# # Generated from file octane_mech.txt # by ck2cti on Tue Apr 05 11:20:12 2005 # units(length = "cm", time = "s", quantity = "mol", act_energy = "cal/mol") ideal_gas(name = "gas", elements = " H C O N Ar", species = """ AR h h2 o o2 oh h2o n2 co hco co2 ch3 ch4 ho2 h2o2 ch2o ch3o c2h6 c2h4 c2h5 ch2 ch c2h c2h2 c2h3 ch3oh ch2oh ch2co hcco c2h5oh pc2h4oh sc2h4oh ch3co ch2cho ch3cho c3h4-a c3h4-p c3h6 c4h6 nc3h7 ic3h7 c3h8 ic4h7 ic4h8 c4h7 c4h8-2 c4h8-1 sc4h9 pc4h9 tc4h9 ic4h9 ic4h10 c4h10 ch3coch3 ch3coch2 c2h5cho c2h5co c5h9 c5h10-1 c5h10-2 ic5h12 ac5h11 bc5h11 cc5h11 dc5h11 ac5h10 bc5h10 cc5h10 ic5h9 nc5h12 c5h11-1 c5h11-2 c5h11-3 neoc5h12 neoc5h11 c2h5o ch3o2 c2h5o2 ch3o2h c2h5o2h c2h3o1-2 ch3co2 c2h4o1-2 c2h4o2h o2c2h4oh ch3co3 ch3co3h c2h3co c2h3cho c3h5o c3h6ooh1-2 c3h6ooh1-3 c3h6ooh2-1 c3h6ooh1-2o2 c3h6ooh1-3o2 c3h6ooh2-1o2 nc3h7o ic3h7o nc3h7o2h ic3h7o2h nc3h7o2 ic3h7o2 c3h6o1-3 ic4h8o ic4h8oh io2c4h8oh ic4h7o c4h7o c4h8oh-1 c4h8oh-2 c4h8oh-1o2 c4h8oh-2o2 c4h8ooh1-2o2 c4h8ooh1-3o2 c4h8ooh1-4o2 c4h8ooh2-1o2 c4h8ooh2-3o2 c4h8ooh2-4o2 tc4h8ooh-io2 ic4h8ooh-io2 ic4h8ooh-to2 c4h8ooh1-2 c4h8ooh1-3 c4h8ooh1-4 c4h8ooh2-1 c4h8ooh2-3 c4h8ooh2-4 ic4h8o2h-i ic4h8o2h-t tc4h8o2h-i c4h8o1-2 c4h8o1-3 c4h8o1-4 c4h8o2-3 cc4h8o pc4h9o sc4h9o ic4h9o tc4h9o pc4h9o2h sc4h9o2h ic4h9o2h tc4h9o2h tc4h9o2 ic4h9o2 sc4h9o2 pc4h9o2 ch3coch2o2 ch3coch2o2h ch3coch2o neoc5ketox neoc5kejol ac5h11o2 bc5h11o2 cc5h11o2 dc5h11o2 ac5h11o2h bc5h11o2h cc5h11o2h dc5h11o2h ac5h11o bc5h11o cc5h11o dc5h11o ac5h10ooh-a ac5h10ooh-b ac5h10ooh-c ac5h10ooh-d bc5h10ooh-a bc5h10ooh-c bc5h10ooh-d cc5h10ooh-a cc5h10ooh-b cc5h10ooh-d dc5h10ooh-a dc5h10ooh-b dc5h10ooh-c ac5h10ooh-ao2 ac5h10ooh-bo2 ac5h10ooh-co2 ac5h10ooh-do2 bc5h10ooh-ao2 bc5h10ooh-co2 bc5h10ooh-do2 cc5h10ooh-ao2 cc5h10ooh-bo2 cc5h10ooh-do2 dc5h10ooh-ao2 dc5h10ooh-bo2 dc5h10ooh-co2 a-ac5h10o a-bc5h10o a-cc5h10o a-dc5h10o b-cc5h10o b-dc5h10o c-dc5h10o c5h11o2-1 c5h11o2-2 c5h11o2-3 c5h11o2h-1 c5h11o2h-2 c5h11o2h-3 c5h11o-1 c5h11o-2 c5h11o-3 c5h10ooh1-2 c5h10ooh1-3 c5h10ooh1-4 c5h10ooh1-5 c5h10ooh2-1 c5h10ooh2-3 c5h10ooh2-4 c5h10ooh2-5 c5h10ooh3-2 c5h10ooh3-1 c5h10ooh1-2o2 c5h10ooh1-3o2 c5h10ooh1-4o2 c5h10ooh1-5o2 c5h10ooh2-1o2 c5h10ooh2-3o2 c5h10ooh2-4o2 c5h10ooh2-5o2 c5h10ooh3-1o2 c5h10ooh3-2o2 c5h10o1-2 c5h10o1-3 c5h10o1-4 c5h10o1-5 c5h10o2-3 c5h10o2-4 neoc5h11o2 neoc5h11o2h neoc5h11o neoc5h10ooh neoc5h10ooh-o2 neo-c5h10o c3h5-a c3h5-s c3h5-t c3h3 c3h2 c3h6o1-2 ho2cho o2cho ocho ch2(s) c3ket12 c3ket13 c3ket21 nc4ket12 nc4ket13 nc4ket14 nc4ket21 nc4ket23 nc4ket24 ic4ketii ic4ketit neoc5ket nc5ket12 nc5ket13 nc5ket14 nc5ket15 nc5ket21 nc5ket23 nc5ket24 nc5ket25 nc5ket31 nc5ket32 ic5ketaa ic5ketab ic5ketac ic5ketad ic5ketca ic5ketcb ic5ketcd ic5ketda ic5ketdb ic5ketdc ic4h7-i1 c3h6oh hoc3h6o2 o2c2h4o2h ch2o2hcho ic4h7ooh ic3h5cho tc3h6ocho tc3h6cho ic3h7cho ic4h7oh ic3h6co ic4h6oh ic3h5co ic3h7co tc3h6o2cho tc3h6o2hco ic3h5o2hcho tc3h6ohcho tc3h6oh ic3h5oh tc4h8cho o2c4h8cho o2hc4h8co o2hc4h7cho c3h5oh ch2cch2oh nc3h7cho nc3h7co ch2ch2coch3 c2h5coch2 c2h5coch3 ch2choohcoch3 ch3choohcoch3 ch3choococh3 ch3chcoch3 c2h3coch3 ch3chco ch2ch2cho c3h6cho-3 c3h6cho-2 c2h5chco ic3h5coch3 ic3h5coch2 ac3h4coch3 sc3h5coch2 ch3chocho ch3chcho sc3h5cho sc3h5co ic3h6cho c3h6cho-1 c2h5coc2h5 c2h5coc2h4p c2h5coc2h4s c2h5coc2h3 pc2h4coc2h3 sc2h4coc2h3 ic3h6chcho ic3h6chco ac3h5chcho ic3h6chcoch3 ac3h5chcoch3 ic3h6chcoch2 nc3h7coch3 nc3h7coch2 c3h6coch3-1 c3h6coch3-2 c3h6coch3-3 ic3h7coch3 ic3h7coch2 ic3h6coch3 tc3h6coch3 nc3h7coc2h5 c3h6coc2h5-1 c3h6coc2h5-2 c3h6coc2h5-3 nc3h7coc2h4p nc3h7coc2h4s ic3h7coc2h5 ic3h6coc2h5 tc3h6coc2h5 ic3h7coc2h4p ic3h7coc2h4s ic3h7coc2h3 ic3h6coc2h3 tc3h6coc2h3 ic3h5coc2h5 ac3h4coc2h5 ic3h5coc2h4p ic3h5coc2h4s nc4h9cho nc4h9co ac3h5cho ac3h5co c2h3chcho c4h8cho-1 c4h8cho-2 c4h8cho-3 c4h8cho-4 neoc5h9q2 neoc5h9q2-n ic4h6q2-ii hoch2o hocho ic6h14 ac6h13 bc6h13 cc6h13 dc6h13 ec6h13 ac6h12 bc6h12 cc6h12 dc6h12 ic6h11 ac6h13o2 bc6h13o2 cc6h13o2 dc6h13o2 ec6h13o2 ac6h13o2h bc6h13o2h cc6h13o2h dc6h13o2h ec6h13o2h ac6h13o bc6h13o cc6h13o dc6h13o ec6h13o ac6h12ooh-a ac6h12ooh-b ac6h12ooh-c ac6h12ooh-d ac6h12ooh-e bc6h12ooh-a bc6h12ooh-c bc6h12ooh-d bc6h12ooh-e cc6h12ooh-a cc6h12ooh-b cc6h12ooh-d cc6h12ooh-e dc6h12ooh-a dc6h12ooh-b dc6h12ooh-c dc6h12ooh-e ec6h12ooh-a ec6h12ooh-b ec6h12ooh-c ec6h12ooh-d a-ac6h12o a-bc6h12o a-cc6h12o a-dc6h12o a-ec6h12o b-cc6h12o b-dc6h12o b-ec6h12o c-dc6h12o c-ec6h12o d-ec6h12o ac6h12ooh-ao2 ac6h12ooh-bo2 ac6h12ooh-co2 ac6h12ooh-do2 ac6h12ooh-eo2 bc6h12ooh-ao2 bc6h12ooh-co2 bc6h12ooh-do2 bc6h12ooh-eo2 cc6h12ooh-ao2 cc6h12ooh-bo2 cc6h12ooh-do2 cc6h12ooh-eo2 dc6h12ooh-ao2 dc6h12ooh-bo2 dc6h12ooh-co2 dc6h12ooh-eo2 ec6h12ooh-ao2 ec6h12ooh-bo2 ec6h12ooh-co2 ec6h12ooh-do2 ic6ketaa ic6ketab ic6ketac ic6ketad ic6ketae ic6ketca ic6ketcb ic6ketcd ic6ketce ic6ketda ic6ketdb ic6ketdc ic6ketde ic6ketea ic6keteb ic6ketec ic6keted nc4h9cho-2 nc4h9co-2 c4h8cho1-2 c4h8cho2-2 c4h8cho3-2 c4h8cho4-2 ic4h9cho ic4h9co ic3h6ch2cho tc3h6ch2cho ic3h7chcho ic5h11cho ic5h11co ac5h10cho bc5h10cho cc5h10cho dc5h10cho c4h7cho1-4 c4h7co1-4 c4h6cho1-43 c4h6cho1-44 c4h7cho2-1 c4h7co2-1 c4h6cho2-11 nc5h11cho-2 nc5h11co-2 c5h10cho1-2 c5h10cho2-2 c5h10cho3-2 c5h10cho4-2 c5h10cho5-2 ic4h9coch3 ic4h9coch2 ic3h6ch2coch3 ic3h7chcoch3 tc3h6ch2coch3 neoc6h14 fc6h13 gc6h13 hc6h13 neoc6h12 neoc6h11 fc6h13o2 gc6h13o2 hc6h13o2 fc6h13o2h gc6h13o2h hc6h13o2h fc6h13o gc6h13o hc6h13o fc6h12ooh-f fc6h12ooh-g fc6h12ooh-h gc6h12ooh-f gc6h12ooh-h hc6h12ooh-f hc6h12ooh-g fc6h12ooh-fo2 fc6h12ooh-go2 fc6h12ooh-ho2 gc6h12ooh-fo2 gc6h12ooh-ho2 hc6h12ooh-fo2 hc6h12ooh-go2 f-fc6h12o f-gc6h12o f-hc6h12o g-hc6h12o neoc6ketff neoc6ketfg neoc6ketfh neoc6ketgf neoc6ketgh neoc6kethf neoc6kethg tc4h9cho tc4h9co neoc5h11cho neoc5h11co tc4h9chcho tc4h8ch2cho ic4h7cho ic4h7co ac3h4ch2cho ic3h5chcho ic5h11cho-b ic5h11co-b ic5h10cho-ba ic5h10cho-bc ic5h10cho-bd c4h7cho1-2 c4h7co1-2 c4h6cho1-23 c4h6cho1-24 c4h7cho2-2 c4h7co2-2 c4h6cho2-21 c4h6cho2-24 ch2cchch3 tc4h9coch3 tc4h9coch2 tc4h8coch3 ch2ccho c7h162-4 xc7h15 yc7h15 zc7h15 xc7h14 yc7h14 xc7h13 xc7h15o2 yc7h15o2 zc7h15o2 xc7h15o2h yc7h15o2h zc7h15o2h xc7h15o yc7h15o zc7h15o xc7h14ooh-x1 xc7h14ooh-y1 xc7h14ooh-z xc7h14ooh-y2 xc7h14ooh-x2 yc7h14ooh-x1 yc7h14ooh-z yc7h14ooh-y2 yc7h14ooh-x2 zc7h14ooh-x zc7h14ooh-y xc7h14ooh-x1o2 xc7h14ooh-x2o2 xc7h14ooh-y1o2 xc7h14ooh-y2o2 xc7h14ooh-zo2 yc7h14ooh-x1o2 yc7h14ooh-x2o2 yc7h14ooh-y2o2 yc7h14ooh-zo2 zc7h14ooh-xo2 zc7h14ooh-yo2 x-x1c7h14o x-x2c7h14o x-y1c7h14o x-y2c7h14o x-zc7h14o y-yc7h14o y-zc7h14o c7ket24xx1 c7ket24xy1 c7ket24xz c7ket24xy2 c7ket24xx2 c7ket24zx c7ket24zy neoc7h16 nc7h15 oc7h15 pc7h15 qc7h15 oc7h14 pc7h14 pc7h13 nc7h15o2 oc7h15o2 pc7h15o2 qc7h15o2 nc7h15o2h oc7h15o2h pc7h15o2h qc7h15o2h nc7h15o oc7h15o pc7h15o qc7h15o nc7h14ooh-n2 nc7h14ooh-q qc7h14ooh-n nc7h14ooh-o nc7h14ooh-p qc7h14ooh-o qc7h14ooh-p oc7h14ooh-n oc7h14ooh-q pc7h14ooh-n pc7h14ooh-q oc7h14ooh-p pc7h14ooh-o nc7h14ooh-n2o2 nc7h14ooh-qo2 qc7h14ooh-no2 nc7h14ooh-oo2 nc7h14ooh-po2 qc7h14ooh-oo2 qc7h14ooh-po2 oc7h14ooh-no2 oc7h14ooh-qo2 pc7h14ooh-no2 pc7h14ooh-qo2 oc7h14ooh-po2 pc7h14ooh-oo2 n-nc7h14o n-oc7h14o n-pc7h14o n-qc7h14o o-pc7h14o o-qc7h14o p-qc7h14o neoc7ketnn neoc7ketno neoc7ketnp neoc7ketnq neoc7keton neoc7ketop neoc7ketoq neoc7ketpn neoc7ketpo neoc7ketpq neoc7ketqn neoc7ketqo neoc7ketqp ic8h18 ac8h17 bc8h17 cc8h17 dc8h17 ic8h16 jc8h16 ic8h14 ic8h15 ac8h17o2 bc8h17o2 cc8h17o2 dc8h17o2 ac8h17o2h bc8h17o2h cc8h17o2h dc8h17o2h ac8h17o bc8h17o cc8h17o dc8h17o ac8h16ooh-a ac8h16ooh-b ac8h16ooh-c ac8h16ooh-d bc8h16ooh-c bc8h16ooh-a bc8h16ooh-d cc8h16ooh-d cc8h16ooh-b cc8h16ooh-a dc8h16ooh-c dc8h16ooh-d dc8h16ooh-b dc8h16ooh-a ic8eteraa ic8eterab ic8eterac ic8eterad ic8eterbc ic8eterbd ic8etercd ic8eterdd ac8h16ooh-ao2 ac8h16ooh-bo2 ac8h16ooh-co2 ac8h16ooh-do2 bc8h16ooh-co2 bc8h16ooh-ao2 bc8h16ooh-do2 cc8h16ooh-do2 cc8h16ooh-bo2 cc8h16ooh-ao2 dc8h16ooh-co2 dc8h16ooh-do2 dc8h16ooh-bo2 dc8h16ooh-ao2 ic8ketaa ic8ketab ic8ketac ic8ketad ic8ketba ic8ketbc ic8ketbd ic8ketda ic8ketdb ic8ketdc ic8ketdd ic6h13cho-b ic6h13co-b ac6h12cho-b cc6h12cho-b dc6h12cho-b ec6h12cho-b ic6h13cho-d ic6h13co-d ac6h12cho-d bc6h12cho-d cc6h12cho-d dc6h12cho-d ec6h12cho-d ic3h7coc3h7-i ic3h7coc3h6-i ic3h7coc3h6-t tc4h9coc2h5 tc4h8coc2h5 tc4h9coc2h4s tc4h9coc2h4p neoc5h11coch3 neoc5h10coch3 tc4h9chcoch3 neoc5h11coch2 neoc6h13cho neoc6h13co fc6h12cho gc6h12cho hc6h12cho ic4h7coch3 ic4h7coch2 ic3h5chcoch3 ac3h4ch2coch3 xc7h13ooh-x1 xc7h13o-x1 yc7h13ooh-x1 yc7h13o-x1 oc7h13ooh-n oc7h13o-n xc7h13ooh-z xc7h13o-z pc7h13ooh-o pc7h13o-o oc7h13ooh-q oc7h13o-q yc7h13ooh-x2 yc7h13o-x2 ac3h5ooh neoc6h11-h cc6h11o-b xc7h14oh-y yc7h14oh-x zc7h14oh-y yc7h14oh-z ic4h7oh-i1 oc7h14oh-p pc7h14oh-o qc7h14oh-p pc7h14oh-q xc7h14oh-yo2 xc7h14o-yo2h yc7h14oh-xo2 yc7h14o-xo2h zc7h14oh-yo2 zc7h14o-yo2h yc7h14oh-zo2 yc7h14o-zo2h oc7h14oh-po2 oc7h14o-po2h pc7h14oh-oo2 pc7h14o-oo2h qc7h14oh-po2 qc7h14o-po2h pc7h14oh-qo2 pc7h14o-qo2h cc8h16oh-b bc8h16oh-c cc8h16oh-d dc8h16oh-c cc8h16oh-bo2 cc8h16o-bo2h bc8h16oh-co2 bc8h16o-co2h cc8h16oh-do2 cc8h16o-do2h dc8h16oh-co2 dc8h16o-co2h """, reactions = "all", initial_state = state(temperature = 300.0, pressure = OneAtm) ) #------------------------------------------------------------------------------- # Species data #------------------------------------------------------------------------------- species(name = "AR", atoms = " Ar:1 ", thermo = ( NASA( [ 300.00, 1000.00], [ 2.500000000E+000, 0.000000000E+000, 0.000000000E+000, 0.000000000E+000, 0.000000000E+000, -7.453750000E+002, 4.366001000E+000] ), NASA( [ 1000.00, 5000.00], [ 2.500000000E+000, 0.000000000E+000, 0.000000000E+000, 0.000000000E+000, 0.000000000E+000, -7.453750000E+002, 4.366001000E+000] ) ), note = "120186" ) species(name = "h", atoms = " H:1 ", thermo = ( NASA( [ 300.00, 1000.00], [ 2.501044220E+000, 0.000000000E+000, 0.000000000E+000, 0.000000000E+000, 0.000000000E+000, 2.547474660E+004, -4.653413170E-001] ), NASA( [ 1000.00, 5000.00], [ 2.501044220E+000, 0.000000000E+000, 0.000000000E+000, 0.000000000E+000, 0.000000000E+000, 2.547474660E+004, -4.653413170E-001] ) ), note = "8/12/99 therm" ) species(name = "h2", atoms = " H:2 ", thermo = ( NASA( [ 300.00, 1000.00], [ 3.298124000E+000, 8.249442000E-004, -8.143015000E-007, -9.475434000E-011, 4.134872000E-013, -1.012521000E+003, -3.294094000E+000] ), NASA( [ 1000.00, 5000.00], [ 2.991423000E+000, 7.000644000E-004, -5.633829000E-008, -9.231578000E-012, 1.582752000E-015, -8.350340000E+002, -1.355110000E+000] ) ), note = "121286" ) species(name = "o", atoms = " O:1 ", thermo = ( NASA( [ 300.00, 1000.00], [ 2.946429000E+000, -1.638166000E-003, 2.421032000E-006, -1.602843000E-009, 3.890696000E-013, 2.914764000E+004, 2.963995000E+000] ), NASA( [ 1000.00, 5000.00], [ 2.542060000E+000, -2.755062000E-005, -3.102803000E-009, 4.551067000E-012, -4.368052000E-016, 2.923080000E+004, 4.920308000E+000] ) ), note = "120186" ) species(name = "o2", atoms = " O:2 ", thermo = ( NASA( [ 300.00, 1000.00], [ 3.212936000E+000, 1.127486000E-003, -5.756150000E-007, 1.313877000E-009, -8.768554000E-013, -1.005249000E+003, 6.034738000E+000] ), NASA( [ 1000.00, 5000.00], [ 3.697578000E+000, 6.135197000E-004, -1.258842000E-007, 1.775281000E-011, -1.136435000E-015, -1.233930000E+003, 3.189166000E+000] ) ), note = "121386" ) species(name = "oh", atoms = " H:1 O:1 ", thermo = ( NASA( [ 300.00, 1357.00], [ 3.435862190E+000, 2.022358040E-004, -1.135464120E-007, 2.424451490E-010, -7.436510310E-014, 3.743212520E+003, 2.450141270E+000] ), NASA( [ 1357.00, 5000.00], [ 2.625997540E+000, 1.319924060E-003, -3.597246700E-007, 4.256308000E-011, -1.820480160E-015, 4.120853740E+003, 7.106673070E+000] ) ), note = "8/12/99 therm" ) species(name = "h2o", atoms = " H:2 O:1 ", thermo = ( NASA( [ 300.00, 1000.00], [ 3.386842000E+000, 3.474982000E-003, -6.354696000E-006, 6.968581000E-009, -2.506588000E-012, -3.020811000E+004, 2.590233000E+000] ), NASA( [ 1000.00, 5000.00], [ 2.672146000E+000, 3.056293000E-003, -8.730260000E-007, 1.200996000E-010, -6.391618000E-015, -2.989921000E+004, 6.862817000E+000] ) ), note = "20387" ) species(name = "n2", atoms = " N:2 ", thermo = ( NASA( [ 300.00, 1000.00], [ 3.298677000E+000, 1.408240000E-003, -3.963222000E-006, 5.641515000E-009, -2.444855000E-012, -1.020900000E+003, 3.950372000E+000] ), NASA( [ 1000.00, 5000.00], [ 2.926640000E+000, 1.487977000E-003, -5.684761000E-007, 1.009704000E-010, -6.753351000E-015, -9.227977000E+002, 5.980528000E+000] ) ), note = "121286" ) species(name = "co", atoms = " C:1 O:1 ", thermo = ( NASA( [ 300.00, 1000.00], [ 3.262452000E+000, 1.511941000E-003, -3.881755000E-006, 5.581944000E-009, -2.474951000E-012, -1.431054000E+004, 4.848897000E+000] ), NASA( [ 1000.00, 5000.00], [ 3.025078000E+000, 1.442689000E-003, -5.630828000E-007, 1.018581000E-010, -6.910952000E-015, -1.426835000E+004, 6.108218000E+000] ) ), note = "121286" ) species(name = "hco", atoms = " H:1 C:1 O:1 ", thermo = ( NASA( [ 300.00, 1000.00], [ 2.898330000E+000, 6.199147000E-003, -9.623084000E-006, 1.089825000E-008, -4.574885000E-012, 4.159922000E+003, 8.983614000E+000] ), NASA( [ 1000.00, 5000.00], [ 3.557271000E+000, 3.345573000E-003, -1.335006000E-006, 2.470573000E-010, -1.713851000E-014, 3.916324000E+003, 5.552299000E+000] ) ), note = "121286" ) species(name = "co2", atoms = " C:1 O:2 ", thermo = ( NASA( [ 300.00, 1000.00], [ 2.275725000E+000, 9.922072000E-003, -1.040911000E-005, 6.866687000E-009, -2.117280000E-012, -4.837314000E+004, 1.018849000E+001] ), NASA( [ 1000.00, 5000.00], [ 4.453623000E+000, 3.140169000E-003, -1.278411000E-006, 2.393997000E-010, -1.669033000E-014, -4.896696000E+004, -9.553959000E-001] ) ), note = "121286" ) species(name = "ch3", atoms = " C:1 H:3 ", thermo = ( NASA( [ 300.00, 1000.00], [ 