + H (+M)  # Reaction 53
  type: falloff
  low-P-rate-constant: {A: 1.049941e+36, b: -6.280071, Ea: 2.862421e+04}
  high-P-rate-constant: {A: 3.817968e+24, b: -3.280071, Ea: 3.048721e+04}
  Troe: {A: 0.9, T3: 2500.0, T1: 1300.0, T2: 1.0e+99}
  efficiencies: {C2H6: 3.0, CH4: 2.0, CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: 2 CH3 (+M) <=> C2H6 (+M)  # Reaction 54
  type: falloff
  low-P-rate-constant: {A: 8.05e+31, b: -3.75, Ea: 981.6}
  high-P-rate-constant: {A: 2.277e+15, b: -0.69, Ea: 174.9}
  Troe: {A: 0.0, T3: 570.0, T1: 1.0000000000000002e+30, T2: 1.0e+30}
  efficiencies: {CO: 2.0, CO2: 3.0, H2O: 5.0}
- equation: C2H5 + H (+M) <=> C2H6 (+M)  # Reaction 55
  type: falloff
  low-P-rate-constant: {A: 1.99e+41, b: -7.08, Ea: 6685.0}
  high-P-rate-constant: {A: 5.21e+17, b: -0.99, Ea: 1580.0}
  Troe: {A: 0.842, T3: 125.0, T1: 2219.0, T2: 6882.0}
  efficiencies: {C2H6: 3.0, CH4: 2.0, CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: C2H6 + O <=> C2H5 + OH  # Reaction 56
  rate-constant: {A: 3.55e+06, b: 2.4, Ea: 5830.0}
- equation: C2H6 + H <=> C2H5 + H2  # Reaction 57
  rate-constant: {A: 1.15e+08, b: 1.9, Ea: 7530.0}
- equation: C2H6 + OH <=> C2H5 + H2O  # Reaction 58
  rate-constant: {A: 1.48e+07, b: 1.9, Ea: 950.0}
- equation: C2H6 + CH3 <=> C2H5 + CH4  # Reaction 59
  rate-constant: {A: 5.55e-04, b: 4.72, Ea: 3231.0}
- equation: C2H4 + H (+M) <=> C2H5 (+M)  # Reaction 60
  type: falloff
  low-P-rate-constant: {A: 1.42e+39, b: -6.642, Ea: 5769.0}
  high-P-rate-constant: {A: 9.569e+08, b: 1.463, Ea: 1355.0}
  Troe: {A: -0.569, T3: 299.0, T1: -9147.0, T2: 152.4}
  efficiencies: {C2H6: 3.0, CH4: 2.0, CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: C2H5 + H <=> C2H4 + H2  # Reaction 61
  rate-constant: {A: 2.0e+12, b: 0.0, Ea: 0.0}
- equation: C2H5 + CH3 <=> C2H4 + CH4  # Reaction 62
  rate-constant: {A: 1.18e+04, b: 2.45, Ea: -2921.0}
- equation: 2 CH3 <=> C2H5 + H  # Reaction 63
  rate-constant: {A: 3.1e+14, b: -0.362, Ea: 1.33725e+04}
- equation: C2H5 + O2 <=> C2H4 + HO2  # Reaction 64
  rate-constant: {A: 1.843e+07, b: 1.13, Ea: -720.6}
- equation: C2H3 + H (+M) <=> C2H4 (+M)  # Reaction 65
  type: falloff
  low-P-rate-constant: {A: 1.4e+30, b: -3.86, Ea: 3320.0}
  high-P-rate-constant: {A: 6.08e+12, b: 0.27, Ea: 280.0}
  Troe: {A: 0.782, T3: 207.49999999999997, T1: 2663.0, T2: 6095.0}
  efficiencies: {C2H6: 3.0, CH4: 2.0, CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: C2H4 + M <=> C2H2 + H2 + M  # Reaction 66
  type: three-body
  rate-constant: {A: 2.61e+16, b: 0.0, Ea: 6.7823e+04}
  efficiencies: {C2H6: 3.0, CH4: 2.0, CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: C2H4 + H <=> C2H3 + H2  # Reaction 67
  rate-constant: {A: 5.07e+07, b: 1.93, Ea: 1.295e+04}
- equation: C2H4 + OH <=> C2H3 + H2O  # Reaction 68
  rate-constant: {A: 2.23e+04, b: 2.745, Ea: 2215.5}
- equation: C2H4 + CH3 <=> C2H3 + CH4  # Reaction 69
  rate-constant: {A: 976.0, b: 2.947, Ea: 1.5148e+04}
  duplicate: true
- equation: C2H4 + O <=> CH3 + HCO  # Reaction 70
  rate-constant: {A: 7.453e+06, b: 1.88, Ea: 183.0}
- equation: C2H4 + O <=> CH2CHO + H  # Reaction 71
  rate-constant: {A: 6.098e+06, b: 1.88, Ea: 183.0}
- equation: C2H2 + H (+M) <=> C2H3 (+M)  # Reaction 72
  type: falloff
  low-P-rate-constant: {A: 6.35e+31, b: -4.664, Ea: 3780.0}
  high-P-rate-constant: {A: 1.71e+10, b: 1.266, Ea: 2709.0}
  Troe: {A: 0.788, T3: -1.02e+04, T1: 1.0e-30, T2: 0.0}
