units(length = "cm", time = "s", quantity = "mol", act_energy = "cal/mol")

ideal_gas(name = "float",
      elements = " O  H  C ",
      species = """ O2  H2O  CO2 CnHm """,
      reactions = "all",
      initial_state = state(temperature = 300.0,
                        pressure = OneAtm)    )


species(name = "O2",
    atoms = " O:2 ",
    thermo = (
       NASA( [  200.00,  1000.00], [  3.782456360E+00,  -2.996734160E-03,
                9.847302010E-06,  -9.681295090E-09,   3.243728370E-12,
               -1.063943560E+03,   3.657675730E+00] ),
       NASA( [ 1000.00,  3500.00], [  3.282537840E+00,   1.483087540E-03,
               -7.579666690E-07,   2.094705550E-10,  -2.167177940E-14,
               -1.088457720E+03,   5.453231290E+00] )
             )
       )


species(name = "H2O",
    atoms = " H:2  O:1 ",
    thermo = (
       NASA( [  200.00,  1000.00], [  4.198640560E+00,  -2.036434100E-03,
                6.520402110E-06,  -5.487970620E-09,   1.771978170E-12,
               -3.029372670E+04,  -8.490322080E-01] ),
       NASA( [ 1000.00,  3500.00], [  3.033992490E+00,   2.176918040E-03,
               -1.640725180E-07,  -9.704198700E-11,   1.682009920E-14,
               -3.000429710E+04,   4.966770100E+00] )
             )
       )

species(name = "CO2",
    atoms = " C:1  O:2 ",
    thermo = (
       NASA( [  200.00,  1000.00], [  2.356773520E+00,   8.984596770E-03,
               -7.123562690E-06,   2.459190220E-09,  -1.436995480E-13,
               -4.837196970E+04,   9.901052220E+00] ),
       NASA( [ 1000.00,  3500.00], [  3.857460290E+00,   4.414370260E-03,
               -2.214814040E-06,   5.234901880E-10,  -4.720841640E-14,
               -4.875916600E+04,   2.271638060E+00] )
             ),
    transport = gas_transport(
                     geom = "linear",
                     diam =     3.76,
                     well_depth =   244.00,
                     polar =     2.65,
                     rot_relax =     2.10),
    note = "L 7/88"
       )

species(name = "CnHm",
    atoms = " C:10.65  H:21.8 ",
    thermo = (
       NASA( [  300.00,  1000.00], [  9.335538100E-01,   2.642457900E-02,
                6.105972700E-06,  -2.197749900E-08,   9.514925300E-12,
               -1.395852000E+04,   1.920169100E+01] ),
       NASA( [ 1000.00,  5000.00], [  7.534136800E+00,   1.887223900E-02,
               -6.271849100E-06,   9.147564900E-10,  -4.783806900E-14,
               -1.646751600E+04,  -1.789234900E+01] )
             )
       )

reaction( "CnHm + 16.1 O2 => 10.65 CO2 + 10.9 H2O",   [3.16000E+07, 1.8, 934])