2.430443000E+000, 1.112410000E-002, -1.680220000E-005, 1.621829000E-008, -5.864953000E-012, 1.642378000E+004, 6.789794000E+000] ), NASA( [ 1000.00, 5000.00], [ 2.844052000E+000, 6.137974000E-003, -2.230345000E-006, 3.785161000E-010, -2.452159000E-014, 1.643781000E+004, 5.452697000E+000] ) ), note = "121286" ) species(name = "ch4", atoms = " C:1 H:4 ", thermo = ( NASA( [ 300.00, 1000.00], [ 7.787415000E-001, 1.747668000E-002, -2.783409000E-005, 3.049708000E-008, -1.223931000E-011, -9.825229000E+003, 1.372219000E+001] ), NASA( [ 1000.00, 5000.00], [ 1.683479000E+000, 1.023724000E-002, -3.875129000E-006, 6.785585000E-010, -4.503423000E-014, -1.008079000E+004, 9.623395000E+000] ) ), note = "121286" ) species(name = "ho2", atoms = " H:1 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [ 3.183106560E+000, 3.667679500E-003, -9.323851220E-007, -3.258529190E-010, 1.511399120E-013, 8.091810130E+002, 8.393710990E+000] ), NASA( [ 1390.00, 5000.00], [ 4.105474230E+000, 2.384528350E-003, -8.063479890E-007, 1.241917230E-010, -7.164001080E-015, 3.981276890E+002, 3.125158360E+000] ) ), note = "8/12/99 therm" ) species(name = "h2o2", atoms = " H:2 O:2 ", thermo = ( NASA( [ 300.00, 1000.00], [ 3.388754000E+000, 6.569226000E-003, -1.485013000E-007, -4.625806000E-009, 2.471515000E-012, -1.766315000E+004, 6.785363000E+000] ), NASA( [ 1000.00, 5000.00], [ 4.573167000E+000, 4.336136000E-003, -1.474689000E-006, 2.348904000E-010, -1.431654000E-014, -1.800696000E+004, 5.011370000E-001] ) ), note = "120186" ) species(name = "ch2o", atoms = " C:1 H:2 O:1 ", thermo = ( NASA( [ 300.00, 1000.00], [ 1.652731000E+000, 1.263144000E-002, -1.888168000E-005, 2.050031000E-008, -8.413237000E-012, -1.486540000E+004, 1.378482000E+001] ), NASA( [ 1000.00, 5000.00], [ 2.995606000E+000, 6.681321000E-003, -2.628955000E-006, 4.737153000E-010, -3.212517000E-014, -1.532037000E+004, 6.912572000E+000] ) ), note = "121286" ) species(name = "ch3o", atoms = " C:1 H:3 O:1 ", thermo = ( NASA( [ 300.00, 1000.00], [ 2.106204000E+000, 7.216595000E-003, 5.338472000E-006, -7.377636000E-009, 2.075611000E-012, 9.786011000E+002, 1.315218000E+001] ), NASA( [ 1000.00, 3000.00], [ 3.770800000E+000, 7.871497000E-003, -2.656384000E-006, 3.944431000E-010, -2.112616000E-014, 1.278325000E+002, 2.929575000E+000] ) ), note = "121686" ) species(name = "c2h6", atoms = " C:2 H:6 ", thermo = ( NASA( [ 300.00, 1384.00], [-2.528543440E-002, 2.407647540E-002, -1.118934720E-005, 2.083409010E-009, -5.298686160E-014, -1.123455340E+004, 2.116487500E+001] ), NASA( [ 1384.00, 5000.00], [ 6.106833850E+000, 1.292363610E-002, -4.425271960E-006, 6.873917260E-010, -3.989017320E-014, -1.375000140E+004, -1.300812500E+001] ) ), note = "1/14/95 therm" ) species(name = "c2h4", atoms = " C:2 H:4 ", thermo = ( NASA( [ 300.00, 1000.00], [-8.614880000E-001, 2.796163000E-002, -3.388677000E-005, 2.785152000E-008, -9.737879000E-012, 5.573046000E+003, 2.421149000E+001] ), NASA( [ 1000.00, 5000.00], [ 3.528419000E+000, 1.148518000E-002, -4.418385000E-006, 7.844601000E-010, -5.266848000E-014, 4.428289000E+003, 2.230389000E+000] ) ), note = "121286" ) species(name = "c2h5", atoms = " C:2 H:5 ", thermo = ( NASA( [ 300.00, 1000.00], [ 2.690702000E+000, 8.719133000E-003, 4.419839000E-006, 9.338703000E-010, -3.927773000E-012, 1.287040000E+004, 1.213820000E+001] ), NASA( [ 1000.00, 5000.00], [ 7.190480000E+000, 6.484077000E-003, -6.428065000E-007, -2.347879000E-010, 3.880877000E-014, 1.067455000E+004, -1.478089000E+001] ) ), note = "12387" ) species(name = "ch2", atoms = " C:1 H:2 ", thermo = ( NASA( [ 250.00, 1000.00], [ 3.762237000E+000, 1.159819000E-003, 2.489585000E-007, 8.800836000E-010, -7.332435000E-013, 4.536791000E+004, 1.712578000E+000] ), NASA( [ 1000.00, 4000.00], [ 3.636408000E+000, 1.933057000E-003, -1.687016000E-007, -1.009899000E-010, 1.808256000E-014, 4.534134000E+004, 2.156561000E+000] ) ), note = "120186" ) species(name = "ch", atoms = " C:1 H:1 ", thermo = ( NASA( [ 300.00, 1000.00], [ 3.200202000E+000, 2.072876000E-003, -5.134431000E-006, 5.733890000E-009, -1.955533000E-012, 7.045259000E+004, 3.331588000E+000] ), NASA( [ 1000.00, 5000.00], [ 2.196223000E+000, 2.340381000E-003, -7.058201000E-007, 9.007582000E-011, -3.855040000E-015, 7.086723000E+004, 9.178373000E+000] ) ), note = "121286" ) species(name = "c2h", atoms = " C:2 H:1 ", thermo = ( NASA( [ 300.00, 1000.00], [ 2.737704000E+000, 8.048446000E-003, -9.244310000E-006, 6.525259000E-009, -1.939580000E-012, 6.683813000E+004, 7.300220000E+000] ), NASA( [ 1000.00, 4000.00], [ 3.986367000E+000, 3.143123000E-003, -1.267243000E-006, 2.924363000E-010, -2.716320000E-014, 6.655884000E+004, 1.191063000E+000] ) ), note = "81193" ) species(name = "c2h2", atoms = " C:2 H:2 ", thermo = ( NASA( [ 300.00, 1000.00], [ 2.013562000E+000, 1.519045000E-002, -1.616319000E-005, 9.078992000E-009, -1.912746000E-012, 2.612444000E+004, 8.805378000E+000] ), NASA( [ 1000.00, 5000.00], [ 4.436770000E+000, 5.376039000E-003, -1.912817000E-006, 3.286379000E-010, -2.156710000E-014, 2.566766000E+004, -2.800338000E+000] ) ), note = "121386" ) species(name = "c2h3", atoms = " C:2 H:3 ", thermo = ( NASA( [ 300.00, 1000.00], [ 2.459276000E+000, 7.371476000E-003, 2.109873000E-006, -1.321642000E-009, -1.184784000E-012, 3.335225000E+004, 1.155620000E+001] ), NASA( [ 1000.00, 5000.00], [ 5.933468000E+000, 4.017746000E-003, -3.966740000E-007, -1.441267000E-010, 2.378644000E-014, 3.185435000E+004, -8.530313000E+000] ) ), note = "12787" ) species(name = "ch3oh", atoms = " C:1 H:4 O:1 ", thermo = ( NASA( [ 300.00, 1000.00], [ 2.660115000E+000, 7.341508000E-003, 7.170051000E-006, -8.793194000E-009, 2.390570000E-012, -2.535348000E+004, 1.123263000E+001] ), NASA( [ 1000.00, 5000.00], [ 4.029061000E+000, 9.376593000E-003, -3.050254000E-006, 4.358793000E-010, -2.224723000E-014, -2.615791000E+004, 2.378196000E+000] ) ), note = "121686" ) species(name = "ch2oh", atoms = " H:3 C:1 O:1 ", thermo = ( NASA( [ 250.00, 1000.00], [ 2.862628000E+000, 1.001527000E-002, -5.285436000E-007, -5.138540000E-009, 2.246041000E-012, -3.349679000E+003, 1.039794000E+001] ), NASA( [ 1000.00, 4000.00], [ 6.327520000E+000, 3.608271000E-003, -3.201547000E-007, -1.938750000E-010, 3.509705000E-014, -4.474509000E+003, -8.329366000E+000] ) ), note = "120186" ) species(name = "ch2co", atoms = " C:2 H:2 O:1 ", thermo = ( NASA( [ 300.00, 1000.00], [ 2.974971000E+000, 1.211871000E-002, -2.345046000E-006, -6.466685000E-009, 3.905649000E-012, -7.632637000E+003, 8.673553000E+000] ), NASA( [ 1000.00, 5000.00], [ 6.038817000E+000, 5.804840000E-003, -1.920954000E-006, 2.794485000E-010, -1.458868000E-014, -8.583402000E+003, -7.657581000E+000] ) ), note = "121686" ) species(name = "hcco", atoms = " H:1 C:2 O:1 ", thermo = ( NASA( [ 300.00, 1000.00], [ 5.047965000E+000, 4.453478000E-003, 2.268283000E-007, -1.482095000E-009, 2.250742000E-013, 1.965892000E+004, 4.818439000E-001] ), NASA( [ 1000.00, 4000.00], [ 6.758073000E+000, 2.000400000E-003, -2.027607000E-007, -1.041132000E-010, 1.965165000E-014, 1.901513000E+004, -9.071262000E+000] ) ), note = "32387" ) species(name = "c2h5oh", atoms = " C:2 H:6 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [ 4.231490450E-001, 2.928581670E-002, -1.738450990E-005, 5.336398920E-009, -6.749172520E-013, -2.956830540E+004, 2.335387630E+001] ), NASA( [ 1391.00, 5000.00], [ 7.952648410E+000, 1.315741440E-002, -4.436933590E-006, 6.822011600E-010, -3.930963350E-014, -3.236029580E+004, -1.765379720E+001] ) ), note = "3/12/95 therm" ) species(name = "pc2h4oh", atoms = " C:2 H:5 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [ 1.177147110E+000, 2.481156850E-002, -1.502995030E-005, 4.790067850E-009, -6.409942110E-013, -4.953690430E+003, 2.200815860E+001] ), NASA( [ 1391.00, 5000.00], [ 7.522419390E+000, 1.104927150E-002, -3.725764650E-006, 5.728273970E-010, -3.300617590E-014, -7.293335900E+003, -1.249587320E+001] ) ), note = "3/12/95 therm" ) species(name = "sc2h4oh", atoms = " C:2 H:5 O:1 ", thermo = ( NASA( [ 300.00, 1392.00], [ 1.914964770E+000, 2.456931450E-002, -1.630753990E-005, 6.122823610E-009, -1.007843630E-012, -8.621615510E+003, 1.659873090E+001] ), NASA( [ 1392.00, 5000.00], [ 7.835245170E+000, 1.088081980E-002, -3.686941270E-006, 5.686013610E-010, -3.282889510E-014, -1.075343110E+004, -1.534957020E+001] ) ), note = "4/ 3/ 0 therm" ) species(name = "ch3co", atoms = " C:2 H:3 O:1 ", thermo = ( NASA( [ 300.00, 1000.00], [ 3.125278000E+000, 9.778220000E-003, 4.521448000E-006, -9.009462000E-009, 3.193718000E-012, -4.108508000E+003, 1.122885000E+001] ), NASA( [ 1000.00, 5000.00], [ 5.612279000E+000, 8.449886000E-003, -2.854147000E-006, 4.238376000E-010, -2.268404000E-014, -5.187863000E+003, -3.274949000E+000] ) ), note = "120186" ) species(name = "ch2cho", atoms = " O:1 H:3 C:2 ", thermo = ( NASA( [ 300.00, 1000.00], [ 3.409062000E+000, 1.073857000E-002, 1.891492000E-006, -7.158583000E-009, 2.867385000E-012, 1.521477000E+003, 9.558290000E+000] ), NASA( [ 1000.00, 5000.00], [ 5.975670000E+000, 8.130591000E-003, -2.743624000E-006, 4.070304000E-010, -2.176017000E-014, 4.903218000E+002, -5.045251000E+000] ) ), note = "110393" ) species(name = "ch3cho", atoms = " C:2 O:1 H:4 ", thermo = ( NASA( [ 300.00, 1000.00], [ 2.505695000E+000, 1.336991000E-002, 4.671953000E-006, -1.128140000E-008, 4.263566000E-012, -2.124589000E+004, 1.335089000E+001] ), NASA( [ 1000.00, 5000.00], [ 5.868650000E+000, 1.079424000E-002, -3.645530000E-006, 5.412912000E-010, -2.896844000E-014, -2.264569000E+004, -6.012946000E+000] ) ), note = "120186" ) species(name = "c3h4-a", atoms = " H:4 C:3 ", thermo = ( NASA( [ 300.00, 1400.00], [ 2.539831000E+000, 1.633437000E-002, -1.764950000E-006, -4.647365000E-009, 1.729131000E-012, 2.251243000E+004, 9.935702000E+000] ), NASA( [ 1400.00, 4000.00], [ 9.776256000E+000, 5.302138000E-003, -3.701118000E-007, -3.026386000E-010, 5.089581000E-014, 1.954972000E+004, -3.077061000E+001] ) ), note = "101993" ) species(name = "c3h4-p", atoms = " H:4 C:3 ", thermo = ( NASA( [ 300.00, 1400.00], [ 3.029730000E+000, 1.498961000E-002, -1.398500000E-006, -3.969619000E-009, 1.388217000E-012, 2.148408000E+004, 8.004594000E+000] ), NASA( [ 1400.00, 4000.00], [ 9.768102000E+000, 5.219151000E-003, -3.753140000E-007, -2.992191000E-010, 5.107878000E-014, 1.860277000E+004, -3.020678000E+001] ) ), note = "101993" ) species(name = "c3h6", atoms = " C:3 H:6 ", thermo = ( NASA( [ 300.00, 1388.00], [ 3.946154440E-001, 2.891076620E-002, -1.548868080E-005, 3.888142090E-009, -3.378903520E-013, 1.066881640E+003, 2.190037360E+001] ), NASA( [ 1388.00, 5000.00], [ 8.015959580E+000, 1.370236340E-002, -4.662497330E-006, 7.212544020E-010, -4.173701260E-014, -1.878212710E+003, -2.001606680E+001] ) ), note = "5/27/97 therm" ) species(name = "c4h6", atoms = " C:4 H:6 ", thermo = ( NASA( [ 300.00, 1398.00], [-1.430951210E+000, 4.787060620E-002, -4.154468000E-005, 1.915495520E-008, -3.571585070E-012, 1.175513140E+004, 2.908258330E+001] ), NASA( [ 1398.00, 5000.00], [ 1.116337890E+001, 1.371639650E-002, -4.697157830E-006, 7.296938360E-010, -4.234862030E-014, 7.790397700E+003, -3.698479490E+001] ) ), note = "4/ 4/ 0 therm" ) species(name = "nc3h7", atoms = " C:3 H:7 ", thermo = ( NASA( [ 300.00, 1000.00], [ 1.922537000E+000, 2.478927000E-002, 1.810249000E-006, -1.783266000E-008, 8.582996000E-012, 9.713281000E+003, 1.399271000E+001] ), NASA( [ 1000.00, 5000.00], [ 7.978291000E+000, 1.576113000E-002, -5.173243000E-006, 7.443892000E-010, -3.824978000E-014, 7.579402000E+003, -1.935611000E+001] ) ), note = "120186" ) species(name = "ic3h7", atoms = " C:3 H:7 ", thermo = ( NASA( [ 300.00, 1000.00], [ 1.713300000E+000, 2.542616000E-002, 1.580808000E-006, -1.821286000E-008, 8.827710000E-012, 7.535809000E+003, 1.297901000E+001] ), NASA( [ 1000.00, 5000.00], [ 8.063369000E+000, 1.574488000E-002, -5.182392000E-006, 7.477245000E-010, -3.854422000E-014, 5.313871000E+003, -2.192647000E+001] ) ), note = "120186" ) species(name = "c3h8", atoms = " C:3 H:8 ", thermo = ( NASA( [ 300.00, 1000.00], [ 8.969208000E-001, 2.668986000E-002, 5.431425000E-006, -2.126001000E-008, 9.243330000E-012, -1.395492000E+004, 1.935533000E+001] ), NASA( [ 1000.00, 5000.00], [ 7.525217000E+000, 1.889034000E-002, -6.283924000E-006, 9.179373000E-010, -4.812410000E-014, -1.646455000E+004, -1.784390000E+001] ) ), note = "120186" ) species(name = "ic4h7", atoms = " C:4 H:7 ", thermo = ( NASA( [ 300.00, 1393.00], [-7.208816970E-004, 4.364957300E-002, -3.163858770E-005, 1.239849830E-008, -2.043783600E-012, 1.457177850E+004, 2.332343400E+001] ), NASA( [ 1393.00, 5000.00], [ 1.163827530E+001, 1.576812990E-002, -5.385388580E-006, 8.351729270E-010, -4.841410830E-014, 1.054716420E+004, -3.902598900E+001] ) ), note = "5/27/97 therm" ) species(name = "ic4h8", atoms = " C:4 H:8 ", thermo = ( NASA( [ 300.00, 1388.00], [ 9.384331730E-001, 3.905472870E-002, -2.164371480E-005, 5.872670770E-009, -6.144354790E-013, -3.748178910E+003, 1.914429850E+001] ), NASA( [ 1388.00, 5000.00], [ 1.122583300E+001, 1.817957980E-002, -6.203485920E-006, 9.614444580E-010, -5.570880570E-014, -7.699837770E+003, -3.733067040E+001] ) ), note = "5/27/97 therm" ) species(name = "c4h7", atoms = " C:4 H:7 ", thermo = ( NASA( [ 300.00, 1392.00], [-3.505083520E-001, 4.265112430E-002, -2.909793730E-005, 1.054039140E-008, -1.600598540E-012, 1.499335910E+004, 2.672956960E+001] ), NASA( [ 1392.00, 5000.00], [ 1.121035780E+001, 1.604831960E-002, -5.465022920E-006, 8.459410530E-010, -4.897727390E-014, 1.090419370E+004, -3.555930150E+001] ) ), note = "2/14/95 therm" ) species(name = "c4h8-2", atoms = " C:4 H:8 ", thermo = ( NASA( [ 300.00, 1384.00], [ 6.692135990E-001, 3.768399410E-002, -1.856896830E-005, 3.695710620E-009, -1.030952090E-013, -3.338193380E+003, 