  efficiencies: {C2H6: 3.0, CH4: 2.0, CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: C2H3 + O2 <=> CH2CHO + O  # Reaction 73
  rate-constant: {A: 7.1e+20, b: -2.65, Ea: 6489.0}
  duplicate: true
- equation: C2H3 + O2 <=> CH2CHO + O  # Reaction 74
  rate-constant: {A: 2.02e+10, b: 0.58, Ea: 38.4}
  duplicate: true
- equation: C2H3 + O2 <=> C2H2 + HO2  # Reaction 75
  rate-constant: {A: 2.15e+07, b: 1.19, Ea: 3367.0}
  duplicate: true
- equation: C2H3 + O2 <=> C2H2 + HO2  # Reaction 76
  rate-constant: {A: 46.0, b: 2.76, Ea: -492.8}
  duplicate: true
- equation: C2H3 + O2 <=> CH2O + HCO  # Reaction 77
  rate-constant: {A: 2.73e+35, b: -7.32, Ea: 1.182e+04}
  duplicate: true
- equation: C2H3 + O2 <=> CH2O + HCO  # Reaction 78
  rate-constant: {A: 6.08e+15, b: -1.31, Ea: 645.7}
  duplicate: true
- equation: C2H3 + O2 => CH2O + CO + H  # Reaction 79
  rate-constant: {A: 6.36e+35, b: -7.32, Ea: 1.182e+04}
  duplicate: true
- equation: C2H3 + O2 => CH2O + CO + H  # Reaction 80
  rate-constant: {A: 1.42e+16, b: -1.31, Ea: 645.7}
  duplicate: true
- equation: C2H3 + H <=> C2H2 + H2  # Reaction 81
  rate-constant: {A: 9.6353e+13, b: 0.0, Ea: 0.0}
- equation: C2H3 + OH <=> C2H2 + H2O  # Reaction 82
  rate-constant: {A: 3.011e+13, b: 0.0, Ea: 0.0}
- equation: C2H2 + O <=> H + HCCO  # Reaction 83
  rate-constant: {A: 2.958e+09, b: 1.28, Ea: 2472.0}
- equation: C2H2 + HCO <=> C2H3 + CO  # Reaction 84
  rate-constant: {A: 1.0e+07, b: 2.0, Ea: 6000.0}
- equation: C2H + O2 <=> CO + HCO  # Reaction 85
  rate-constant: {A: 5.0e+13, b: 0.0, Ea: 1500.0}
- equation: C2H + H2 <=> C2H2 + H  # Reaction 86
  rate-constant: {A: 4.9e+05, b: 2.5, Ea: 560.0}
- equation: CH2CHO (+M) <=> CH3 + CO (+M)  # Reaction 87
  type: falloff
  low-P-rate-constant: {A: 9.52e+33, b: -5.07, Ea: 4.13e+04}
  high-P-rate-constant: {A: 2.93e+12, b: 0.29, Ea: 4.03e+04}
  Troe: {A: 7.13e-17, T3: 1150.0, T1: 4.99e+09, T2: 1.79e+09}
- equation: HCCO + OH => 2 CO + H2  # Reaction 88
  rate-constant: {A: 1.0e+14, b: 0.0, Ea: 0.0}
- equation: H + HCCO <=> CH2(S) + CO  # Reaction 89
  rate-constant: {A: 1.0e+14, b: 0.0, Ea: 0.0}
- equation: HCCO + O2 => CO + CO2 + H  # Reaction 90
  rate-constant: {A: 4.78e+12, b: -0.142, Ea: 1150.0}
- equation: HO2 + NC3H7 => C2H5 + CH2O + OH  # Reaction 91
  rate-constant: {A: 7.0e+12, b: 0.0, Ea: -1000.0}
- equation: C2H3 + CH3 (+M) <=> C3H6 (+M)  # Reaction 92
  type: falloff
  low-P-rate-constant: {A: 4.27e+58, b: -11.94, Ea: 9769.8}
  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}
- equation: C2H3 + CH3 <=> C3H5-A + H  # Reaction 93
  rate-constant: {A: 5.3e+29, b: -4.57, Ea: 1.44e+04}
  duplicate: true
- equation: C2H3 + CH3 <=> C3H5-A + H  # Reaction 94
  rate-constant: {A: 4.48e+10, b: 0.6, Ea: 1421.6}
  duplicate: true
- equation: C3H6 <=> C3H5-A + H  # Reaction 95
  rate-constant: {A: 1.08e+71, b: -15.9, Ea: 1.2486e+05}
  duplicate: true
- equation: C3H6 <=> C3H5-A + H  # Reaction 96
  rate-constant: {A: 6.28e+42, b: -8.51, Ea: 9.8004e+04}
  duplicate: true
- equation: C3H6 + H <=> C3H5-A + H2  # Reaction 97
  rate-constant: {A: 3.644e+05, b: 2.455, Ea: 4361.2}
- equation: C3H6 + O2 <=> C3H5-A + HO2  # Reaction 98
  rate-constant: {A: 1.2e+20, b: -1.67, Ea: 4.61921e+04}
- equation: C3H6 + O <=> C3H5-A + OH  # Reaction 99
  rate-constant: {A: 5.24e+11, b: 0.7, Ea: 5884.0}
- equation: C3H6 + OH <=> C3H5-A + H2O  # Reaction 100
  rate-constant: {A: 4.46e+06, b: 2.072, Ea: 1050.8}