2.148681690E+001] ), NASA( [ 1384.00, 5000.00], [ 1.078643760E+001, 1.846291940E-002, -6.282894900E-006, 9.720521910E-010, -5.625791660E-014, -7.337937170E+003, -3.448927630E+001] ) ), note = "4/ 7/97 therm" ) species(name = "c4h8-1", atoms = " C:4 H:8 ", thermo = ( NASA( [ 300.00, 1392.00], [-8.313720890E-001, 4.525809780E-002, -2.936585590E-005, 1.002204360E-008, -1.431916800E-012, -1.578750350E+003, 2.950842360E+001] ), NASA( [ 1392.00, 5000.00], [ 1.135086680E+001, 1.806178770E-002, -6.160930290E-006, 9.546529590E-010, -5.530896410E-014, -5.978710380E+003, -3.643694380E+001] ) ), note = "4/ 7/97 therm" ) species(name = "sc4h9", atoms = " C:4 H:9 ", thermo = ( NASA( [ 300.00, 1373.00], [ 7.702801430E-001, 3.862809040E-002, -1.571002600E-005, 7.168601090E-010, 7.008012890E-013, 6.288128370E+003, 2.491064890E+001] ), NASA( [ 1373.00, 5000.00], [ 1.182939920E+001, 1.942038120E-002, -6.558351410E-006, 1.009890310E-009, -5.826931760E-014, 1.793159730E+003, -3.682105350E+001] ) ), note = "1/14/95 therm" ) species(name = "pc4h9", atoms = " C:4 H:9 ", thermo = ( NASA( [ 300.00, 1395.00], [-4.377797250E-001, 4.789723640E-002, -3.140231590E-005, 1.097864720E-008, -1.620106640E-012, 7.689452480E+003, 2.868527320E+001] ), NASA( [ 1395.00, 5000.00], [ 1.215100820E+001, 1.943107170E-002, -6.615779500E-006, 1.023751360E-009, -5.925297070E-014, 3.172319420E+003, -3.934258220E+001] ) ), note = "1/14/95 therm" ) species(name = "tc4h9", atoms = " C:4 H:9 ", thermo = ( NASA( [ 300.00, 1381.00], [-2.737292030E+000, 4.553903450E-002, -2.263909390E-005, 4.569510520E-009, -1.553217950E-013, 4.871388870E+003, 4.141448770E+001] ), NASA( [ 1381.00, 5000.00], [ 9.943821130E+000, 2.166930780E-002, -7.470014050E-006, 1.165784540E-009, -6.787918340E-014, -1.896936160E+002, -2.886922860E+001] ) ), note = "1/14/95 therm" ) species(name = "ic4h9", atoms = " C:4 H:9 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.008374700E+000, 5.010870030E-002, -3.419412100E-005, 1.260257830E-008, -1.975520530E-012, 6.655579090E+003, 3.003862040E+001] ), NASA( [ 1393.00, 5000.00], [ 1.227531630E+001, 1.951740060E-002, -6.687730010E-006, 1.039351930E-009, -6.033745020E-014, 1.923953600E+003, -4.158275590E+001] ) ), note = "1/14/95 therm" ) species(name = "ic4h10", atoms = " C:4 H:10 ", thermo = ( NASA( [ 300.00, 1389.00], [-1.012775060E+000, 5.046831810E-002, -3.005020720E-005, 9.154355820E-009, -1.153266830E-012, -1.804956980E+004, 2.742568710E+001] ), NASA( [ 1389.00, 5000.00], [ 1.257331140E+001, 2.189264180E-002, -7.525383500E-006, 1.172054950E-009, -6.814466810E-014, -2.316967460E+004, -4.680442550E+001] ) ), note = "1/14/95 therm" ) species(name = "c4h10", atoms = " C:4 H:10 ", thermo = ( NASA( [ 300.00, 1389.00], [-5.956844730E-001, 4.896057430E-002, -2.826702690E-005, 8.135980600E-009, -9.290981010E-013, -1.699343080E+004, 2.718452120E+001] ), NASA( [ 1389.00, 5000.00], [ 1.250555260E+001, 2.175243930E-002, -7.433849450E-006, 1.153316840E-009, -6.687497620E-014, -2.194793020E+004, -4.449023560E+001] ) ), note = "1/14/95 therm" ) species(name = "ch3coch3", atoms = " C:3 H:6 O:1 ", thermo = ( NASA( [ 300.00, 1374.00], [ 1.307671630E+000, 2.920217420E-002, -1.190456170E-005, 6.521500870E-010, 4.677512030E-013, -2.753282690E+004, 1.963950250E+001] ), NASA( [ 1374.00, 5000.00], [ 9.914219840E+000, 1.460307090E-002, -5.060857650E-006, 7.926828550E-010, -4.627396450E-014, -3.111674230E+004, -2.861132150E+001] ) ), note = "5/ 4/92 therm" ) species(name = "ch3coch2", atoms = " C:3 H:5 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [ 1.803391870E+000, 3.014070850E-002, -1.935055520E-005, 6.381990340E-009, -8.661031800E-013, -5.372332610E+003, 1.780464080E+001] ), NASA( [ 1391.00, 5000.00], [ 1.023039750E+001, 1.164941610E-002, -4.010055370E-006, 6.252052460E-010, -3.637843620E-014, -8.443804620E+003, -2.791972200E+001] ) ), note = "5/ 4/92 therm" ) species(name = "c2h5cho", atoms = " C:3 H:6 O:1 ", thermo = ( NASA( [ 300.00, 1378.00], [ 2.163084440E+000, 2.955012640E-002, -1.524462520E-005, 3.495039470E-009, -2.388966270E-013, -2.422601370E+004, 1.611533480E+001] ), NASA( [ 1378.00, 5000.00], [ 1.024276950E+001, 1.396419890E-002, -4.762480010E-006, 7.381057060E-010, -4.277595030E-014, -2.741431350E+004, -2.853468430E+001] ) ), note = "6/26/95 therm" ) species(name = "c2h5co", atoms = " C:3 H:5 O:1 ", thermo = ( NASA( [ 300.00, 1373.00], [ 2.933139460E+000, 2.474279110E-002, -1.212220030E-005, 2.347010480E-009, -5.268433380E-014, -5.696630630E+003, 1.359583550E+001] ), NASA( [ 1373.00, 5000.00], [ 9.878819970E+000, 1.175156760E-002, -4.006149230E-006, 6.208506170E-010, -3.598352250E-014, -8.472922830E+003, -2.492351960E+001] ) ), note = "6/26/95 therm" ) species(name = "c5h9", atoms = " C:5 H:9 ", thermo = ( NASA( [ 300.00, 1392.00], [-1.380139500E+000, 5.576084870E-002, -3.701439280E-005, 1.268839010E-008, -1.785388350E-012, 1.255898240E+004, 3.264413040E+001] ), NASA( [ 1392.00, 5000.00], [ 1.418604540E+001, 2.071288990E-002, -7.069606170E-006, 1.096071330E-009, -6.353222080E-014, 7.004961350E+003, -5.145017730E+001] ) ), note = "1/14/99 therm" ) species(name = "c5h10-1", atoms = " C:5 H:10 ", thermo = ( NASA( [ 300.00, 1392.00], [-1.062234810E+000, 5.742182940E-002, -3.744868900E-005, 1.273649890E-008, -1.796097890E-012, -4.465466660E+003, 3.227397900E+001] ), NASA( [ 1392.00, 5000.00], [ 1.458515390E+001, 2.240724710E-002, -7.633480250E-006, 1.181889660E-009, -6.843851390E-014, -1.008982050E+004, -5.236839360E+001] ) ), note = "2/14/95 therm" ) species(name = "c5h10-2", atoms = " C:5 H:10 ", thermo = ( NASA( [ 300.00, 1389.00], [-5.415605510E-001, 5.396299180E-002, -3.235087380E-005, 9.774160370E-009, -1.185346680E-012, -5.986061690E+003, 2.971427480E+001] ), NASA( [ 1389.00, 5000.00], [ 1.411092670E+001, 2.283482720E-002, -7.786268350E-006, 1.206274910E-009, -6.987959830E-014, -1.143365070E+004, -5.016011630E+001] ) ), note = "2/14/95 therm" ) species(name = "ic5h12", atoms = " C:5 H:12 ", thermo = ( NASA( [ 300.00, 1390.00], [-1.341317590E+000, 6.313999500E-002, -3.895499170E-005, 1.240669110E-008, -1.640372580E-012, -2.055609440E+004, 3.172549410E+001] ), NASA( [ 1390.00, 5000.00], [ 1.579731450E+001, 2.626133690E-002, -9.008651950E-006, 1.401207520E-009, -8.139440790E-014, -2.690729370E+004, -6.157886640E+001] ) ), note = "7/29/99 therm" ) species(name = "ac5h11", atoms = " C:5 H:11 ", thermo = ( NASA( [ 300.00, 1389.00], [-5.924093950E-001, 5.867349470E-002, -3.659811100E-005, 1.184125410E-008, -1.598458190E-012, 4.059707230E+003, 3.041154900E+001] ), NASA( [ 1389.00, 5000.00], [ 1.538187500E+001, 2.411410420E-002, -8.278475840E-006, 1.288318560E-009, -7.486491880E-014, -1.842961280E+003, -5.649076410E+001] ) ), note = "7/29/99 therm" ) species(name = "bc5h11", atoms = " C:5 H:11 ", thermo = ( NASA( [ 300.00, 1378.00], [ 2.429010650E+000, 4.244073150E-002, -1.305622530E-005, -1.976211330E-009, 1.295291800E-012, 1.383267600E+003, 1.732794840E+001] ), NASA( [ 1378.00, 5000.00], [ 1.390731370E+001, 2.542498900E-002, -8.742893720E-006, 1.362027120E-009, -7.920411570E-014, -3.683870540E+003, -4.796190440E+001] ) ), note = "7/29/99 therm" ) species(name = "cc5h11", atoms = " C:5 H:11 ", thermo = ( NASA( [ 300.00, 1384.00], [-1.240270820E-001, 5.360813140E-002, -2.775320980E-005, 5.910913650E-009, -2.255841420E-013, 2.744456980E+003, 2.942302300E+001] ), NASA( [ 1384.00, 5000.00], [ 1.496943060E+001, 2.416463610E-002, -8.233511100E-006, 1.275108850E-009, -7.385481880E-014, -3.096810680E+003, -5.373137350E+001] ) ), note = "7/29/99 therm" ) species(name = "dc5h11", atoms = " C:5 H:11 ", thermo = ( NASA( [ 300.00, 1389.00], [-5.924093950E-001, 5.867349470E-002, -3.659811100E-005, 1.184125410E-008, -1.598458190E-012, 4.059707230E+003, 3.041154900E+001] ), NASA( [ 1389.00, 5000.00], [ 1.538187500E+001, 2.411410420E-002, -8.278475840E-006, 1.288318560E-009, -7.486491880E-014, -1.842961280E+003, -5.649076410E+001] ) ), note = "7/29/99 therm" ) species(name = "ac5h10", atoms = " C:5 H:10 ", thermo = ( NASA( [ 300.00, 1391.00], [-2.766306030E-001, 5.535392800E-002, -3.544996200E-005, 1.196268540E-008, -1.698782420E-012, -6.395472970E+003, 2.739115780E+001] ), NASA( [ 1391.00, 5000.00], [ 1.456140870E+001, 2.253705380E-002, -7.701000600E-006, 1.194678700E-009, -6.927048080E-014, -1.180045200E+004, -5.306519590E+001] ) ), note = "2/14/95 therm" ) species(name = "bc5h10", atoms = " C:5 H:10 ", thermo = ( NASA( [ 300.00, 1385.00], [ 1.202741470E+000, 4.788721070E-002, -2.481447660E-005, 5.735143550E-009, -3.912666850E-013, -8.152123350E+003, 2.015925790E+001] ), NASA( [ 1385.00, 5000.00], [ 1.399454430E+001, 2.294465820E-002, -7.825941530E-006, 1.212602300E-009, -7.025184570E-014, -1.315769430E+004, -5.040838480E+001] ) ), note = "2/14/95 therm" ) species(name = "cc5h10", atoms = " C:5 H:10 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.836856050E+000, 6.077094660E-002, -4.215925760E-005, 1.561039720E-008, -2.431427660E-012, -5.348642820E+003, 3.452035430E+001] ), NASA( [ 1393.00, 5000.00], [ 1.464919090E+001, 2.254220610E-002, -7.720530010E-006, 1.199586040E-009, -6.963177450E-014, -1.116523320E+004, -5.422522850E+001] ) ), note = "2/14/95 therm" ) species(name = "ic5h9", atoms = " C:5 H:9 ", thermo = ( NASA( [ 300.00, 1385.00], [-3.175943040E-001, 5.224549100E-002, -3.259681300E-005, 1.036280500E-008, -1.360665330E-012, 1.059228260E+004, 2.652052250E+001] ), NASA( [ 1385.00, 5000.00], [ 1.456821060E+001, 2.050212580E-002, -7.114937580E-006, 1.115353140E-009, -6.514609290E-014, 5.040897040E+003, -5.463308880E+001] ) ), note = "2/14/95 therm" ) species(name = "nc5h12", atoms = " C:5 H:12 ", thermo = ( NASA( [ 300.00, 1390.00], [-7.367661190E-001, 6.072009730E-002, -3.575927610E-005, 1.049070410E-008, -1.214873150E-012, -1.989349340E+004, 2.953582860E+001] ), NASA( [ 1390.00, 5000.00], [ 1.572576030E+001, 2.610860450E-002, -8.909709960E-006, 1.381022480E-009, -8.002965360E-014, -2.605195430E+004, -6.033654570E+001] ) ), note = "1/14/95 therm" ) species(name = "c5h11-1", atoms = " C:5 H:11 ", thermo = ( NASA( [ 300.00, 1397.00], [-9.052559120E-001, 6.106328520E-002, -4.094918250E-005, 1.460934700E-008, -2.188596150E-012, 4.839953030E+003, 3.255749630E+001] ), NASA( [ 1397.00, 5000.00], [ 1.532347400E+001, 2.390412000E-002, -8.147716190E-006, 1.261762360E-009, -7.306773350E-014, -9.232416370E+002, -5.495288590E+001] ) ), note = "1/14/95 therm" ) species(name = "c5h11-2", atoms = " C:5 H:11 ", thermo = ( NASA( [ 300.00, 1377.00], [ 4.989435960E-001, 5.098501840E-002, -2.406874880E-005, 3.594652100E-009, 3.013830990E-013, 3.407023660E+003, 2.786009530E+001] ), NASA( [ 1377.00, 5000.00], [ 1.509980070E+001, 2.372253330E-002, -8.013889000E-006, 1.234310390E-009, -7.123001250E-014, -2.334200390E+003, -5.296139790E+001] ) ), note = "1/14/95 therm" ) species(name = "c5h11-3", atoms = " C:5 H:11 ", thermo = ( NASA( [ 300.00, 1377.00], [ 4.989435960E-001, 5.098501840E-002, -2.406874880E-005, 3.594652100E-009, 3.013830990E-013, 3.407023660E+003, 2.717061370E+001] ), NASA( [ 1377.00, 5000.00], [ 1.509980070E+001, 2.372253330E-002, -8.013889000E-006, 1.234310390E-009, -7.123001250E-014, -2.334200390E+003, -5.365087960E+001] ) ), note = "1/14/95 therm" ) species(name = "neoc5h12", atoms = " C:5 H:12 ", thermo = ( NASA( [ 300.00, 1397.00], [-2.883727710E+000, 7.224176870E-002, -5.111061660E-005, 1.873424070E-008, -2.806283130E-012, -2.221710690E+004, 3.367654620E+001] ), NASA( [ 1397.00, 5000.00], [ 1.744893020E+001, 2.454623770E-002, -8.351824790E-006, 1.292197080E-009, -7.479428500E-014, -2.923803330E+004, -7.541739420E+001] ) ), note = "1/14/95 therm" ) species(name = "neoc5h11", atoms = " C:5 H:11 ", thermo = ( NASA( [ 300.00, 1396.00], [-1.581401320E+000, 6.571750670E-002, -4.681203140E-005, 1.747327930E-008, -2.687099250E-012, 2.309337420E+003, 3.133802850E+001] ), NASA( [ 1396.00, 5000.00], [ 1.662383940E+001, 2.270378840E-002, -7.716248350E-006, 1.192898530E-009, -6.900606000E-014, -3.964637550E+003, -6.626283610E+001] ) ), note = "12/ 9/97 therm" ) species(name = "c2h5o", atoms = " C:2 H:5 O:1 ", thermo = ( NASA( [ 300.00, 1389.00], [ 4.944207080E-001, 2.717744340E-002, -1.659090100E-005, 5.152042000E-009, -6.484969150E-013, -3.352529250E+003, 2.280793780E+001] ), NASA( [ 1389.00, 5000.00], [ 7.873397720E+000, 1.130729070E-002, -3.844214210E-006, 5.944141050E-010, -3.438945380E-014, -6.072749530E+003, -1.734167900E+001] ) ), note = "3/12/95 therm" ) species(name = "ch3o2", atoms = " C:1 H:3 O:2 ", thermo = ( NASA( [ 300.00, 1385.00], [ 4.261469060E+000, 1.008735990E-002, -3.215061840E-006, 2.094092670E-010, 4.183391030E-014, -6.843942590E+002, 5.163303200E+000] ), NASA( [ 1385.00, 5000.00], [ 5.957878910E+000, 7.907286260E-003, -2.682462340E-006, 4.138913370E-010, -2.390073300E-014, -1.535748380E+003, -4.719638860E+000] ) ), note = "7/13/98 therm" ) species(name = "c2h5o2", atoms = " C:2 H:5 O:2 ", thermo = ( NASA( [ 300.00, 1382.00], [ 2.268461880E+000, 2.769425780E-002, -1.708041060E-005, 5.879518780E-009, -9.208990690E-013, -5.038807580E+003, 1.647739720E+001] ), NASA( [ 1382.00, 5000.00], [ 9.486960230E+000, 1.244725450E-002, -4.321615760E-006, 6.775830330E-010, -3.957845680E-014, -7.824817950E+003, -2.306130200E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ch3o2h", atoms = " C:1 H:4 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [ 3.234428170E+000, 1.901297670E-002, -1.133862870E-005, 3.403066530E-009, -4.118302220E-013, -1.771979260E+004, 9.256239490E+000] ), NASA( [ 1390.00, 5000.00], [ 8.431170910E+000, 8.068179090E-003, -2.770949210E-006, 4.313322430E-010, -2.506921460E-014, -1.966787710E+004, -1.911706290E+001] ) ), note = "7/13/98 therm" ) species(name = "c2h5o2h", atoms = " C:2 H:6 O:2 ", thermo = ( NASA( [ 300.00, 1383.00], [ 1.299702940E+000, 3.654884200E-002, -2.528088750E-005, 9.197468030E-009, -1.413622330E-012, -2.188666470E+004, 2.027190780E+001] ), NASA( [ 1383.00, 5000.00], [ 1.194429920E+001, 1.262715970E-002, -4.417767550E-006, 6.963273530E-010, -4.082689610E-014, -2.574086340E+004, -3.733823940E+001] ) ), note = "7/19/ 0 therm" ) species(name = "c2h3o1-2", atoms = " C:2 H:3 O:1 ", thermo = ( NASA( [ 300.00, 1492.00], [-1.629651220E+000, 2.934554860E-002, -2.437375500E-005, 1.005223250E-008, -1.612590360E-012, 1.524594250E+004, 3.227827410E+001] ), NASA( [ 1492.00, 5000.00], [ 6.884864710E+000, 6.947205010E-003, -2.232146980E-006, 3.321907670E-010, -1.871245550E-014, 1.264422000E+004, -1.238425700E+001] ) ), note = "4/ 3/ 0 therm" ) species(name = "ch3co2", atoms = " C:2 H:3 O:2 ", thermo = ( NASA( [ 300.00, 1395.00], [ 1.374407680E+000, 2.491156040E-002, -1.743088940E-005, 6.247995080E-009, -9.095168350E-013, -2.723301500E+004, 1.814054540E+001] ), NASA( [ 1395.00, 5000.00], [ 8.540597360E+000, 8.329512140E-003, -2.847220100E-006, 4.419271960E-010, -2.563733940E-014, -2.972906780E+004, -2.038835450E+001] ) ), note = "2/14/95 therm" ) species(name = "c2h4o1-2", atoms = " C:2 H:4 O:1 ", thermo = ( NASA( [ 300.00, 1399.00], [-1.443617900E+000, 2.918371070E-002, -1.968050540E-005, 6.674725750E-009, -9.021393420E-013, -7.434335070E+003, 2.952124530E+001] ), NASA( [ 1399.00, 5000.00], [ 6.994857630E+000, 1.007724590E-002, -3.452209320E-006, 5.365712160E-010, -3.115635430E-014, -1.040913440E+004, -1.598579760E+001] ) ), note = "9/ 1/ 0 therm" ) species(name = "c2h4o2h", atoms = " C:2 H:5 O:2 ", thermo = ( NASA( [ 300.00, 1416.00], [ 3.547211350E+000, 2.684228480E-002, -1.846062160E-005, 6.708756590E-009, -9.954406170E-013, 3.234329790E+003, 1.394366660E+001] ), NASA( [ 1416.00, 5000.00], [ 1.041411610E+001, 1.035354180E-002, -3.408026170E-006, 5.153282000E-010, -2.934432420E-014, 9.204949990E+002, -2.273198610E+001] ) ), note = "7/19/ 0 therm" ) species(name = "o2c2h4oh", atoms = " C:2 H:5 O:3 ", thermo = ( NASA( [ 300.00, 1392.00], [ 4.118394450E+000, 2.722406320E-002, -1.608244300E-005, 5.170334080E-009, -7.316101680E-013, -2.308577850E+004, 1.284821120E+001] ), NASA( [ 1392.00, 5000.00], [ 1.074326590E+001, 1.309577870E-002, -4.453700880E-006, 6.885487380E-010, -3.982301130E-014, -2.559112740E+004, -2.332549530E+001] ) ), note = "2/14/95 therm" ) species(name = "ch3co3", atoms = " C:2 H:3 O:3 ", thermo = ( NASA( [ 300.00, 1391.00], [ 3.603734320E+000, 2.700803410E-002, -2.082934380E-005, 8.505411040E-009, -1.438461100E-012, -2.342051710E+004, 1.120149140E+001] ), NASA( [ 1391.00, 5000.00], [ 1.125224980E+001, 8.336526720E-003, -2.890145300E-006, 4.527817340E-010, -2.643544560E-014, -2.602385840E+004, -2.963704570E+001] ) ), note = "4/ 3/ 0 therm" ) species(name = "ch3co3h", atoms = " C:2 H:4 O:3 ", thermo = ( NASA( [ 300.00, 1391.00], [ 2.241358760E+000, 3.379635140E-002, -2.538874820E-005, 9.675835870E-009, -1.492661570E-012, -4.246778310E+004, 1.706681330E+001] ), NASA( [ 1391.00, 5000.00], [ 1.250604850E+001, 9.477896950E-003, -3.304022460E-006, 5.196307930E-010, -3.042335680E-014, -4.598567030E+004, -3.791959470E+001] ) ), note = "6/26/95 therm" ) species(name = "c2h3co", atoms = " C:3 H:3 O:1 ", thermo = ( NASA( [ 300.00, 1402.00], [ 1.362420130E+000, 3.152739720E-002, -3.002189350E-005, 1.481671120E-008, -2.879715300E-012, 4.257702150E+003, 1.726265460E+001] ), NASA( [ 1402.00, 5000.00], [ 9.374676760E+000, 7.912969000E-003, -2.671982800E-006, 4.111154300E-010, -2.369789810E-014, 1.929695140E+003, -2.408926960E+001] ) ), note = "4/ 3/ 0 therm" ) species(name = "c2h3cho", atoms = " C:3 H:4 O:1 ", thermo = ( NASA( [ 300.00, 1393.00], [ 2.923551620E-001, 3.543214170E-002, -2.949363240E-005, 1.281001240E-008, -2.261441080E-012, -1.165215840E+004, 2.288782800E+001] ), NASA( [ 1393.00, 5000.00], [ 1.041849590E+001, 9.489633210E-003, -3.293105290E-006, 5.162792030E-010, -3.015872910E-014, -1.496302810E+004, -3.072350610E+001] ) ), note = "6/26/95 therm" ) species(name = "c3h5o", atoms = " C:3 H:5 O:1 ", thermo = ( NASA( [ 300.00, 1380.00], [ 1.198225820E+000, 3.055798370E-002, -1.806302760E-005, 4.861500330E-009, -4.198545620E-013, 9.582177840E+003, 2.155662210E+001] ), NASA( [ 1380.00, 5000.00], [ 1.025517520E+001, 1.149837200E-002, -3.846456590E-006, 5.889103460E-010, -3.385579230E-014, 6.265608100E+003, -2.776550420E+001] ) ), note = "7/20/95 therm" ) species(name = "c3h6ooh1-2", atoms = " C:3 H:7 O:2 ", thermo = ( NASA( [ 300.00, 1402.00], [ 2.877745620E+000, 3.741669990E-002, -2.360580630E-005, 7.799308600E-009, -1.060425620E-012, -7.823681190E+002, 1.939413400E+001] ), NASA( [ 1402.00, 5000.00], [ 1.246057630E+001, 1.588895260E-002, -5.327421060E-006, 8.158187910E-010, -4.687232500E-014, -4.203051960E+003, -3.238589470E+001] ) ), note = "7/19/ 0 therm" ) species(name = "c3h6ooh1-3", atoms = " C:3 H:7 O:2 ", thermo = ( NASA( [ 300.00, 1384.00], [ 1.883314650E+000, 4.401560510E-002, -3.078584620E-005, 1.132148620E-008, -1.753231840E-012, -1.687791680E+002, 2.140406210E+001] ), NASA( [ 1384.00, 5000.00], [ 1.468815640E+001, 1.499412000E-002, -5.240565050E-006, 8.254627110E-010, -4.837589520E-014, -4.773428630E+003, -4.779844920E+001] ) ), note = "7/19/ 0 therm" ) species(name = "c3h6ooh2-1", atoms = " C:3 H:7 O:2 ", thermo = ( NASA( [ 300.00, 1407.00], [ 2.091939500E+000, 4.692203940E-002, -3.902808310E-005, 1.723814530E-008, -3.079689790E-012, -1.893779180E+003, 2.001782820E+001] ), NASA( [ 1407.00, 5000.00], [ 1.421632210E+001, 1.433824500E-002, -4.780044770E-006, 7.291331340E-010, -4.177619730E-014, -5.673816200E+003, -4.357709970E+001] ) ), note = "7/19/ 0 therm" ) species(name = "c3h6ooh1-2o2", atoms = " C:3 H:7 O:4 ", thermo = ( NASA( [ 300.00, 1386.00], [ 2.651965840E+000, 5.746381490E-002, -4.721908670E-005, 2.055915570E-008, -3.687873870E-012, -2.088293710E+004, 2.015479550E+001] ), NASA( [ 1386.00, 5000.00], [ 1.917591590E+001, 1.598570130E-002, -5.613063780E-006, 8.868804950E-010, -5.208770400E-014, -2.644121150E+004, -6.775129360E+001] ) ), note = "7/19/ 0 trm" ) species(name = "c3h6ooh1-3o2", atoms = " C:3 H:7 O:4 ", thermo = ( NASA( [ 300.00, 1382.00], [ 3.148645880E+000, 5.335425710E-002, -4.083306110E-005, 1.675422200E-008, -2.892883260E-012, -1.854736450E+004, 1.863054310E+001] ), NASA( [ 1382.00, 5000.00], [ 1.859166980E+001, 1.653285530E-002, -5.813436260E-006, 9.193969390E-010, -5.403207020E-014, -2.395986980E+004, -6.425444020E+001] ) ), note = "7/19/ 0 trm" ) species(name = "c3h6ooh2-1o2", atoms = " C:3 H:7 O:4 ", thermo = ( NASA( [ 300.00, 1386.00], [ 2.651965840E+000, 5.746381490E-002, -4.721908670E-005, 2.055915570E-008, -3.687873870E-012, -2.088293710E+004, 2.015479550E+001] ), NASA( [ 1386.00, 5000.00], [ 1.917591590E+001, 1.598570130E-002, -5.613063780E-006, 8.868804950E-010, -5.208770400E-014, -2.644121150E+004, -6.775129360E+001] ) ), note = "7/19/ 0 trm" ) species(name = "nc3h7o", atoms = " C:3 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [ 2.897065140E-001, 3.930755600E-002, -2.480693550E-005, 8.070835730E-009, -1.079982900E-012, -6.244742690E+003, 2.543878100E+001] ), NASA( [ 1390.00, 5000.00], [ 1.101303080E+001, 1.581102710E-002, -5.387432150E-006, 8.342648250E-010, -4.831473490E-014, -1.015289680E+004, -3.275116890E+001] ) ), note = "4/ 7/97 therm" ) species(name = "ic3h7o", atoms = " C:3 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1395.00], [-1.003695760E-001, 4.311189280E-002, -3.106318170E-005, 1.206683640E-008, -1.972149670E-012, -8.449029980E+003, 2.576500100E+001] ), NASA( [ 1395.00, 5000.00], [ 1.145927530E+001, 1.559028120E-002, -5.344432270E-006, 8.308581060E-010, -4.824552890E-014, -1.246385310E+004, -3.622036240E+001] ) ), note = "4/ 7/97 therm" ) species(name = "nc3h7o2h", atoms = " C:3 H:8 O:2 ", thermo = ( NASA( [ 300.00, 1385.00], [ 1.133666960E+000, 4.849199040E-002, -3.318014570E-005, 1.193082780E-008, -1.809053720E-012, -2.478454930E+004, 2.272560880E+001] ), NASA( [ 1385.00, 5000.00], [ 1.508955010E+001, 1.717147070E-002, -5.984988790E-006, 9.409644120E-010, -5.507283810E-014, -2.983524450E+004, -5.280901660E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ic3h7o2h", atoms = " C:3 H:8 O:2 ", thermo = ( NASA( [ 300.00, 1389.00], [ 5.192655700E-001, 5.321112280E-002, -4.051568920E-005, 1.633467130E-008, -2.737512330E-012, -2.710484860E+004, 2.408150650E+001] ), NASA( [ 1389.00, 5000.00], [ 1.570463910E+001, 1.659245160E-002, -5.772509340E-006, 9.064530700E-010, -5.300841110E-014, -3.232685640E+004, -5.717351560E+001] ) ), note = "7/19/ 0 therm" ) species(name = "nc3h7o2", atoms = " C:3 H:7 O:2 ", thermo = ( NASA( [ 300.00, 1384.00], [ 2.107314920E+000, 3.961649860E-002, -2.494915990E-005, 8.594503000E-009, -1.312403300E-012, -7.937455670E+003, 1.890827480E+001] ), NASA( [ 1384.00, 5000.00], [ 1.263270590E+001, 1.699107260E-002, -5.888668730E-006, 9.221953960E-010, -5.382306750E-014, -1.191946520E+004, -3.853492970E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ic3h7o2", atoms = " C:3 H:7 O:2 ", thermo = ( NASA( [ 300.00, 1388.00], [ 1.499416390E+000, 4.430812050E-002, -3.224144560E-005, 1.296871360E-008, -2.233705690E-012, -1.025879800E+004, 2.023364900E+001] ), NASA( [ 1388.00, 5000.00], [ 1.324934930E+001, 1.640821900E-002, -5.674320620E-006, 8.873363400E-010, -5.173615350E-014, -1.441098550E+004, -4.290662130E+001] ) ), note = "7/19/ 0 therm" ) species(name = "c3h6o1-3", atoms = " C:3 H:6 O:1 ", thermo = ( NASA( [ 300.00, 2035.00], [-2.757179960E+000, 4.263716020E-002, -2.568312310E-005, 6.629812080E-009, -5.311933250E-013, -1.009903750E+004, 3.671818040E+001] ), NASA( [ 2035.00, 5000.00], [ 1.023639530E+001, 1.505147050E-002, -5.636365340E-006, 9.324634550E-010, -5.661024410E-014, -1.462120290E+004, -3.367247320E+001] ) ), note = "1/22/95 therm" ) species(name = "ic4h8o", atoms = " C:4 H:8 O:1 ", thermo = ( NASA( [ 300.00, 1399.00], [-2.973737410E+000, 6.246186370E-002, -5.043482110E-005, 2.133453600E-008, -3.673828240E-012, -1.732743180E+004, 3.623363620E+001] ), NASA( [ 1399.00, 5000.00], [ 1.446248300E+001, 1.805628600E-002, -6.180087910E-006, 9.599413410E-010, -5.571322970E-014, -2.302306160E+004, -5.611901650E+001] ) ), note = "7/19/95 therm" ) species(name = "ic4h8oh", atoms = " C:4 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1376.00], [ 3.296127070E+000, 3.476496470E-002, -1.025056180E-005, -2.046419310E-009, 1.188794080E-012, -1.456272470E+004, 1.586063200E+001] ), NASA( [ 1376.00, 5000.00], [ 1.256059970E+001, 2.106374880E-002, -7.150196480E-006, 1.104392620E-009, -6.384286950E-014, -1.862032490E+004, -3.678894300E+001] ) ), note = "2/14/95 therm" ) species(name = "io2c4h8oh", atoms = " C:4 H:9 O:3 ", thermo = ( NASA( [ 300.00, 1395.00], [ 2.888260080E+000, 5.803631240E-002, -4.266908740E-005, 1.717593320E-008, -2.918421860E-012, -3.338815030E+004, 1.833811490E+001] ), NASA( [ 1395.00, 5000.00], [ 1.797982080E+001, 2.134521150E-002, -7.291081980E-006, 1.130688460E-009, -6.554022360E-014, -3.857699170E+004, -6.235535220E+001] ) ), note = "8/23/95 therm" ) species(name = "ic4h7o", atoms = " C:4 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1386.00], [ 1.747006870E+000, 4.077834360E-002, -2.447502430E-005, 7.065029580E-009, -7.515705890E-013, 4.869792330E+003, 1.945359990E+001] ), NASA( [ 1386.00, 5000.00], [ 1.334576150E+001, 1.612185880E-002, -5.443764030E-006, 8.381993740E-010, -4.836082800E-014, 6.114436440E+002, -4.368188380E+001] ) ), note = "4/ 3/ 0 therm" ) species(name = "c4h7o", atoms = " C:4 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1395.00], [-1.606191920E+000, 5.585626820E-002, -4.355957670E-005, 1.705892790E-008, -2.656351800E-012, 4.850903260E+003, 3.471125590E+001] ), NASA( [ 1395.00, 5000.00], [ 1.531377800E+001, 1.434270170E-002, -4.816255170E-006, 7.395748390E-010, -4.261408140E-014, -7.293428840E+002, -5.529378590E+001] ) ), note = "4/ 3/ 0 therm" ) species(name = "c4h8oh-1", atoms = " C:4 H:9 O:1 ", thermo = ( NASA( [ 300.00, 2017.00], [ 8.937294800E-001, 4.564585520E-002, -2.509188810E-005, 6.241301810E-009, -4.995335120E-013, -1.200516960E+004, 2.784533520E+001] ), NASA( [ 2017.00, 5000.00], [ 1.224116980E+001, 2.141927990E-002, -7.365401760E-006, 1.153468650E-009, -6.748439410E-014, -1.593140410E+004, -3.356596130E+001] ) ), note = "2/14/95 therm" ) species(name = "c4h8oh-2", atoms = " C:4 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [ 7.342258480E-001, 4.822335060E-002, -2.925661100E-005, 8.783960670E-009, -1.018125190E-012, -1.423945560E+004, 2.714276930E+001] ), NASA( [ 1390.00, 5000.00], [ 1.400989640E+001, 1.963039980E-002, -6.614838070E-006, 1.016862760E-009, -5.859507470E-014, -1.908659000E+004, -4.500525420E+001] ) ), note = "2/14/95 therm" ) species(name = "c4h8oh-1o2", atoms = " C:4 H:9 O:3 ", thermo = ( NASA( [ 300.00, 1396.00], [ 2.884973980E+000, 5.632879290E-002, -3.984035030E-005, 1.538916430E-008, -2.519407870E-012, -3.052467210E+004, 2.092933550E+001] ), NASA( [ 1396.00, 5000.00], [ 1.743832470E+001, 2.167788760E-002, -7.377726280E-006, 1.141288110E-009, -6.603914510E-014, -3.558926200E+004, -5.712471400E+001] ) ), note = "6/26/95 therm" ) species(name = "c4h8oh-2o2", atoms = " C:4 H:9 O:3 ", thermo = ( NASA( [ 300.00, 1399.00], [ 2.100035040E+000, 6.175282180E-002, -4.772385410E-005, 1.991457840E-008, -3.444162750E-012, -3.266987550E+004, 2.309012710E+001] ), NASA( [ 1399.00, 5000.00], [ 1.829428710E+001, 2.093953890E-002, -7.120969340E-006, 1.101030940E-009, -6.368897680E-014, -3.805058550E+004, -6.291543260E+001] ) ), note = "6/26/95 therm" ) species(name = "c4h8ooh1-2o2", atoms = " C:4 H:9 O:4 ", thermo = ( NASA( [ 300.00, 1387.00], [ 2.224007280E+000, 