- equation: C3H6 + HO2 <=> C3H5-A + H2O2  # Reaction 101
  rate-constant: {A: 0.0307, b: 4.403, Ea: 1.35472e+04}
- equation: C3H6 + CH3 <=> C3H5-A + CH4  # Reaction 102
  rate-constant: {A: 2.21, b: 3.5, Ea: 5675.0}
- equation: C3H6 + O <=> C2H5 + HCO  # Reaction 103
  rate-constant: {A: 7.45e+06, b: 1.88, Ea: 183.0}
- equation: C3H6 + H <=> NC3H7  # Reaction 104
  rate-constant: {A: 1.04e+49, b: -11.5, Ea: 1.5359e+04}
  duplicate: true
- equation: C3H6 + H <=> NC3H7  # Reaction 105
  rate-constant: {A: 3.78e+28, b: -5.57, Ea: 5625.1}
  duplicate: true
- equation: C2H4 + CH3 <=> NC3H7  # Reaction 106
  rate-constant: {A: 7.67e+47, b: -11.17, Ea: 2.2366e+04}
  duplicate: true
- equation: C2H4 + CH3 <=> NC3H7  # Reaction 107
  rate-constant: {A: 2.6e+33, b: -7.46, Ea: 1.2416e+04}
  duplicate: true
- equation: C2H5 + C3H5-A <=> C2H4 + C3H6  # Reaction 108
  rate-constant: {A: 4.0e+11, b: 0.0, Ea: 0.0}
- equation: C3H5-A + HO2 <=> C3H5O + OH  # Reaction 109
  rate-constant: {A: 7.77e+17, b: -1.52, Ea: 2379.2}
- equation: C3H5O <=> C2H3 + CH2O  # Reaction 110
  rate-constant: {A: 1.07e+26, b: -4.56, Ea: 2.46229e+04}
- equation: C3H5O <=> C2H3CHO + H  # Reaction 111
  rate-constant: {A: 1.15e+25, b: -4.24, Ea: 2.03112e+04}
- equation: C3H5O <=> C2H4 + HCO  # Reaction 112
  rate-constant: {A: 1.07e+24, b: -4.16, Ea: 1.8985e+04}
- equation: NC3H7 + O2 <=> C3H6 + HO2  # Reaction 113
  rate-constant: {A: 5.0e+11, b: 0.0, Ea: 3000.0}
- equation: O2 + PC4H9 <=> C4H8(L1) + HO2  # Reaction 114
  rate-constant: {A: 5.0e+11, b: 0.0, Ea: 3000.0}
- equation: C3H5-A + CH3 (+M) <=> C4H8(L1) (+M)  # Reaction 115
  type: falloff
  low-P-rate-constant: {A: 3.91e+60, b: -12.81, Ea: 6250.0}
  high-P-rate-constant: {A: 6.0e+14, b: -0.32, Ea: -262.3}
  Troe: {A: 0.104, T3: 1606.0, T1: 6.0e+04, T2: 6118.0}
  efficiencies: {C2H6: 3.0, CH4: 2.0, CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: C4H71-3 + H <=> C4H8(L1)  # Reaction 116
  rate-constant: {A: 5.0e+13, b: 0.0, Ea: 5000.0}
- equation: C4H8(L1) + OH <=> C4H71-3 + H2O  # Reaction 117
  rate-constant: {A: 5.116824e+08, b: 1.341177, Ea: 694.6017}
- equation: C4H8(L1) + OH <=> C4H71-4 + H2O  # Reaction 118
  rate-constant: {A: 5.664138e+09, b: 1.171177, Ea: 3754.882}
- equation: C4H8(L1) + HO2 <=> C4H71-3 + H2O2  # Reaction 119
  rate-constant: {A: 515.0413, b: 3.111177, Ea: 1.283378e+04}
- equation: C4H8(L1) + HO2 <=> C4H71-4 + H2O2  # Reaction 120
  rate-constant: {A: 2.687172e+04, b: 2.731177, Ea: 1.829178e+04}
- equation: C4H8(L1) + O <=> C4H71-3 + OH  # Reaction 121
  rate-constant: {A: 1.152586e+14, b: -0.1588232, Ea: 7015.782}
- equation: C4H8(L1) + O <=> C4H71-4 + OH  # Reaction 122
  rate-constant: {A: 7.442413e+16, b: -0.8588232, Ea: 8981.782}
- equation: C4H8(L1) + O2 <=> C4H71-3 + HO2  # Reaction 123
  rate-constant: {A: 6.586207e+16, b: -0.8588232, Ea: 3.832178e+04}
- equation: C4H71-3 + CH3O(L1) <=> C4H8(L1) + CH2O  # Reaction 124
  rate-constant: {A: 1.353133e+24, b: -3.280071, Ea: 4317.206}
- equation: C4H71-3 <=> C4H6 + H  # Reaction 125
  rate-constant: {A: 8.53e+07, b: 1.95, Ea: 4.749011e+04}
- equation: C4H71-4 <=> C2H3 + C2H4  # Reaction 126
  rate-constant: {A: 2.84e+10, b: 0.99, Ea: 3.89988e+04}
- equation: C4H71-4 <=> C4H6 + H  # Reaction 127
  rate-constant: {A: 1.32e+05, b: 2.28, Ea: 3.324586e+04}
- equation: C4H71-3 <=> C4H71-4  # Reaction 128
  rate-constant: {A: 5.62e-12, b: 7.19, Ea: 3.620082e+04}
- equation: C4H71-3 + O <=> C2H3CHO + CH3  # Reaction 129
  rate-constant: {A: 6.03e+13, b: 0.0, Ea: 0.0}
- equation: C4H8(L1) + H <=> C2H4 + C2H5  # Reaction 130
  rate-constant: {A: 9.47e+16, b: -1.03, Ea: 1.3413e+04}
  duplicate: true
- equation: C4H8(L1) + H <=> C2H4 + C2H5  # Reaction 131
  rate-constant: {A: 6.02e+15, b: -0.49, Ea: 8452.0}
  duplicate: true
- equation: C4H8(L1) + H <=> PC4H9  # Reaction 132
  rate-constant: {A: 1.9e+31, b: -6.46, Ea: 1.1968e+04}
  duplicate: true
- equation: C4H8(L1) + H <=> PC4H9  # Reaction 133
  rate-constant: {A: 3.78e+32, b: -6.63, Ea: 7265.0}
  duplicate: true
- equation: PC4H9 <=> C2H4 + C2H5  # Reaction 134
  rate-constant: {A: 7.47e+43, b: -9.67, Ea: 3.8722e+04}
- equation: PC4H9 <=> C3H6 + CH3  # Reaction 135
  rate-constant: {A: 2.05e+42, b: -9.61, Ea: 4.6415e+04}
- equation: C4H8(L1) + O <=> HCO + NC3H7  # Reaction 136
  rate-constant: {A: 4.906724e+09, b: 1.021177, Ea: 1314.782}
- equation: C4H8(L1) <=> C4H6 + H2  # Reaction 137
  rate-constant: {A: 1.975862e+16, b: -0.8588232, Ea: 7.113178e+04}
- equation: C4H6 + H <=> C2H3 + C2H4  # Reaction 138
  rate-constant: {A: 6.48e+32, b: -4.91, Ea: 2.6478e+04}
- equation: C4H6 + OH <=> C2H3CHO + CH3  # Reaction 139
  rate-constant: {A: 1.37e+12, b: 0.0, Ea: -1040.0}
- equation: C4H6 + OH <=> C3H5-A + CH2O  # Reaction 140
  rate-constant: {A: 1.37e+12, b: 0.0, Ea: -1040.0}
- equation: HCCO + O2 <=> CO2 + HCO  # Reaction 141
  rate-constant: {A: 2.4e+11, b: 0.0, Ea: -854.0}
- equation: C2H + O2 <=> HCCO + O  # Reaction 142
  rate-constant: {A: 2.3e+13, b: 0.0, Ea: 0.0}
- equation: C2H3CHO + OH => C2H4 + CO2 + H  # Reaction 143
  rate-constant: {A: 5.0e+12, b: 0.0, Ea: 0.0}
- equation: C2H4 + HCO => 0.2 C2H3CHO + 0.8 C2H5 + 0.8 CO + 0.2 H  # Reaction 144
  rate-constant: {A: 7.0e+11, b: 0.0, Ea: 6000.0}
- equation: C4H6 + O2 => C2H3CHO + CH2O  # Reaction 145
  rate-constant: {A: 1.0e+14, b: 0.0, Ea: 3.9e+04}
- equation: C2H3CHO + H => C2H4 + HCO  # Reaction 146
  rate-constant: {A: 1.0e+13, b: 0.0, Ea: 5000.0}
- equation: O + OH + M <=> HO2 + M  # Reaction 147
  type: three-body
  rate-constant: {A: 1.0e+16, b: 0.0, Ea: 0.0}
- equation: C2H5 + O2 => CH2O + CH3O(L1)  # Reaction 148
  rate-constant: {A: 1.0e+14, b: 0.0, Ea: 2.4e+04}
- equation: C2H5 + HO2 => CH2O + CH3 + OH  # Reaction 149
  rate-constant: {A: 5.0e+12, b: 0.0, Ea: 0.0}
- equation: CH2(S) + CH4 <=> 2 CH3  # Reaction 150
  rate-constant: {A: 4.3e+13, b: 0.0, Ea: 0.0}
- equation: 2 CH3 => C2H4 + H2  # Reaction 151
  rate-constant: {A: 5.0e+14, b: 0.0, Ea: 3.2e+04}
- equation: C4H6 + CH3 => C2H4 + C3H5-A  # Reaction 152
  rate-constant: {A: 1.0e+11, b: 0.0, Ea: 7600.0}
- equation: C2H2 + C2H5 => C4H71-4  # Reaction 153
  rate-constant: {A: 3.0e+11, b: 0.0, Ea: 7600.0}
- equation: C2H6 <=> C2H4 + H2  # Reaction 154
  rate-constant: {A: 3.0e+13, b: 0.0, Ea: 7.85e+04}
- equation: C2H2 + C2H4 <=> C4H6  # Reaction 155
  rate-constant: {A: 5.0e+10, b: 0.0, Ea: 2.7e+04}
- equation: C3H6 + O => C2H3CHO + 2 H  # Reaction 156
  rate-constant: {A: 1.0e+13, b: 0.0, Ea: 3000.0}
- equation: C4H6 + O => C3H6 + CO  # Reaction 157
  rate-constant: {A: 1.5e+12, b: 0.0, Ea: 0.0}
- equation: CH2O + O => CO2 + 2 H  # Reaction 158
  rate-constant: {A: 2.0e+13, b: 0.0, Ea: 5000.0}
- equation: C2H2 + HO2 => CH2O + HCO  # Reaction 159
  rate-constant: {A: 5.0e+12, b: 0.0, Ea: 1.5e+04}
- equation: C2H4 + O2 => CH3O(L1) + HCO  # Reaction 160
  rate-constant: {A: 1.0e+14, b: 0.0, Ea: 4.3e+04}