7.049946200E-002, -5.669788270E-005, 2.426277510E-008, -4.297154590E-012, -2.373914900E+004, 2.383715330E+001] ), NASA( [ 1387.00, 5000.00], [ 2.232440150E+001, 2.054747750E-002, -7.190763480E-006, 1.133615360E-009, -6.647443830E-014, -3.054682770E+004, -8.326660700E+001] ) ), note = "7/19/ 0 trm" ) species(name = "c4h8ooh1-3o2", atoms = " C:4 H:9 O:4 ", thermo = ( NASA( [ 300.00, 1387.00], [ 2.224007280E+000, 7.049946200E-002, -5.669788270E-005, 2.426277510E-008, -4.297154590E-012, -2.373914900E+004, 2.383715330E+001] ), NASA( [ 1387.00, 5000.00], [ 2.232440150E+001, 2.054747750E-002, -7.190763480E-006, 1.133615360E-009, -6.647443830E-014, -3.054682770E+004, -8.326660700E+001] ) ), note = "7/19/ 0 trm" ) species(name = "c4h8ooh1-4o2", atoms = " C:4 H:9 O:4 ", thermo = ( NASA( [ 300.00, 1383.00], [ 3.123517170E+000, 6.467259080E-002, -4.783579140E-005, 1.896568170E-008, -3.180258280E-012, -2.146643000E+004, 2.043224940E+001] ), NASA( [ 1383.00, 5000.00], [ 2.171164700E+001, 2.112161720E-002, -7.401014480E-006, 1.167729590E-009, -6.851398460E-014, -2.804831240E+004, -7.958852490E+001] ) ), note = "7/19/ 0 trm" ) species(name = "c4h8ooh2-1o2", atoms = " C:4 H:9 O:4 ", thermo = ( NASA( [ 300.00, 1387.00], [ 2.224007280E+000, 7.049946200E-002, -5.669788270E-005, 2.426277510E-008, -4.297154590E-012, -2.373914900E+004, 2.383715330E+001] ), NASA( [ 1387.00, 5000.00], [ 2.232440150E+001, 2.054747750E-002, -7.190763480E-006, 1.133615360E-009, -6.647443830E-014, -3.054682770E+004, -8.326660700E+001] ) ), note = "7/19/ 0 trm" ) species(name = "c4h8ooh2-3o2", atoms = " C:4 H:9 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 2.192480060E+000, 7.367634300E-002, -6.244283000E-005, 2.793713070E-008, -5.101260130E-012, -2.617735380E+004, 2.295687520E+001] ), NASA( [ 1389.00, 5000.00], [ 2.299510440E+001, 1.992389190E-002, -6.963267650E-006, 1.096778320E-009, -6.427472810E-014, -3.300954080E+004, -8.714619580E+001] ) ), note = "7/19/ 0 trm" ) species(name = "c4h8ooh2-4o2", atoms = " C:4 H:9 O:4 ", thermo = ( NASA( [ 300.00, 1387.00], [ 2.224007280E+000, 7.049946200E-002, -5.669788270E-005, 2.426277510E-008, -4.297154590E-012, -2.373914900E+004, 2.383715330E+001] ), NASA( [ 1387.00, 5000.00], [ 2.232440150E+001, 2.054747750E-002, -7.190763480E-006, 1.133615360E-009, -6.647443830E-014, -3.054682770E+004, -8.326660700E+001] ) ), note = "7/19/ 0 trm" ) species(name = "tc4h8ooh-io2", atoms = " C:4 H:9 O:4 ", thermo = ( NASA( [ 300.00, 1386.00], [ 2.177820960E+000, 7.177851180E-002, -5.888360460E-005, 2.567591710E-008, -4.616786430E-012, -2.556223780E+004, 2.078462310E+001] ), NASA( [ 1386.00, 5000.00], [ 2.263828890E+001, 2.032461430E-002, -7.123907700E-006, 1.124250280E-009, -6.597329930E-014, -3.244068770E+004, -8.803878430E+001] ) ), note = "7/19/ 0 trm" ) species(name = "ic4h8ooh-io2", atoms = " C:4 H:9 O:4 ", thermo = ( NASA( [ 300.00, 1385.00], [ 2.394244260E+000, 6.765725490E-002, -5.170836820E-005, 2.107960410E-008, -3.599603730E-012, -2.247874950E+004, 2.250298390E+001] ), NASA( [ 1385.00, 5000.00], [ 2.189695810E+001, 2.096378740E-002, -7.346649000E-006, 1.159265940E-009, -6.802254130E-014, -2.926648890E+004, -8.205408070E+001] ) ), note = "7/19/ 0 trm" ) species(name = "ic4h8ooh-to2", atoms = " C:4 H:9 O:4 ", thermo = ( NASA( [ 300.00, 1386.00], [ 2.177820960E+000, 7.177851180E-002, -5.888360460E-005, 2.567591710E-008, -4.616786430E-012, -2.556223780E+004, 2.078462310E+001] ), NASA( [ 1386.00, 5000.00], [ 2.263828890E+001, 2.032461430E-002, -7.123907700E-006, 1.124250280E-009, -6.597329930E-014, -3.244068770E+004, -8.803878430E+001] ) ), note = "7/19/ 0 trm" ) species(name = "c4h8ooh1-2", atoms = " C:4 H:9 O:2 ", thermo = ( NASA( [ 300.00, 1393.00], [ 1.516982340E+000, 5.445843310E-002, -3.845243190E-005, 1.481455230E-008, -2.428094340E-012, -3.497284230E+003, 2.649169260E+001] ), NASA( [ 1393.00, 5000.00], [ 1.583279060E+001, 2.072204360E-002, -7.098690280E-006, 1.103020450E-009, -6.402519840E-014, -8.530343140E+003, -5.043998280E+001] ) ), note = "7/19/ 0 therm" ) species(name = "c4h8ooh1-3", atoms = " C:4 H:9 O:2 ", thermo = ( NASA( [ 300.00, 1377.00], [ 1.941062760E+000, 5.187893510E-002, -3.104116830E-005, 8.635688810E-009, -8.428419940E-013, -4.343159620E+003, 2.402304710E+001] ), NASA( [ 1377.00, 5000.00], [ 1.764421700E+001, 1.917065360E-002, -6.571686410E-006, 1.022465710E-009, -5.943047350E-014, -1.018592800E+004, -6.171158130E+001] ) ), note = "7/19/ 0 therm" ) species(name = "c4h8ooh1-4", atoms = " C:4 H:9 O:2 ", thermo = ( NASA( [ 300.00, 1386.00], [ 1.450170840E+000, 5.724189910E-002, -4.064312180E-005, 1.528217930E-008, -2.421232180E-012, -3.029055220E+003, 2.507378900E+001] ), NASA( [ 1386.00, 5000.00], [ 1.786237000E+001, 1.952125010E-002, -6.803511730E-006, 1.069605290E-009, -6.260005400E-014, -8.879230080E+003, -6.343933590E+001] ) ), note = "7/19/ 0 therm" ) species(name = "c4h8ooh2-1", atoms = " C:4 H:9 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [ 1.017116810E+000, 6.105608660E-002, -4.657891850E-005, 1.880241380E-008, -3.152655750E-012, -5.373914740E+003, 2.630596910E+001] ), NASA( [ 1390.00, 5000.00], [ 1.845556730E+001, 1.895437190E-002, -6.593814570E-006, 1.035383700E-009, -6.054671010E-014, -1.136371000E+004, -6.698391380E+001] ) ), note = "7/19/ 0 therm" ) species(name = "c4h8ooh2-3", atoms = " C:4 H:9 O:2 ", thermo = ( NASA( [ 300.00, 1387.00], [ 1.454362660E+000, 5.631212860E-002, -3.841614250E-005, 1.342292970E-008, -1.923829140E-012, -6.689161160E+003, 2.542475540E+001] ), NASA( [ 1387.00, 5000.00], [ 1.793384720E+001, 1.921536230E-002, -6.644869610E-006, 1.039400070E-009, -6.062398620E-014, -1.257679130E+004, -6.361940890E+001] ) ), note = "7/19/ 0 therm" ) species(name = "c4h8ooh2-4", atoms = " C:4 H:9 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [ 1.017116810E+000, 6.105608660E-002, -4.657891850E-005, 1.880241380E-008, -3.152655750E-012, -5.373914740E+003, 2.630596910E+001] ), NASA( [ 1390.00, 5000.00], [ 1.845556730E+001, 1.895437190E-002, -6.593814570E-006, 1.035383700E-009, -6.054671010E-014, -1.136371000E+004, -6.698391380E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ic4h8o2h-i", atoms = " C:4 H:9 O:2 ", thermo = ( NASA( [ 300.00, 1388.00], [ 9.947847930E-001, 5.892122400E-002, -4.252022250E-005, 1.613705740E-008, -2.559049020E-012, -4.080290570E+003, 2.589508800E+001] ), NASA( [ 1388.00, 5000.00], [ 1.802464560E+001, 1.936682640E-002, -6.746764960E-006, 1.060401290E-009, -6.205064450E-014, -1.008589770E+004, -6.576296930E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ic4h8o2h-t", atoms = " C:4 H:9 O:2 ", thermo = ( NASA( [ 300.00, 1397.00], [ 3.776330010E+000, 4.508892690E-002, -2.624238750E-005, 7.747369000E-009, -9.115203930E-013, -5.982958420E+003, 1.535033990E+001] ), NASA( [ 1397.00, 5000.00], [ 1.523950120E+001, 2.064969830E-002, -6.947919270E-006, 1.066510970E-009, -6.137827540E-014, -1.022711990E+004, -4.709085850E+001] ) ), note = "7/19/ 0 therm" ) species(name = "tc4h8o2h-i", atoms = " C:4 H:9 O:2 ", thermo = ( NASA( [ 300.00, 1405.00], [ 1.574697230E+000, 6.046486590E-002, -4.849918140E-005, 2.052361810E-008, -3.529747220E-012, -6.541909010E+003, 2.168527000E+001] ), NASA( [ 1405.00, 5000.00], [ 1.780602530E+001, 1.849527160E-002, -6.212684230E-006, 9.527539620E-010, -5.480103300E-014, -1.175558160E+004, -6.401802360E+001] ) ), note = "7/19/ 0 therm" ) species(name = "c4h8o1-2", atoms = " C:4 H:8 O:1 ", thermo = ( NASA( [ 300.00, 1399.00], [-2.420330730E+000, 5.793085080E-002, -4.302364990E-005, 1.666797930E-008, -2.647143500E-012, -1.539508800E+004, 3.664252420E+001] ), NASA( [ 1399.00, 5000.00], [ 1.391972900E+001, 1.855514920E-002, -6.360141790E-006, 9.888446450E-010, -5.742747790E-014, -2.094525480E+004, -5.067882310E+001] ) ), note = "4/ 3/ 0 therm" ) species(name = "c4h8o1-3", atoms = " C:4 H:8 O:1 ", thermo = ( NASA( [ 300.00, 1371.00], [-2.536901040E+000, 5.439957070E-002, -3.433903050E-005, 1.010799220E-008, -1.102627360E-012, -1.529806800E+004, 3.674007190E+001] ), NASA( [ 1371.00, 5000.00], [ 1.542270920E+001, 1.702110520E-002, -6.063479510E-006, 9.673547620E-010, -5.719924190E-014, -2.201941740E+004, -6.138718620E+001] ) ), note = "1/22/95 therm" ) species(name = "c4h8o1-4", atoms = " C:4 H:8 O:1 ", thermo = ( NASA( [ 300.00, 1361.00], [-3.285055610E+000, 5.048009020E-002, -2.519989840E-005, 3.657437440E-009, 3.948631610E-013, -2.300674220E+004, 4.193492530E+001] ), NASA( [ 1361.00, 5000.00], [ 1.423607310E+001, 1.811761050E-002, -6.462638090E-006, 1.031943720E-009, -6.105573310E-014, -2.994786700E+004, -5.520810410E+001] ) ), note = "1/22/95 therm" ) species(name = "c4h8o2-3", atoms = " C:4 H:8 O:1 ", thermo = ( NASA( [ 300.00, 1384.00], [-2.987011970E+000, 6.326788800E-002, -5.208557770E-005, 2.240643640E-008, -3.954166180E-012, -1.719571960E+004, 3.669203900E+001] ), NASA( [ 1384.00, 5000.00], [ 1.582638590E+001, 1.644009380E-002, -5.806803110E-006, 9.211460000E-010, -5.425110020E-014, -2.353345730E+004, -6.348445620E+001] ) ), note = "1/22/95 therm" ) species(name = "cc4h8o", atoms = " C:4 H:8 O:1 ", thermo = ( NASA( [ 300.00, 1401.00], [-5.277682300E+000, 6.524822420E-002, -5.002090300E-005, 1.974521790E-008, -3.156058130E-012, -1.377065220E+004, 4.785006880E+001] ), NASA( [ 1401.00, 5000.00], [ 1.351317040E+001, 1.916664410E-002, -6.539023590E-006, 1.013665700E-009, -5.875466710E-014, -2.003114880E+004, -5.221469670E+001] ) ), note = "6/29/95 therm" ) species(name = "pc4h9o", atoms = " C:4 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [ 9.675406510E-002, 5.137750420E-002, -3.290327200E-005, 1.091051030E-008, -1.494331370E-012, -9.138698020E+003, 2.801589340E+001] ), NASA( [ 1391.00, 5000.00], [ 1.416407000E+001, 2.031876240E-002, -6.935110830E-006, 1.075136720E-009, -6.231274100E-014, -1.424206010E+004, -4.823674010E+001] ) ), note = "4/ 7/97 therm" ) species(name = "sc4h9o", atoms = " C:4 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1395.00], [-2.833577190E-001, 5.516776010E-002, -3.909344940E-005, 1.480250000E-008, -2.349147740E-012, -1.134572610E+004, 2.897692920E+001] ), NASA( [ 1395.00, 5000.00], [ 1.463750830E+001, 2.002476450E-002, -6.855915560E-006, 1.064955310E-009, -6.180396020E-014, -1.654824500E+004, -5.113730310E+001] ) ), note = "4/ 7/97 therm" ) species(name = "ic4h9o", atoms = " C:4 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1393.00], [-7.351444800E-001, 5.474968580E-002, -3.718589860E-005, 1.317283140E-008, -1.927621490E-012, -1.002862060E+004, 3.056771830E+001] ), NASA( [ 1393.00, 5000.00], [ 1.444102110E+001, 2.002363840E-002, -6.821234810E-006, 1.056196640E-009, -6.116567490E-014, -1.538811770E+004, -5.122265340E+001] ) ), note = "4/ 3/ 0 therm" ) species(name = "tc4h9o", atoms = " C:4 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1394.00], [-7.704640680E-001, 5.819266600E-002, -4.361979210E-005, 1.749422190E-008, -2.918360400E-012, -1.365028050E+004, 2.775765130E+001] ), NASA( [ 1394.00, 5000.00], [ 1.503989780E+001, 1.962558480E-002, -6.706642800E-006, 1.040538230E-009, -6.033983420E-014, -1.902439040E+004, -5.665239380E+001] ) ), note = "4/ 7/97 therm" ) species(name = "pc4h9o2h", atoms = " C:4 H:10 O:2 ", thermo = ( NASA( [ 300.00, 1387.00], [ 6.346442860E-001, 6.200076570E-002, -4.344777490E-005, 1.614076160E-008, -2.531215070E-012, -2.763458050E+004, 2.670260900E+001] ), NASA( [ 1387.00, 5000.00], [ 1.826874540E+001, 2.169400790E-002, -7.546298280E-006, 1.184848060E-009, -6.928184980E-014, -3.394416330E+004, -6.848163000E+001] ) ), note = "7/19/ 0 therm" ) species(name = "sc4h9o2h", atoms = " C:4 H:10 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [ 3.405876570E-001, 6.520780690E-002, -4.848404600E-005, 1.910118300E-008, -3.138330730E-012, -3.000079600E+004, 2.728354510E+001] ), NASA( [ 1390.00, 5000.00], [ 1.885879160E+001, 2.112009870E-002, -7.332055680E-006, 1.149698420E-009, -6.716569910E-014, -3.642360580E+004, -7.200264580E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ic4h9o2h", atoms = " C:4 H:10 O:2 ", thermo = ( NASA( [ 300.00, 1388.00], [ 2.441818990E-001, 6.340278410E-002, -4.491623790E-005, 1.674068770E-008, -2.612164780E-012, -2.869598080E+004, 2.721562290E+001] ), NASA( [ 1388.00, 5000.00], [ 1.843087940E+001, 2.153376060E-002, -7.486239650E-006, 1.174992400E-009, -6.868907880E-014, -3.514832770E+004, -7.080308460E+001] ) ), note = "7/19/ 0 therm" ) species(name = "tc4h9o2h", atoms = " C:4 H:10 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [ 1.145059320E-001, 6.715078540E-002, -5.155784100E-005, 2.102563650E-008, -3.564670240E-012, -3.179287250E+004, 2.400110300E+001] ), NASA( [ 1390.00, 5000.00], [ 1.916170410E+001, 2.091572490E-002, -7.273468210E-006, 1.141809890E-009, -6.675771350E-014, -3.832016870E+004, -7.782308740E+001] ) ), note = "7/19/ 0 therm" ) species(name = "tc4h9o2", atoms = " C:4 H:9 O:2 ", thermo = ( NASA( [ 300.00, 1388.00], [ 1.087425830E+000, 5.827807090E-002, -4.332926970E-005, 1.768925350E-008, -3.067696060E-012, -1.494566400E+004, 2.018719630E+001] ), NASA( [ 1388.00, 5000.00], [ 1.670615560E+001, 2.073277800E-002, -7.175961690E-006, 1.122824730E-009, -6.549413860E-014, -2.040469240E+004, -6.355586080E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ic4h9o2", atoms = " C:4 H:9 O:2 ", thermo = ( NASA( [ 300.00, 1387.00], [ 1.214342930E+000, 5.453883110E-002, -3.670015930E-005, 1.341310420E-008, -2.117417930E-012, -1.184824500E+004, 2.341530480E+001] ), NASA( [ 1387.00, 5000.00], [ 1.597412210E+001, 2.135347400E-002, -7.390011050E-006, 1.156244110E-009, -6.744080460E-014, -1.723293040E+004, -5.653024090E+001] ) ), note = "7/19/ 0 therm" ) species(name = "sc4h9o2", atoms = " C:4 H:9 O:2 ", thermo = ( NASA( [ 300.00, 1389.00], [ 1.326890440E+000, 