- equation: C4H6 + O2 => C2H2 + C2H4 + O2  # Reaction 161
  rate-constant: {A: 4.0e+14, b: 0.0, Ea: 4.0e+04}
- equation: C4H71-3 + O2 => C4H6 + HO2  # Reaction 162
  rate-constant: {A: 3.0e+10, b: 0.0, Ea: 8000.0}
- equation: C4H71-4 + O2 => C4H6 + HO2  # Reaction 163
  rate-constant: {A: 2.0e+12, b: 0.0, Ea: 3500.0}
- equation: CH2CHO + O2 => CH2O + CO + OH  # Reaction 164
  rate-constant: {A: 6.0e+10, b: 0.0, Ea: 0.0}
- equation: C2H3 + O => CH2CHO  # Reaction 165
  rate-constant: {A: 2.5e+13, b: 0.0, Ea: 0.0}
- equation: C3H5-A + O => C2H3 + CH2O  # Reaction 166
  rate-constant: {A: 3.25e+13, b: 0.0, Ea: 0.0}
- equation: CH2CHO + O => CH2O + HCO  # Reaction 167
  rate-constant: {A: 5.0e+13, b: 0.0, Ea: 0.0}
- equation: CH2CHO + OH => CH3O(L1) + HCO  # Reaction 168
  rate-constant: {A: 1.0e+13, b: 0.0, Ea: 0.0}
- equation: C2H2 + OH => CH2CHO  # Reaction 169
  rate-constant: {A: 5.0e+11, b: 0.0, Ea: 0.0}
- equation: C4H6 + O2 => C2H5 + CO + HCO  # Reaction 170
  rate-constant: {A: 5.0e+13, b: 0.0, Ea: 4.1e+04}
- equation: C2H3CHO + OH => C2H3 + CO + H2O  # Reaction 171
  rate-constant: {A: 9.9996e+06, b: 2.0, Ea: -3343.83}
- equation: C5H5 + H <=> C5H6  # Reaction 172
  rate-constant: {A: 3.16e+13, b: 0.281, Ea: -179.23}
- equation: C5H6 + OH => C4H6 + HCO  # Reaction 173
  rate-constant: {A: 8.0e+12, b: 0.0, Ea: 0.0}
- equation: C5H6 + OH => C2H2 + C2H4 + HCO  # Reaction 174
  rate-constant: {A: 2.0e+12, b: 0.0, Ea: 0.0}
- equation: C5H6 + O => C4H6 + CO  # Reaction 175
  rate-constant: {A: 2.0e+13, b: 0.0, Ea: 0.0}
- equation: C5H5 + HO2 => C2H + C2H4 + CO + OH  # Reaction 176
  rate-constant: {A: 1.5e+13, b: 0.0, Ea: 0.0}
- equation: C5H5 + OH => C2H2 + C2H4 + CO  # Reaction 177
  rate-constant: {A: 1.0e+14, b: 0.25, Ea: 4350.0}
- equation: C5H5 + OH => C4H6 + CO  # Reaction 178
  rate-constant: {A: 1.25e+13, b: 0.25, Ea: 4350.0}
- equation: C5H6 + H => C5H5 + H2  # Reaction 179
  rate-constant: {A: 5.7e+05, b: 2.39, Ea: 2175.24}
- equation: C5H6 + CH3 => C5H5 + CH4  # Reaction 180
  rate-constant: {A: 444.53, b: 2.91, Ea: 4727.71}
- equation: C5H6 + OH => C5H5 + H2O  # Reaction 181
  rate-constant: {A: 1.0e+14, b: 0.0, Ea: 1714.0}
- equation: C2H3 + C4H6 => C5H6 + CH3  # Reaction 182
  rate-constant: {A: 1.0e+12, b: 0.0, Ea: 2000.0}
- equation: C3H5-A + H (+M) <=> C3H6 (+M)  # Reaction 183
  type: falloff
  low-P-rate-constant: {A: 1.33e+60, b: -12.0, Ea: 5967.8}
  high-P-rate-constant: {A: 1.0e+14, b: 0.0, Ea: 0.0}
  Troe: {A: 0.02, T3: 1097.0, T1: 1.097e+04, T2: 6860.0}
  efficiencies: {C2H6: 3.0, CH4: 2.0, CO: 1.5, CO2: 2.0, H2: 2.0, H2O: 6.0}
- equation: C2H2 + O => C2H + OH  # Reaction 184
  rate-constant: {A: 4.7e+06, b: 2.0, Ea: 8057.53}
- equation: C2H4 + O => C2H3 + OH  # Reaction 185
  rate-constant: {A: 1.88e+07, b: 2.0, Ea: 8057.53}
- equation: C2H4 + HO2 => C2H3 + H2O2  # Reaction 186
  rate-constant: {A: 6.4e+06, b: 2.0, Ea: 2.488796e+04}
- equation: C2H3CHO + H => C2H3 + CO + H2  # Reaction 187
  rate-constant: {A: 2.16e+07, b: 2.0, Ea: 2573.61}
- equation: C2H3CHO + CH3 => C2H3 + CH4 + CO  # Reaction 188
  rate-constant: {A: 2.16e+05, b: 2.0, Ea: 3516.32}
- equation: C2H3CHO + O => C2H3 + CO + OH  # Reaction 189
  rate-constant: {A: 1.692e+07, b: 2.0, Ea: 1169.32}
- equation: C2H3CHO + HO2 => C2H3 + CO + H2O2  # Reaction 190
  rate-constant: {A: 5.76e+06, b: 2.0, Ea: 1.406289e+04}
- equation: C4H8(L1) + H => C4H71-3 + H2  # Reaction 191
  rate-constant: {A: 1.185517e+10, b: 1.141177, Ea: 5521.662}
- equation: C4H8(L1) + CH3 => C4H71-3 + CH4  # Reaction 192
  rate-constant: {A: 1.185517e+08, b: 1.141177, Ea: 6770.622}
- equation: C4H8(L1) + H => C4H71-4 + H2  # Reaction 193
  rate-constant: {A: 5.927586e+09, b: 1.141177, Ea: 7156.612}
- equation: C4H8(L1) + CH3 => C4H71-4 + CH4  # Reaction 194
  rate-constant: {A: 5.927586e+07, b: 1.141177, Ea: 8043.752}
- equation: C2H3 + C4H8(L1) => C2H4 + C4H71-4  # Reaction 195
  rate-constant: {A: 1.339634e+08, b: 1.141177, Ea: 6816.072}
- equation: C5H6 + O => C5H5 + OH  # Reaction 196
  rate-constant: {A: 2.35e+07, b: 2.0, Ea: 2500.0}
- equation: C5H6 + HO2 => C5H5 + H2O2  # Reaction 197
  rate-constant: {A: 8.0e+06, b: 2.0, Ea: 1.551451e+04}
- equation: NC5H11 => 0.25 C2H4 + 0.55 C2H5 + 0.55 C3H6 + 0.2 C4H8(L1) +
    0.2 CH3 + 0.25 NC3H7  # Reaction 198
  rate-constant: {A: 3.3e+13, b: 0.0, Ea: 3.0e+04}
- equation: NC5H10 <=> C2H5 + C3H5-A  # Reaction 199
  rate-constant: {A: 2.0e+16, b: 0.0, Ea: 7.45e+04}
- equation: NC5H10 <=> C4H71-3 + CH3  # Reaction 200
  rate-constant: {A: 5.0e+16, b: 0.0, Ea: 8.0e+04}
- equation: H + NC5H10 <=> NC5H11  # Reaction 201
  rate-constant: {A: 2.0e+13, b: 0.0, Ea: 2500.0}
- equation: NC5H11 + O2 => HO2 + NC5H10  # Reaction 202
  rate-constant: {A: 7.5e+11, b: 0.0, Ea: 3000.0}
- equation: C2H5 + C4H8(L1) <=> CH3 + NC5H10  # Reaction 203
  rate-constant: {A: 1.975862e+14, b: -0.8588232, Ea: 8731.782}
- equation: C4H71-3 <=> C2H3 + C2H4  # Reaction 204
  rate-constant: {A: 1.5e+13, b: 0.0, Ea: 5.0e+04}
- equation: C4H71-3 + O2 => C2H3CHO + CH3O(L1)  # Reaction 205
  rate-constant: {A: 2.0e+13, b: 0.0, Ea: 1.6e+04}
- equation: C3H5-A + C3H6 <=> CYC6H10 + H  # Reaction 206
  rate-constant: {A: 2.5e+10, b: 0.0, Ea: 1.5e+04}
- equation: CYC6H10 <=> C2H4 + C4H6  # Reaction 207
  rate-constant: {A: 1.0e+15, b: 0.0, Ea: 6.7e+04}
- equation: CYC6H10 + OH => C2H3CHO + NC3H7  # Reaction 208
  rate-constant: {A: 5.0e+12, b: 0.0, Ea: 0.0}
- equation: NC7H14 => 0.5 C2H5 + 0.5 C4H6 + 0.5 C4H71-3 + 0.5 CH3 + 0.5
    NC3H7  # Reaction 209
  rate-constant: {A: 3.0e+15, b: 0.0, Ea: 7.3e+04}
- equation: H + NC7H14 <=> NC7H15  # Reaction 210
  rate-constant: {A: 2.5e+13, b: 0.0, Ea: 2500.0}
- equation: NC7H15 <=> C2H4 + NC5H11  # Reaction 211
  rate-constant: {A: 6.2e+12, b: 0.0, Ea: 3.0e+04}
- equation: NC7H15 <=> C3H6 + PC4H9  # Reaction 212
  rate-constant: {A: 1.42e+13, b: 0.0, Ea: 3.0e+04}
- equation: NC7H15 <=> C4H8(L1) + NC3H7  # Reaction 213
  rate-constant: {A: 7.5e+12, b: 0.0, Ea: 3.0e+04}
- equation: NC7H15 <=> C2H5 + NC5H10  # Reaction 214
  rate-constant: {A: 5.6e+12, b: 0.0, Ea: 3.0e+04}
- equation: NC7H15 + O2 => HO2 + NC7H14  # Reaction 215
  rate-constant: {A: 7.5e+11, b: 0.0, Ea: 3000.0}
- equation: C4H71-4 + O2 => C2H3 + 2 CH2O  # Reaction 216
  rate-constant: {A: 3.0e+11, b: 0.0, Ea: 2500.0}
- equation: C6H5 + O2 <=> C5H5 + CO2  # Reaction 217
  rate-constant: {A: 1.7e+33, b: -5.96, Ea: 1.8648e+04}
- equation: C7H7(L1) + H <=> C6H5 + CH3  # Reaction 218
  rate-constant: {A: 5.83e+67, b: -14.15, Ea: 6.833e+04}
- equation: C7H7(L1) + O2 <=> O + RCRESOLO  # Reaction 219
  rate-constant: {A: 9.18e+20, b: -2.3, Ea: 7370.0}
- equation: HO2 + RCRESOLO => C5H6 + CO + HCO + OH  # Reaction 220
  rate-constant: {A: 2.5e+12, b: 0.0, Ea: 6000.0}
- equation: HO2 + RXYLENE => C7H7(L1) + CH2O + OH  # Reaction 221
  rate-constant: {A: 1.0e+13, b: 0.0, Ea: 800.0}
- equation: O + RXYLENE => C7H7(L1) + CH2O  # Reaction 222