5.627855830E-002, -4.017177860E-005, 1.571209670E-008, -2.629484430E-012, -1.315570570E+004, 2.340696590E+001] ), NASA( [ 1389.00, 5000.00], [ 1.640311350E+001, 2.093610060E-002, -7.233930110E-006, 1.130589960E-009, -6.589386670E-014, -1.850745170E+004, -5.773316360E+001] ) ), note = "7/19/ 0 therm" ) species(name = "pc4h9o2", atoms = " C:4 H:9 O:2 ", thermo = ( NASA( [ 300.00, 1385.00], [ 1.943636500E+000, 5.155131630E-002, -3.282844000E-005, 1.130648600E-008, -1.701186060E-012, -1.083581030E+004, 2.135031490E+001] ), NASA( [ 1385.00, 5000.00], [ 1.578454480E+001, 2.152109100E-002, -7.449090170E-006, 1.165580710E-009, -6.798856090E-014, -1.601460540E+004, -5.403885250E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ch3coch2o2", atoms = " C:3 H:5 O:3 ", thermo = ( NASA( [ 300.00, 1379.00], [ 5.955354680E+000, 2.702552050E-002, -1.373850310E-005, 3.537358510E-009, -4.039225570E-013, -2.066794640E+004, 5.214360490E+000] ), NASA( [ 1379.00, 5000.00], [ 1.276903420E+001, 1.425548280E-002, -4.928214610E-006, 7.704489210E-010, -4.491105340E-014, -2.347986690E+004, -3.271557990E+001] ) ), note = "2/14/95" ) species(name = "ch3coch2o2h", atoms = " C:3 H:6 O:3 ", thermo = ( NASA( [ 300.00, 1381.00], [ 4.947897610E+000, 3.604744320E-002, -2.217199330E-005, 6.982968740E-009, -9.212692600E-013, -3.886871780E+004, 8.499261300E+000] ), NASA( [ 1381.00, 5000.00], [ 1.523728100E+001, 1.441146510E-002, -5.012900090E-006, 7.870712290E-010, -4.602257840E-014, -4.275644440E+004, -4.773837840E+001] ) ), note = "2/14/95" ) species(name = "ch3coch2o", atoms = " C:3 H:5 O:2 ", thermo = ( NASA( [ 300.00, 1370.00], [ 3.729276890E+000, 2.639436970E-002, -1.097964860E-005, 8.581853030E-010, 3.394745900E-013, -1.915515650E+004, 1.185053350E+001] ), NASA( [ 1370.00, 5000.00], [ 1.146375860E+001, 1.321243420E-002, -4.565804950E-006, 7.138975380E-010, -4.162810470E-014, -2.238330170E+004, -3.151278680E+001] ) ), note = "4/ 3/ 0 therm" ) species(name = "neoc5ketox", atoms = " C:5 H:9 O:2 ", thermo = ( NASA( [ 300.00, 1397.00], [-1.288481190E+000, 7.230784810E-002, -5.574213080E-005, 2.183191550E-008, -3.437358340E-012, -2.348090370E+004, 3.540176180E+001] ), NASA( [ 1397.00, 5000.00], [ 2.020855940E+001, 1.989224440E-002, -6.802388540E-006, 1.056429570E-009, -6.132077640E-014, -3.065167330E+004, -7.914649680E+001] ) ), note = "7/19/ 0 therm" ) species(name = "neoc5kejol", atoms = " C:5 H:9 O:2 ", thermo = ( NASA( [ 300.00, 1398.00], [-5.890783950E-001, 6.962518600E-002, -5.347395970E-005, 2.093963110E-008, -3.299755540E-012, -3.116780080E+004, 3.342192070E+001] ), NASA( [ 1398.00, 5000.00], [ 1.987861650E+001, 1.961436580E-002, -6.676998150E-006, 1.033777080E-009, -5.987698690E-014, -3.798297790E+004, -7.560095070E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ac5h11o2", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1387.00], [ 1.045084980E+000, 6.649532160E-002, -4.460345970E-005, 1.613256450E-008, -2.506335370E-012, -1.474570190E+004, 2.657315660E+001] ), NASA( [ 1387.00, 5000.00], [ 1.913056820E+001, 2.587343610E-002, -8.945645390E-006, 1.398748180E-009, -8.154966700E-014, -2.132886910E+004, -7.136849760E+001] ) ), note = "7/19/ 0 therm" ) species(name = "bc5h11o2", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1389.00], [ 5.493333410E-001, 7.196351210E-002, -5.385139210E-005, 2.204778780E-008, -3.820670050E-012, -1.778992940E+004, 2.544131840E+001] ), NASA( [ 1389.00, 5000.00], [ 1.989152570E+001, 2.524525280E-002, -8.732744080E-006, 1.365892540E-009, -7.965125430E-014, -2.451481270E+004, -7.816451120E+001] ) ), note = "7/19/ 0 therm" ) species(name = "cc5h11o2", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [-4.180721250E-002, 7.333121330E-002, -5.492672680E-005, 2.231359860E-008, -3.816328920E-012, -1.699614700E+004, 3.011288490E+001] ), NASA( [ 1390.00, 5000.00], [ 1.985626540E+001, 2.522856360E-002, -8.716864390E-006, 1.362376000E-009, -7.940504280E-014, -2.387757500E+004, -7.640082230E+001] ) ), note = "7/19/ 0 therm" ) species(name = "dc5h11o2", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1387.00], [ 1.045084980E+000, 6.649532160E-002, -4.460345970E-005, 1.613256450E-008, -2.506335370E-012, -1.474570190E+004, 2.588367500E+001] ), NASA( [ 1387.00, 5000.00], [ 1.913056820E+001, 2.587343610E-002, -8.945645390E-006, 1.398748180E-009, -8.154966700E-014, -2.132886910E+004, -7.205797920E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ac5h11o2h", atoms = " C:5 H:12 O:2 ", thermo = ( NASA( [ 300.00, 1389.00], [ 4.440690670E-002, 7.547661500E-002, -5.298231240E-005, 1.955680700E-008, -3.021815400E-012, -3.158829750E+004, 3.051878530E+001] ), NASA( [ 1389.00, 5000.00], [ 2.158695550E+001, 2.605473780E-002, -9.042378130E-006, 1.417591110E-009, -8.280409510E-014, -3.924531140E+004, -8.564217420E+001] ) ), note = "7/19/ 0 therm" ) species(name = "bc5h11o2h", atoms = " C:5 H:12 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [-3.975087210E-001, 8.068234610E-002, -6.183345130E-005, 2.522857520E-008, -4.283292980E-012, -3.463996020E+004, 2.914287370E+001] ), NASA( [ 1390.00, 5000.00], [ 2.234014010E+001, 2.543529350E-002, -8.832975510E-006, 1.385332900E-009, -8.094257160E-014, -4.242957280E+004, -9.239577230E+001] ) ), note = "7/19/ 0 therm" ) species(name = "cc5h11o2h", atoms = " C:5 H:12 O:2 ", thermo = ( NASA( [ 300.00, 1391.00], [-9.884507900E-001, 8.194848690E-002, -6.257111810E-005, 2.521601560E-008, -4.208849620E-012, -3.384418920E+004, 3.383090210E+001] ), NASA( [ 1391.00, 5000.00], [ 2.235953500E+001, 2.539089450E-002, -8.811853240E-006, 1.381461560E-009, -8.069489980E-014, -4.182650640E+004, -9.097470150E+001] ) ), note = "7/19/ 0 therm" ) species(name = "dc5h11o2h", atoms = " C:5 H:12 O:2 ", thermo = ( NASA( [ 300.00, 1389.00], [ 4.440690670E-002, 7.547661500E-002, -5.298231240E-005, 1.955680700E-008, -3.021815400E-012, -3.158829750E+004, 2.982930360E+001] ), NASA( [ 1389.00, 5000.00], [ 2.158695550E+001, 2.605473780E-002, -9.042378130E-006, 1.417591110E-009, -8.280409510E-014, -3.924531140E+004, -8.633165580E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ac5h11o", atoms = " C:5 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1393.00], [-9.197322650E-001, 6.678486840E-002, -4.523872950E-005, 1.598962390E-008, -2.337533160E-012, -1.302955290E+004, 3.379527900E+001] ), NASA( [ 1393.00, 5000.00], [ 1.758690490E+001, 2.453674270E-002, -8.370924520E-006, 1.297394420E-009, -7.518299930E-014, -1.958052480E+004, -6.598836360E+001] ) ), note = "4/ 7/97 therm" ) species(name = "bc5h11o", atoms = " C:5 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1394.00], [-9.589114870E-001, 7.022754010E-002, -5.162996490E-005, 2.026461160E-008, -3.315078150E-012, -1.654465280E+004, 3.101081520E+001] ), NASA( [ 1394.00, 5000.00], [ 1.820698010E+001, 2.411569640E-002, -8.247538360E-006, 1.280292030E-009, -7.427077010E-014, -2.312119370E+004, -7.153761670E+001] ) ), note = "4/ 7/97 therm" ) species(name = "cc5h11o", atoms = " C:5 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1394.00], [-1.179343510E+000, 6.999411330E-002, -5.068998670E-005, 1.961757240E-008, -3.178773760E-012, -1.525269700E+004, 3.352799410E+001] ), NASA( [ 1394.00, 5000.00], [ 1.796905280E+001, 2.450475190E-002, -8.422120900E-006, 1.311670410E-009, -7.626239290E-014, -2.189812120E+004, -6.916061120E+001] ) ), note = "4/ 7/97 therm" ) species(name = "dc5h11o", atoms = " C:5 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1393.00], [-9.197322650E-001, 6.678486840E-002, -4.523872950E-005, 1.598962390E-008, -2.337533160E-012, -1.302955290E+004, 3.310579740E+001] ), NASA( [ 1393.00, 5000.00], [ 1.758690490E+001, 2.453674270E-002, -8.370924520E-006, 1.297394420E-009, -7.518299930E-014, -1.958052480E+004, -6.667784520E+001] ) ), note = "4/ 7/97 therm" ) species(name = "ac5h10ooh-a", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1388.00], [ 8.291918580E-001, 7.086443950E-002, -5.040791290E-005, 1.884976960E-008, -2.947030780E-012, -6.978375190E+003, 2.903538000E+001] ), NASA( [ 1388.00, 5000.00], [ 2.117913180E+001, 2.389065280E-002, -8.304192480E-006, 1.303231100E-009, -7.618026310E-014, -1.418123310E+004, -8.059052910E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "ac5h10ooh-b", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1396.00], [ 3.587891280E+000, 5.712452560E-002, -3.425564460E-005, 1.052536110E-008, -1.311154440E-012, -8.877351840E+003, 1.928776290E+001] ), NASA( [ 1396.00, 5000.00], [ 1.839718040E+001, 2.515996240E-002, -8.498184030E-006, 1.307958070E-009, -7.541650720E-014, -1.432140380E+004, -6.124197360E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "ac5h10ooh-c", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1379.00], [ 9.167259690E-001, 6.724276030E-002, -4.313277120E-005, 1.344828190E-008, -1.608172570E-012, -8.231403210E+003, 2.985150470E+001] ), NASA( [ 1379.00, 5000.00], [ 2.123755120E+001, 2.312835360E-002, -7.896008780E-006, 1.225350950E-009, -7.110190180E-014, -1.559288440E+004, -8.042540700E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "ac5h10ooh-d", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1388.00], [ 8.291918580E-001, 7.086443950E-002, -5.040791290E-005, 1.884976960E-008, -2.947030780E-012, -6.978375190E+003, 2.903538000E+001] ), NASA( [ 1388.00, 5000.00], [ 2.117913180E+001, 2.389065280E-002, -8.304192480E-006, 1.303231100E-009, -7.618026310E-014, -1.418123310E+004, -8.059052910E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "bc5h10ooh-a", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [ 5.114983580E-001, 7.544425950E-002, -5.828269160E-005, 2.389836700E-008, -4.068134530E-012, -1.004671580E+004, 2.710014830E+001] ), NASA( [ 1390.00, 5000.00], [ 2.191895460E+001, 2.327323510E-002, -8.093454120E-006, 1.270554770E-009, -7.428598740E-014, -1.736024420E+004, -8.726517400E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "bc5h10ooh-c", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1387.00], [ 9.245819050E-001, 7.066351590E-002, -4.986345350E-005, 1.821123200E-008, -2.742831220E-012, -1.135482660E+004, 2.635869780E+001] ), NASA( [ 1387.00, 5000.00], [ 2.148619520E+001, 2.333705700E-002, -8.050762370E-006, 1.257350300E-009, -7.325874220E-014, -1.859489860E+004, -8.437044860E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "bc5h10ooh-d", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [ 5.114983580E-001, 7.544425950E-002, -5.828269160E-005, 2.389836700E-008, -4.068134530E-012, -1.004671580E+004, 2.710014830E+001] ), NASA( [ 1390.00, 5000.00], [ 2.191895460E+001, 2.327323510E-002, -8.093454120E-006, 1.270554770E-009, -7.428598740E-014, -1.736024420E+004, -8.726517400E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "cc5h10ooh-a", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1391.00], [-1.632947850E-001, 7.720220520E-002, -5.985917210E-005, 2.444329490E-008, -4.121591190E-012, -9.241434180E+003, 3.215190470E+001] ), NASA( [ 1391.00, 5000.00], [ 2.193541360E+001, 2.323068830E-002, -8.072733820E-006, 1.266713880E-009, -7.403854020E-014, -1.674985520E+004, -8.581520010E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "cc5h10ooh-b", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1383.00], [ 3.358575320E+000, 5.915927710E-002, -3.388462000E-005, 9.183993740E-009, -9.161271820E-013, -1.200541710E+004, 1.666064040E+001] ), NASA( [ 1383.00, 5000.00], [ 2.050370390E+001, 2.444176810E-002, -8.489039250E-006, 1.331514580E-009, -7.780336340E-014, -1.857424480E+004, -7.744852180E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "cc5h10ooh-d", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1391.00], [-1.632947850E-001, 7.720220520E-002, -5.985917210E-005, 2.444329490E-008, -4.121591190E-012, -9.241434180E+003, 3.215190470E+001] ), NASA( [ 1391.00, 5000.00], [ 2.193541360E+001, 2.323068830E-002, -8.072733820E-006, 1.266713880E-009, -7.403854020E-014, -1.674985520E+004, -8.581520010E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "dc5h10ooh-a", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1388.00], [ 8.291918580E-001, 7.086443950E-002, -5.040791290E-005, 1.884976960E-008, -2.947030780E-012, -6.978375190E+003, 2.793824860E+001] ), NASA( [ 1388.00, 5000.00], [ 2.117913180E+001, 2.389065280E-002, -8.304192480E-006, 1.303231100E-009, -7.618026310E-014, -1.418123310E+004, -8.168766050E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "dc5h10ooh-b", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1378.00], [ 3.963842000E+000, 5.421830070E-002, -2.626724460E-005, 4.657241940E-009, 3.004605180E-014, -9.674789470E+003, 1.472197400E+001] ), NASA( [ 1378.00, 5000.00], [ 1.976196170E+001, 2.512372350E-002, -8.735863000E-006, 1.371254640E-009, -8.016654630E-014, -1.604057480E+004, -7.306021830E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "dc5h10ooh-c", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1379.00], [ 9.167259690E-001, 6.724276030E-002, -4.313277120E-005, 1.344828190E-008, -1.608172570E-012, -8.231403210E+003, 2.916202310E+001] ), NASA( [ 1379.00, 5000.00], [ 2.123755120E+001, 2.312835360E-002, -7.896008780E-006, 1.225350950E-009, -7.110190180E-014, -1.559288440E+004, -8.111488860E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "ac5h10ooh-ao2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1386.00], [ 2.059222840E+000, 8.039849900E-002, -6.082757710E-005, 2.458500930E-008, -4.168203910E-012, -2.535238980E+004, 2.572928780E+001] ), NASA( [ 1386.00, 5000.00], [ 2.505204660E+001, 2.551314600E-002, -8.918544090E-006, 1.404935210E-009, -8.234073990E-014, -3.336707480E+004, -9.758941620E+001] ) ), note = "7/19/ 0 tm" ) species(name = "ac5h10ooh-bo2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1387.00], [ 2.027570550E+000, 8.363744420E-002, -6.665599360E-005, 