  rate-constant: {A: 8.0e+13, b: 0.0, Ea: 0.0}
- equation: CH3 + XYLENE => CH4 + RXYLENE  # Reaction 223
  rate-constant: {A: 3.5e+12, b: 0.0, Ea: 8846.0}
- equation: H + XYLENE => H2 + RXYLENE  # Reaction 224
  rate-constant: {A: 2.0e+14, b: 0.0, Ea: 7925.0}
- equation: O2 + XYLENE <=> HO2 + RXYLENE  # Reaction 225
  rate-constant: {A: 3.0e+14, b: 0.0, Ea: 4.14e+04}
- equation: C2H3 + XYLENE => C2H4 + RXYLENE  # Reaction 226
  rate-constant: {A: 4.068e+05, b: 2.0, Ea: 3900.0}
- equation: O + XYLENE => OH + RXYLENE  # Reaction 227
  rate-constant: {A: 1.41e+07, b: 2.0, Ea: 2500.0}
- equation: OH + XYLENE => H2O + RXYLENE  # Reaction 228
  rate-constant: {A: 9.0e+09, b: 1.0, Ea: 50.0}
- equation: HO2 + XYLENE => H2O2 + RXYLENE  # Reaction 229
  rate-constant: {A: 4.8e+06, b: 2.0, Ea: 1.6e+04}
- equation: H + XYLENE => 0.5 C2H4 + C7H7(L1) + H2  # Reaction 230
  rate-constant: {A: 2.4e+07, b: 2.0, Ea: 9957.26}
- equation: CH3 + XYLENE => 0.5 C2H4 + C7H7(L1) + CH4  # Reaction 231
  rate-constant: {A: 2.4e+05, b: 2.0, Ea: 1.119653e+04}
- equation: C2H3 + XYLENE => 1.5 C2H4 + C7H7(L1)  # Reaction 232
  rate-constant: {A: 5.424e+05, b: 2.0, Ea: 9832.26}
- equation: O + XYLENE => 0.5 C2H4 + C7H7(L1) + OH  # Reaction 233
  rate-constant: {A: 1.88e+07, b: 2.0, Ea: 8057.53}
- equation: OH + XYLENE => 0.5 C2H4 + C7H7(L1) + H2O  # Reaction 234
  rate-constant: {A: 1.2e+10, b: 1.0, Ea: 3830.11}
- equation: XYLENE (+M) <=> H + RXYLENE (+M)  # Reaction 235
  type: falloff
  low-P-rate-constant: {A: 1.0e+98, b: -22.855, Ea: 9.9882e+04}
  high-P-rate-constant: {A: 1.12e+16, b: 0.17, Ea: 9.1168e+04}
  Troe: {A: 0.06547, T3: 15.11, T1: 1.0e+10, T2: 7.596e+07}
- equation: NC10H21 => 0.85 C2H4 + 0.4 CH3 + 0.24 NC10H20 + 0.2 NC10H21
    + 0.1 NC7H14 + 0.4 NC7H15  # Reaction 236
  rate-constant: {A: 5.0e+12, b: 0.0, Ea: 3.0e+04}
- equation: NC10H21 => 0.35 C2H4 + 0.5 C2H5 + 0.7 C3H6 + 0.12 NC10H20 +
    0.5 NC3H7 + 0.5 NC7H14  # Reaction 237
  rate-constant: {A: 1.0e+13, b: 0.0, Ea: 3.0e+04}
- equation: NC10H21 => 0.4 C4H8(L1) + 0.45 NC5H10 + 0.4 NC5H11 + 0.25 NC7H14
    + 0.6 PC4H9  # Reaction 238
  rate-constant: {A: 1.0e+13, b: 0.0, Ea: 3.0e+04}
- equation: NC10H21 => 0.75 C3H6 + 0.25 NC5H10 + 0.25 NC5H11 + 0.75 NC7H15  # Reaction 239
  rate-constant: {A: 1.0e+13, b: 0.0, Ea: 3.0e+04}
- equation: NC12H26 => 0.5 C2H5 + 0.5 NC12H25 + 0.5 NC3H7 + 0.5 NC7H15  # Reaction 240
  rate-constant: {A: 2.0e+17, b: 0.0, Ea: 8.15e+04}
- equation: NC12H26 => 0.1 NC12H25 + 0.5 NC5H11 + 0.9 NC7H15 + 0.5 PC4H9  # Reaction 241
  rate-constant: {A: 2.0e+17, b: 0.0, Ea: 8.15e+04}
- equation: NC12H25 + O2 => HO2 + 1.2 NC10H20  # Reaction 242
  rate-constant: {A: 1.07, b: 3.7, Ea: 9320.0}
- equation: NC12H25 => C2H4 + 0.4 CH3 + 0.36 NC10H20 + 0.6 NC10H21  # Reaction 243
  rate-constant: {A: 9.5e+12, b: 0.0, Ea: 3.0e+04}
- equation: NC12H25 => 0.9 C2H4 + 0.3 C2H5 + 0.633333 NC10H20 + 0.7 NC3H7
    + 0.166667 NC7H14  # Reaction 244
  rate-constant: {A: 4.2e+12, b: 0.0, Ea: 3.0e+04}
- equation: NC12H25 => 0.2 C3H6 + 0.106667 NC10H20 + 0.5 NC5H11 + 0.833333
    NC7H14 + 0.5 PC4H9  # Reaction 245
  rate-constant: {A: 5.3e+12, b: 0.0, Ea: 3.0e+04}
- equation: NC12H25 => 0.35 C2H4 + 0.75 NC5H10 + 0.25 NC5H11 + 0.15 NC7H14
    + 0.75 NC7H15  # Reaction 246
  rate-constant: {A: 7.0e+12, b: 0.0, Ea: 3.0e+04}
- equation: NC12H25 => 0.3 C2H4 + 0.5 C3H6 + 0.35 C4H8(L1) + 0.5 NC10H21
    + 0.5 NC7H15  # Reaction 247
  rate-constant: {A: 1.05e+13, b: 0.0, Ea: 3.0e+04}
- equation: NC10H20 => 0.5 C3H5-A + 0.5 C4H71-3 + 0.25 NC5H11 + 0.75 NC7H15  # Reaction 248
  rate-constant: {A: 1.0e+16, b: 0.0, Ea: 7.2e+04}
- equation: H + NC10H20 <=> NC10H21  # Reaction 249
  rate-constant: {A: 3.0e+13, b: 0.0, Ea: 2500.0}
- equation: NC10H19 => 0.6 C2H4 + 0.5 C3H5-A + 0.6 C3H6 + 0.5 C4H71-3 +
    0.5 NC7H14  # Reaction 250
  rate-constant: {A: 2.25e+13, b: 0.0, Ea: 3.1e+04}
- equation: MCYC6 => 0.7 C3H6 + 0.7 C4H8(L1) + 0.3 NC7H14  # Reaction 251
  rate-constant: {A: 6.0e+16, b: 0.0, Ea: 8.2e+04}
- equation: RMCYC6 => C2H4 + C4H6 + CH3  # Reaction 252
  rate-constant: {A: 1.9e+13, b: 0.0, Ea: 2.9e+04}
- equation: RMCYC6 => 0.5 C3H6 + 0.5 C4H71-4 + 0.5 CH3 + 0.5 CYC6H10  # Reaction 253
  rate-constant: {A: 8.0e+12, b: 0.0, Ea: 2.9e+04}
- equation: O2 + RMCYC6 => 0.5 C2H4 + CYC6H10 + HO2  # Reaction 254
  rate-constant: {A: 6.0e+11, b: 0.0, Ea: 2000.0}
- equation: H + NC10H20 => H2 + NC10H19  # Reaction 255
  rate-constant: {A: 6.6e+07, b: 2.0, Ea: 4000.0}
- equation: CH3 + NC10H20 => CH4 + NC10H19  # Reaction 256
  rate-constant: {A: 6.6e+05, b: 2.0, Ea: 5000.0}
- equation: NC10H20 + O => NC10H19 + OH  # Reaction 257
  rate-constant: {A: 5.17e+07, b: 2.0, Ea: 2500.0}
- equation: NC10H20 + OH => H2O + NC10H19  # Reaction 258
  rate-constant: {A: 3.3e+10, b: 1.0, Ea: 50.0}
- equation: HO2 + NC10H20 => H2O2 + NC10H19  # Reaction 259
  rate-constant: {A: 1.76e+07, b: 2.0, Ea: 1.6e+04}
- equation: H + NC12H26 => H2 + NC12H25  # Reaction 260
  rate-constant: {A: 6.6e+07, b: 2.0, Ea: 4000.0}
- equation: CH3 + NC12H26 => CH4 + NC12H25  # Reaction 261
  rate-constant: {A: 6.6e+05, b: 2.0, Ea: 5000.0}
- equation: C2H3 + NC12H26 => C2H4 + NC12H25  # Reaction 262
  rate-constant: {A: 1.4916e+06, b: 2.0, Ea: 3900.0}
- equation: C2H5 + NC12H26 => C2H6 + NC12H25  # Reaction 263
  rate-constant: {A: 4.4e+05, b: 2.0, Ea: 6700.0}
- equation: C3H5-A + NC12H26 => C3H6 + NC12H25  # Reaction 264
  rate-constant: {A: 1.1858e+06, b: 2.0, Ea: 1.28e+04}
- equation: NC12H26 + O => NC12H25 + OH  # Reaction 265
  rate-constant: {A: 5.17e+07, b: 2.0, Ea: 2500.0}
- equation: NC12H26 + O2 => HO2 + NC12H25  # Reaction 266
  rate-constant: {A: 3.74e+07, b: 2.0, Ea: 4.4e+04}
- equation: NC12H26 + OH => H2O + NC12H25  # Reaction 267
  rate-constant: {A: 3.3e+10, b: 1.0, Ea: 50.0}
- equation: HO2 + NC12H26 => H2O2 + NC12H25  # Reaction 268
  rate-constant: {A: 1.76e+07, b: 2.0, Ea: 1.6e+04}
- equation: CH3 + MCYC6 => CH4 + RMCYC6  # Reaction 269
  rate-constant: {A: 4.2e+05, b: 2.0, Ea: 5000.0}
- equation: C2H3 + MCYC6 => C2H4 + RMCYC6  # Reaction 270
  rate-constant: {A: 9.492e+05, b: 2.0, Ea: 3900.0}
- equation: C2H5 + MCYC6 => C2H6 + RMCYC6  # Reaction 271
  rate-constant: {A: 2.8e+05, b: 2.0, Ea: 6700.0}
- equation: C3H5-A + MCYC6 => C3H6 + RMCYC6  # Reaction 272
  rate-constant: {A: 7.546e+05, b: 2.0, Ea: 1.28e+04}
- equation: MCYC6 + O => OH + RMCYC6  # Reaction 273
  rate-constant: {A: 3.29e+07, b: 2.0, Ea: 2500.0}
- equation: MCYC6 + OH => H2O + RMCYC6  # Reaction 274
  rate-constant: {A: 2.1e+10, b: 1.0, Ea: 50.0}
- equation: MCYC6 + O2 => HO2 + RMCYC6  # Reaction 275
  rate-constant: {A: 1.0005e+08, b: 2.0, Ea: 4.072249e+04}
- equation: HO2 + MCYC6 => H2O2 + RMCYC6  # Reaction 276
  rate-constant: {A: 4.5e+06, b: 2.0, Ea: 1.388773e+04}
- equation: H + MCYC6 => H2 + RMCYC6  # Reaction 277
  rate-constant: {A: 3.372e+06, b: 2.462, Ea: 5238.05}