2.833900940E-008, -4.998890090E-012, -2.846207400E+004, 2.385793050E+001] ), NASA( [ 1387.00, 5000.00], [ 2.577555310E+001, 2.488807080E-002, -8.700436180E-006, 1.370618960E-009, -8.033126260E-014, -3.653517120E+004, -1.027819460E+002] ) ), note = "7/19/ 0 tm" ) species(name = "ac5h10ooh-co2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1388.00], [ 1.457561340E+000, 8.498613100E-002, -6.788077840E-005, 2.877693130E-008, -5.044189580E-012, -2.767274310E+004, 2.773050670E+001] ), NASA( [ 1388.00, 5000.00], [ 2.567305050E+001, 2.493033310E-002, -8.705001040E-006, 1.370281330E-009, -8.026890260E-014, -3.586401670E+004, -1.013056050E+002] ) ), note = "7/19/ 0 tm" ) species(name = "ac5h10ooh-do2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1386.00], [ 2.059222840E+000, 8.039849900E-002, -6.082757710E-005, 2.458500930E-008, -4.168203910E-012, -2.535238980E+004, 2.641876950E+001] ), NASA( [ 1386.00, 5000.00], [ 2.505204660E+001, 2.551314600E-002, -8.918544090E-006, 1.404935210E-009, -8.234073990E-014, -3.336707480E+004, -9.689993450E+001] ) ), note = "7/19/ 0 tm" ) species(name = "bc5h10ooh-ao2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1387.00], [ 2.027570550E+000, 8.363744420E-002, -6.665599360E-005, 2.833900940E-008, -4.998890090E-012, -2.846207400E+004, 2.385793050E+001] ), NASA( [ 1387.00, 5000.00], [ 2.577555310E+001, 2.488807080E-002, -8.700436180E-006, 1.370618960E-009, -8.033126260E-014, -3.653517120E+004, -1.027819460E+002] ) ), note = "7/19/ 0 tm" ) species(name = "bc5h10ooh-co2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1390.00], [ 1.102696790E+000, 8.961491170E-002, -7.576593750E-005, 3.379620950E-008, -6.151844960E-012, -3.073203400E+004, 2.668263860E+001] ), NASA( [ 1390.00, 5000.00], [ 2.639526750E+001, 2.430550300E-002, -8.486743130E-006, 1.335913500E-009, -7.825516370E-014, -3.903468930E+004, -1.071857070E+002] ) ), note = "7/19/ 0 tm" ) species(name = "bc5h10ooh-do2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1387.00], [ 2.027570550E+000, 8.363744420E-002, -6.665599360E-005, 2.833900940E-008, -4.998890090E-012, -2.846207400E+004, 2.316844890E+001] ), NASA( [ 1387.00, 5000.00], [ 2.577555310E+001, 2.488807080E-002, -8.700436180E-006, 1.370618960E-009, -8.033126260E-014, -3.653517120E+004, -1.034714270E+002] ) ), note = "7/19/ 0 tm" ) species(name = "cc5h10ooh-ao2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1388.00], [ 1.457561340E+000, 8.498613100E-002, -6.788077840E-005, 2.877693130E-008, -5.044189580E-012, -2.767274310E+004, 2.773050670E+001] ), NASA( [ 1388.00, 5000.00], [ 2.567305050E+001, 2.493033310E-002, -8.705001040E-006, 1.370281330E-009, -8.026890260E-014, -3.586401670E+004, -1.013056050E+002] ) ), note = "7/19/ 0 tm" ) species(name = "cc5h10ooh-bo2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1390.00], [ 1.102696790E+000, 8.961491170E-002, -7.576593750E-005, 3.379620950E-008, -6.151844960E-012, -3.073203400E+004, 2.668263860E+001] ), NASA( [ 1390.00, 5000.00], [ 2.639526750E+001, 2.430550300E-002, -8.486743130E-006, 1.335913500E-009, -7.825516370E-014, -3.903468930E+004, -1.071857070E+002] ) ), note = "7/19/ 0 tm" ) species(name = "cc5h10ooh-do2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1388.00], [ 1.457561340E+000, 8.498613100E-002, -6.788077840E-005, 2.877693130E-008, -5.044189580E-012, -2.767274310E+004, 2.773050670E+001] ), NASA( [ 1388.00, 5000.00], [ 2.567305050E+001, 2.493033310E-002, -8.705001040E-006, 1.370281330E-009, -8.026890260E-014, -3.586401670E+004, -1.013056050E+002] ) ), note = "7/19/ 0 tm" ) species(name = "dc5h10ooh-ao2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1386.00], [ 2.059222840E+000, 8.039849900E-002, -6.082757710E-005, 2.458500930E-008, -4.168203910E-012, -2.535238980E+004, 2.641876950E+001] ), NASA( [ 1386.00, 5000.00], [ 2.505204660E+001, 2.551314600E-002, -8.918544090E-006, 1.404935210E-009, -8.234073990E-014, -3.336707480E+004, -9.689993450E+001] ) ), note = "7/19/ 0 tm" ) species(name = "dc5h10ooh-bo2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1387.00], [ 2.027570550E+000, 8.363744420E-002, -6.665599360E-005, 2.833900940E-008, -4.998890090E-012, -2.846207400E+004, 2.316844890E+001] ), NASA( [ 1387.00, 5000.00], [ 2.577555310E+001, 2.488807080E-002, -8.700436180E-006, 1.370618960E-009, -8.033126260E-014, -3.653517120E+004, -1.034714270E+002] ) ), note = "7/19/ 0 tm" ) species(name = "dc5h10ooh-co2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1388.00], [ 1.457561340E+000, 8.498613100E-002, -6.788077840E-005, 2.877693130E-008, -5.044189580E-012, -2.767274310E+004, 2.773050670E+001] ), NASA( [ 1388.00, 5000.00], [ 2.567305050E+001, 2.493033310E-002, -8.705001040E-006, 1.370281330E-009, -8.026890260E-014, -3.586401670E+004, -1.013056050E+002] ) ), note = "7/19/ 0 tm" ) species(name = "a-ac5h10o", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1371.00], [-3.124068320E+000, 6.536195790E-002, -3.976376880E-005, 1.126978300E-008, -1.181200300E-012, -1.697373880E+004, 4.075215830E+001] ), NASA( [ 1371.00, 5000.00], [ 1.805766240E+001, 2.216648900E-002, -7.876423000E-006, 1.254445850E-009, -7.408613280E-014, -2.503536320E+004, -7.537187820E+001] ) ), note = "1/22/95 therm" ) species(name = "a-bc5h10o", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1382.00], [-2.763340330E+000, 7.234872110E-002, -5.556162630E-005, 2.256584410E-008, -3.829920760E-012, -2.026779330E+004, 3.740758260E+001] ), NASA( [ 1382.00, 5000.00], [ 1.866528770E+001, 2.135987340E-002, -7.529758800E-006, 1.192878000E-009, -7.018913780E-014, -2.774966160E+004, -7.757493940E+001] ) ), note = "1/22/95 therm" ) species(name = "a-cc5h10o", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1373.00], [-3.516336230E+000, 6.869758840E-002, -4.465792370E-005, 1.406705560E-008, -1.749347660E-012, -1.916635810E+004, 4.255898400E+001] ), NASA( [ 1373.00, 5000.00], [ 1.871488320E+001, 2.161226250E-002, -7.686384330E-006, 1.224922270E-009, -7.237341760E-014, -2.743362230E+004, -7.866618490E+001] ) ), note = "1/22/95 therm" ) species(name = "a-dc5h10o", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1368.00], [-4.144297600E+000, 6.519895620E-002, -3.735366260E-005, 9.227830070E-009, -6.732989640E-013, -2.691634770E+004, 4.701673310E+001] ), NASA( [ 1368.00, 5000.00], [ 1.730813730E+001, 2.284912500E-002, -8.122764650E-006, 1.294084340E-009, -7.644388470E-014, -3.520625160E+004, -7.106285220E+001] ) ), note = "1/22/95 therm" ) species(name = "b-cc5h10o", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1385.00], [-3.375352490E+000, 7.703523100E-002, -6.284422480E-005, 2.693892030E-008, -4.751901610E-012, -2.243678360E+004, 3.878266320E+001] ), NASA( [ 1385.00, 5000.00], [ 1.925986000E+001, 2.080996110E-002, -7.329747720E-006, 1.160553170E-009, -6.826134700E-014, -3.008307740E+004, -8.180041290E+001] ) ), note = "1/22/95 therm" ) species(name = "b-dc5h10o", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1373.00], [-2.731086870E+000, 6.703913240E-002, -4.351389900E-005, 1.381758730E-008, -1.755931640E-012, -2.055932750E+004, 3.661332370E+001] ), NASA( [ 1373.00, 5000.00], [ 1.876536670E+001, 2.153628490E-002, -7.652247130E-006, 1.218719340E-009, -7.197531980E-014, -2.857471580E+004, -8.064602790E+001] ) ), note = "1/22/95 therm" ) species(name = "c-dc5h10o", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1383.00], [-3.177228360E+000, 7.296258370E-002, -5.570421580E-005, 2.234780020E-008, -3.733150780E-012, -1.894708280E+004, 4.012929960E+001] ), NASA( [ 1383.00, 5000.00], [ 1.852018840E+001, 2.144891560E-002, -7.552664860E-006, 1.195621460E-009, -7.031464000E-014, -2.650818860E+004, -7.629179590E+001] ) ), note = "1/22/95 therm" ) species(name = "c5h11o2-1", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1386.00], [ 1.397880380E+000, 6.527888930E-002, -4.342240320E-005, 1.571517430E-008, -2.466313240E-012, -1.367912220E+004, 2.554118240E+001] ), NASA( [ 1386.00, 5000.00], [ 1.897025360E+001, 2.603555520E-002, -9.007068340E-006, 1.408888680E-009, -8.216183810E-014, -2.012536830E+004, -6.974776160E+001] ) ), note = "7/19/ 0 therm" ) species(name = "c5h11o2-2", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1389.00], [ 7.107864020E-001, 7.035218210E-002, -5.115652990E-005, 2.030051970E-008, -3.424705850E-012, -1.599031260E+004, 2.791131320E+001] ), NASA( [ 1389.00, 5000.00], [ 1.966555390E+001, 2.539461130E-002, -8.774773730E-006, 1.371459130E-009, -7.993500150E-014, -2.265212550E+004, -7.389343100E+001] ) ), note = "7/19/ 0 therm" ) species(name = "c5h11o2-3", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1389.00], [ 7.107864020E-001, 7.035218210E-002, -5.115652990E-005, 2.030051970E-008, -3.424705850E-012, -1.599031260E+004, 2.791131320E+001] ), NASA( [ 1389.00, 5000.00], [ 1.966555390E+001, 2.539461130E-002, -8.774773730E-006, 1.371459130E-009, -7.993500150E-014, -2.265212550E+004, -7.389343100E+001] ) ), note = "7/19/ 0 therm" ) species(name = "c5h11o2h-1", atoms = " C:5 H:12 O:2 ", thermo = ( NASA( [ 300.00, 1387.00], [ 4.745961610E-001, 7.388080980E-002, -5.122166450E-005, 1.877971490E-008, -2.902918700E-012, -3.053237790E+004, 2.913622310E+001] ), NASA( [ 1387.00, 5000.00], [ 2.141807250E+001, 2.622514720E-002, -9.106910670E-006, 1.428245070E-009, -8.344736350E-014, -3.804013230E+004, -8.397467340E+001] ) ), note = "7/19/ 0 therm" ) species(name = "c5h11o2h-2", atoms = " C:5 H:12 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [-2.684311720E-001, 7.909759700E-002, -5.897512770E-005, 2.330291660E-008, -3.837946550E-012, -3.283298700E+004, 3.178361910E+001] ), NASA( [ 1390.00, 5000.00], [ 2.217122640E+001, 2.555403370E-002, -8.868573460E-006, 1.390340210E-009, -8.121220400E-014, -4.060273960E+004, -8.848309590E+001] ) ), note = "7/19/ 0 therm" ) species(name = "c5h11o2h-3", atoms = " C:5 H:12 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [-2.684311720E-001, 7.909759700E-002, -5.897512770E-005, 2.330291660E-008, -3.837946550E-012, -3.283298700E+004, 3.178361910E+001] ), NASA( [ 1390.00, 5000.00], [ 2.217122640E+001, 2.555403370E-002, -8.868573460E-006, 1.390340210E-009, -8.121220400E-014, -4.060273960E+004, -8.848309590E+001] ) ), note = "7/19/ 0 therm" ) species(name = "c5h11o-1", atoms = " C:5 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [-9.858355060E-001, 6.520756860E-002, -4.257050130E-005, 1.443278310E-008, -2.025302650E-012, -1.183305490E+004, 3.510542020E+001] ), NASA( [ 1391.00, 5000.00], [ 1.700477470E+001, 2.509830380E-002, -8.578835020E-006, 1.331275650E-009, -7.721198400E-014, -1.831667060E+004, -6.226896730E+001] ) ), note = "1/16/95 therm" ) species(name = "c5h11o-2", atoms = " C:5 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1395.00], [-1.327045350E+000, 6.882991850E-002, -4.853406930E-005, 1.820857560E-008, -2.859450350E-012, -1.404600090E+004, 3.588578330E+001] ), NASA( [ 1395.00, 5000.00], [ 1.745545920E+001, 2.484918580E-002, -8.520557720E-006, 1.324908320E-009, -7.694695150E-014, -2.061734390E+004, -6.504856390E+001] ) ), note = "1/16/95 ther" ) species(name = "c5h11o-3", atoms = " C:5 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1395.00], [-1.327045350E+000, 6.882991850E-002, -4.853406930E-005, 1.820857560E-008, -2.859450350E-012, -1.404600090E+004, 3.519630170E+001] ), NASA( [ 1395.00, 5000.00], [ 1.745545920E+001, 2.484918580E-002, -8.520557720E-006, 1.324908320E-009, -7.694695150E-014, -2.061734390E+004, -6.573804560E+001] ) ), note = "1/16/95 therm" ) species(name = "c5h10ooh1-2", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1379.00], [ 1.663046810E+000, 6.425117340E-002, -3.941247540E-005, 1.153481010E-008, -1.251284220E-012, -7.222880060E+003, 2.700637390E+001] ), NASA( [ 1379.00, 5000.00], [ 2.092252810E+001, 2.348630570E-002, -8.036444200E-006, 1.248807240E-009, -7.252277760E-014, -1.432456800E+004, -7.791529040E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "c5h10ooh1-3", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1379.00], [ 1.663046810E+000, 6.425117340E-002, -3.941247540E-005, 1.153481010E-008, -1.251284220E-012, -7.222880060E+003, 2.700637390E+001] ), NASA( [ 1379.00, 5000.00], [ 2.092252810E+001, 2.348630570E-002, -8.036444200E-006, 1.248807240E-009, -7.252277760E-014, -1.432456800E+004, -7.791529040E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "c5h10ooh1-4", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1379.00], [ 1.663046810E+000, 6.425117340E-002, -3.941247540E-005, 1.153481010E-008, -1.251284220E-012, -7.222880060E+003, 2.700637390E+001] ), NASA( [ 1379.00, 5000.00], [ 2.092252810E+001, 2.348630570E-002, -8.036444200E-006, 1.248807240E-009, -7.252277760E-014, -1.432456800E+004, -7.791529040E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "c5h10ooh1-5", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1387.00], [ 1.269572120E+000, 6.921722530E-002, -4.856267150E-005, 1.801447910E-008, -2.814153820E-012, -5.923847990E+003, 2.760177510E+001] ), NASA( [ 1387.00, 5000.00], [ 2.101144880E+001, 2.405612260E-002, -8.366169550E-006, 1.313398750E-009, -7.679171940E-014, -1.297578490E+004, -7.893299030E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "c5h10ooh2-1", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [ 5.188617560E-001, 7.449349180E-002, -5.646228710E-005, 2.264886730E-008, -3.776120260E-012, -8.223725860E+003, 3.028581180E+001] ), NASA( [ 1390.00, 5000.00], [ 2.174410740E+001, 2.339583110E-002, -8.130025910E-006, 1.275669430E-009, -7.455982380E-014, -1.552606980E+004, -8.330924490E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "c5h10ooh2-3", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1388.00], [ 1.270922090E+000, 6.829589850E-002, -4.634212430E-005, 1.614037550E-008, -2.308842200E-012, -9.583399480E+003, 2.796681730E+001] ), NASA( [ 1388.00, 5000.00], [ 2.108994510E+001, 2.371680230E-002, -8.190061280E-006, 1.279860650E-009, -7.459740630E-014, -1.667020920E+004, -7.913836770E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "c5h10ooh2-4", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1388.00], [ 1.270922090E+000, 6.829589850E-002, -4.634212430E-005, 1.614037550E-008, -2.308842200E-012, -9.583399480E+003, 2.796681730E+001] ), NASA( [ 1388.00, 5000.00], [ 2.108994510E+001, 2.371680230E-002, -8.190061280E-006, 1.279860650E-009, -7.459740630E-014, -1.667020920E+004, -7.913836770E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "c5h10ooh2-5", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [ 5.188617560E-001, 7.449349180E-002, -5.646228710E-005, 2.264886730E-008, -3.776120260E-012, -8.223725860E+003, 3.028581180E+001] ), NASA( [ 1390.00, 5000.00], [ 2.174410740E+001, 2.339583110E-002, -8.130025910E-006, 1.275669430E-009, -7.455982380E-014, -1.552606980E+004, -8.330924490E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "c5h10ooh3-2", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1388.00], [ 1.270922090E+000, 6.829589850E-002, -4.634212430E-005, 1.614037550E-008, -2.308842200E-012, -9.583399480E+003, 2.796681730E+001] ), NASA( [ 1388.00, 5000.00], [ 2.108994510E+001, 2.371680230E-002, -8.190061280E-006, 1.279860650E-009, -7.459740630E-014, -1.667020920E+004, -7.913836770E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "c5h10ooh3-1", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [ 5.188617560E-001, 7.449349180E-002, -5.646228710E-005, 2.264886730E-008, -3.776120260E-012, -8.223725860E+003, 3.028581180E+001] ), NASA( [ 1390.00, 5000.00], [ 2.174410740E+001, 2.339583110E-002, -8.130025910E-006, 1.275669430E-009, -7.455982380E-014, -1.552606980E+004, -8.330924490E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "c5h10ooh1-2o2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1387.00], [ 2.530728340E+000, 8.121674010E-002, -6.330547980E-005, 2.639007000E-008, -4.587396120E-012, -2.673376370E+004, 2.391050490E+001] ), NASA( [ 1387.00, 5000.00], [ 2.554788140E+001, 2.503851110E-002, -8.742439380E-006, 1.376114160E-009, -8.060731820E-014, -3.463451510E+004, -9.910220200E+001] ) ), note = "7/19/ 0 tm" ) species(name = "c5h10ooh1-3o2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1387.00], [ 2.530728340E+000, 8.121674010E-002, -6.330547980E-005, 2.639007000E-008, -4.587396120E-012, -2.673376370E+004, 2.391050490E+001] ), NASA( [ 1387.00, 5000.00], [ 2.554788140E+001, 2.503851110E-002, -8.742439380E-006, 1.376114160E-009, -8.060731820E-014, -3.463451510E+004, -9.910220200E+001] ) ), note = "7/19/ 0 tm" ) species(name = "c5h10ooh1-4o2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1387.00], [ 2.530728340E+000, 8.121674010E-002, -6.330547980E-005, 2.639007000E-008, -4.587396120E-012, -2.673376370E+004, 2.391050490E+001] ), NASA( [ 1387.00, 5000.00], [ 2.554788140E+001, 2.503851110E-002, -8.742439380E-006, 1.376114160E-009, -8.060731820E-014, -3.463451510E+004, -9.910220200E+001] ) ), note = "7/19/ 0 tm" ) species(name = "c5h10ooh1-5o2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1385.00], [ 2.819974340E+000, 7.726905040E-002, -5.672825090E-005, 2.232365230E-008, -3.715013830E-012, -2.434474830E+004, 2.351352590E+001] ), NASA( [ 1385.00, 5000.00], [ 2.486665760E+001, 2.566888380E-002, -8.971693240E-006, 1.413156140E-009, -8.281587110E-014, -3.214792180E+004, -9.512117380E+001] ) ), note = "7/19/ 0 tm" ) species(name = "c5h10ooh2-1o2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1387.00], [ 2.530728340E+000, 8.121674010E-002, -6.330547980E-005, 2.639007000E-008, -4.587396120E-012, -2.673376370E+004, 2.391050490E+001] ), NASA( [ 1387.00, 5000.00], [ 2.554788140E+001, 2.503851110E-002, -8.742439380E-006, 1.376114160E-009, -8.060731820E-014, -3.463451510E+004, -9.910220200E+001] ) ), note = "7/19/ 0 tm" ) species(name = "c5h10ooh2-3o2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 2.089351730E+000, 8.571569540E-002, -7.049869020E-005, 3.074972160E-008, -5.511325330E-012, -2.909703650E+004, 2.502975990E+001] ), NASA( [ 1389.00, 5000.00], [ 2.628501750E+001, 2.436784220E-002, -8.501019500E-006, 1.337365190E-009, -7.830750480E-014, -3.715372840E+004, -1.034352860E+002] ) ), note = "7/19/ 0 tm" ) species(name = "c5h10ooh2-4o2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 2.089351730E+000, 8.571569540E-002, -7.049869020E-005, 3.074972160E-008, -5.511325330E-012, -2.909703650E+004, 2.502975990E+001] ), NASA( [ 1389.00, 5000.00], [ 2.628501750E+001, 2.436784220E-002, -8.501019500E-006, 1.337365190E-009, -7.830750480E-014, -3.715372840E+004, -1.034352860E+002] ) ), note = "7/19/ 0 tm" ) species(name = "c5h10ooh2-5o2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1387.00], [ 2.530728340E+000, 8.121674010E-002, -6.330547980E-005, 2.639007000E-008, -4.587396120E-012, -2.673376370E+004, 2.391050490E+001] ), NASA( [ 1387.00, 5000.00], [ 2.554788140E+001, 2.503851110E-002, -8.742439380E-006, 1.376114160E-009, -8.060731820E-014, -3.463451510E+004, -9.910220200E+001] ) ), note = "7/19/ 0 tm" ) species(name = "c5h10ooh3-1o2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1387.00], [ 2.530728340E+000, 8.121674010E-002, -6.330547980E-005, 2.639007000E-008, -4.587396120E-012, -2.673376370E+004, 2.391050490E+001] ), NASA( [ 1387.00, 5000.00], [ 2.554788140E+001, 2.503851110E-002, -8.742439380E-006, 1.376114160E-009, -8.060731820E-014, -3.463451510E+004, -9.910220200E+001] ) ), note = "7/19/ 0 tm" ) species(name = "c5h10ooh3-2o2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 2.089351730E+000, 8.571569540E-002, -7.049869020E-005, 3.074972160E-008, -5.511325330E-012, -2.909703650E+004, 2.502975990E+001] ), NASA( [ 1389.00, 5000.00], [ 2.628501750E+001, 2.436784220E-002, -8.501019500E-006, 1.337365190E-009, -7.830750480E-014, -3.715372840E+004, -1.034352860E+002] ) ), note = "7/19/ 0 tm" ) species(name = "c5h10o1-2", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1382.00], [-2.509158910E+000, 7.028209050E-002, -5.230781540E-005, 2.053307380E-008, -3.379994720E-012, -1.792638790E+004, 3.834027380E+001] ), NASA( [ 1382.00, 5000.00], [ 1.834508230E+001, 2.158942870E-002, -7.599149170E-006, 1.202656880E-009, -7.071493480E-014, -2.529188160E+004, -7.387481270E+001] ) ), note = "1/22/95 therm" ) species(name = "c5h10o1-3", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1370.00], [-2.700671470E+000, 6.512344660E-002, -3.978632090E-005, 1.129835580E-008, -1.181410560E-012, -1.816119840E+004, 3.875893340E+001] ), NASA( [ 1370.00, 5000.00], [ 1.850511340E+001, 2.179096500E-002, -7.748037990E-006, 1.234538100E-009, -7.293270860E-014, -2.621518810E+004, -7.745242210E+001] ) ), note = "1/22/95 therm" ) species(name = "c5h10o1-4", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1371.00], [-3.942050660E+000, 6.684401020E-002, -4.099408780E-005, 1.176847710E-008, -1.260298700E-012, -2.809431370E+004, 4.586171500E+001] ), NASA( [ 1371.00, 5000.00], [ 1.770745170E+001, 2.247255230E-002, -7.984041920E-006, 1.271468160E-009, -7.508669450E-014, -3.630664450E+004, -7.273925600E+001] ) ), note = "1/22/95 therm" ) species(name = "c5h10o1-5", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1457.00], [-3.029045030E+000, 6.013201660E-002, -2.120724900E-005, -4.913132740E-009, 3.075775470E-012, -2.910288620E+004, 3.646987850E+001] ), NASA( [ 1457.00, 5000.00], [ 2.136841090E+001, 1.973214110E-002, -7.128421600E-006, 1.147898880E-009, -6.831627870E-014, -3.898349040E+004, -1.000321760E+002] ) ), note = "1/22/95 therm" ) species(name = "c5h10o2-3", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1385.00], [-3.038918740E+000, 7.464067210E-002, -5.912750180E-005, 2.463079030E-008, -4.243126860E-012, -2.010889980E+004, 4.001067610E+001] ), NASA( [ 1385.00, 5000.00], [ 1.893798460E+001, 2.104348490E-002, -7.401075770E-006, 1.170694020E-009, -6.881063560E-014, -2.762288140E+004, -7.740176730E+001] ) ), note = "1/22/95 therm" ) species(name = "c5h10o2-4", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1376.00], [-3.507020640E+000, 7.137072780E-002, -4.994835460E-005, 1.765158980E-008, -2.566532550E-012, -2.031987340E+004, 4.226125710E+001] ), NASA( [ 1376.00, 5000.00], [ 1.911862780E+001, 2.121691260E-002, -7.537648330E-006, 1.200357800E-009, -7.088665850E-014, -2.852161890E+004, -8.034083900E+001] ) ), note = "1/22/95 therm" ) species(name = "neoc5h11o2", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1392.00], [-3.917755160E-001, 7.523000280E-002, -5.657875450E-005, 2.267248560E-008, -3.784453700E-012, -1.605643980E+004, 2.872215560E+001] ), NASA( [ 1392.00, 5000.00], [ 2.054833170E+001, 2.463046500E-002, -8.509187880E-006, 1.329891240E-009, -7.751316810E-014, -2.324263350E+004, -8.328037180E+001] ) ), note = "7/19/ 0 therm" ) species(name = "neoc5h11o2h", atoms = " C:5 H:12 O:2 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.355524680E+000, 8.407092290E-002, -6.476312000E-005, 2.598057660E-008, -4.274832460E-012, -3.290530720E+004, 3.249156280E+001] ), NASA( [ 1393.00, 5000.00], [ 2.300555940E+001, 2.480945740E-002, -8.604765320E-006, 1.348516050E-009, -7.875335360E-014, -4.115765440E+004, -9.755461110E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "neoc5h11o", atoms = " C:5 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1399.00], [-2.412657020E+000, 7.568724560E-002, -5.731168040E-005, 2.247313180E-008, -3.581236510E-012, -1.433007070E+004, 3.621848190E+001] ), NASA( [ 1399.00, 5000.00], [ 1.911952810E+001, 2.308377860E-002, -7.839417090E-006, 1.211520000E-009, -7.007273650E-014, -2.153148690E+004, -7.852836470E+001] ) ), note = "7/13/98 therm" ) species(name = "neoc5h10ooh", atoms = " C:5 H:11 O:2 ", thermo = ( NASA( [ 300.00, 1393.00], [-6.052209380E-001, 7.959125760E-002, -6.237657130E-005, 2.538939620E-008, -4.225811040E-012, -8.289551040E+003, 3.226961770E+001] ), NASA( [ 1393.00, 5000.00], [ 2.259384960E+001, 2.265355590E-002, -7.870443930E-006, 1.234864610E-009, -7.217494710E-014, -1.609409530E+004, -9.138876960E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "neoc5h10ooh-o2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 7.251927820E-001, 8.863904640E-002, -7.207409910E-005, 3.069457250E-008, -5.356252980E-012, -2.667745450E+004, 2.919253930E+001] ), NASA( [ 1389.00, 5000.00], [ 2.643820580E+001, 2.431965130E-002, -8.503950010E-006, 1.339973860E-009, -7.855008310E-014, -3.527301370E+004, -1.075490440E+002] ) ), note = "7/19/ 0 t" ) species(name = "neo-c5h10o", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1403.00], [-6.218477330E+000, 8.107957490E-002, -6.225015260E-005, 2.425002170E-008, -3.783600320E-012, -1.886538120E+004, 5.385178190E+001] ), NASA( [ 1403.00, 5000.00], [ 1.764601100E+001, 2.268107170E-002, -7.712822790E-006, 1.193238520E-009, -6.907424590E-014, -2.678040020E+004, -7.319484160E+001] ) ), note = "4/ 3/ 0 therm" ) species(name = "c3h5-a", atoms = " C:3 H:5 ", thermo = ( NASA( [ 300.00, 1397.00], [-5.291319580E-001, 3.345591000E-002, -2.534010270E-005, 1.028657540E-008, -1.732583400E-012, 1.938342260E+004, 2.530671310E+001] ), NASA( [ 1397.00, 5000.00], [ 8.458839580E+000, 1.126954830E-002, -3.837928640E-006, 5.940591190E-010, -3.439180300E-014, 1.635760920E+004, -2.258094500E+001] ) ), note = "5/27/97 therm" ) species(name = "c3h5-s", atoms = " C:3 H:5 ", thermo = ( NASA( [ 300.00, 1390.00], [ 1.328073350E+000, 2.531079140E-002, -1.515304390E-005, 4.743455650E-009, -6.246660840E-013, 3.068739030E+004, 1.833287870E+001] ), NASA( [ 1390.00, 5000.00], [ 7.887658790E+000, 1.130125910E-002, -3.842131300E-006, 5.939826770E-010, -3.435671750E-014, 2.823777160E+004, -1.742915890E+001] ) ), note = "5/27/97 therm" ) species(name = "c3h5-t", atoms = " C:3 H:5 ", thermo = ( NASA( [ 300.00, 1382.00], [ 2.179166440E+000, 2.038266230E-002, -7.914138340E-006, 4.769061870E-010, 2.703985360E-013, 2.948953380E+004, 1.487856840E+001] ), NASA( [ 1382.00, 5000.00], [ 7.374924430E+000, 1.175100610E-002, -4.000212830E-006, 6.189473950E-010, -3.582150180E-014, 2.728749110E+004, -1.434786550E+001] ) ), note = "5/27/97 therm" ) species(name = "c3h3", atoms = " C:3 H:3 ", thermo = ( NASA( [ 300.00, 1000.00], [ 4.754200000E+000, 1.108028000E-002, 2.793323000E-007, -5.479212000E-009, 1.949629000E-012, 3.988883000E+004, 5.854549000E-001] ), NASA( [ 1000.00, 4000.00], [ 8.831047000E+000, 4.357195000E-003, -4.109067000E-007, -2.368723000E-010, 4.376520000E-014, 3.847420000E+004, -2.177919000E+001] ) ), note = "82489" ) species(name = "c3h2", atoms = " H:2 C:3 ", thermo = ( NASA( [ 150.00, 1000.00], [ 3.166714000E+000, 2.482572000E-002, -4.591637000E-005, 4.268019000E-008, -1.482152000E-011, 6.350421000E+004, 8.869446000E+000] ), NASA( [ 1000.00, 4000.00], [ 7.670981000E+000, 2.748749000E-003, -4.370943000E-007, -6.455599000E-011, 1.663887000E-014, 6.259722000E+004, -1.236890000E+001] ) ), note = "102193" ) species(name = "c3h6o1-2", atoms = " C:3 H:6 O:1 ", thermo = ( NASA( [ 300.00, 1379.00], [-1.219881530E+000, 4.285787720E-002, -3.175302490E-005, 1.217637360E-008, -1.941543030E-012, -1.229537610E+004, 2.884678260E+001] ), NASA( [ 1379.00, 5000.00], [ 1.198252890E+001, 1.239646960E-002, -4.391138130E-006, 6.979111820E-010, -4.115851270E-014, -1.697391890E+004, -4.228940350E+001] ) ), note = "1/22/95 therm" ) species(name = "ho2cho", atoms = " C:1 H:2 O:3 ", thermo = ( NASA( [ 300.00, 1378.00], [ 2.424647260E+000, 2.197063800E-002, -1.687055460E-005, 6.256121940E-009, -9.116458430E-013, -3.548280060E+004, 1.750277960E+001] ), NASA( [ 1378.00, 5000.00], [ 9.875038780E+000, 4.646637080E-003, -1.672305220E-006, 2.686244130E-010, -1.595952320E-014, -3.805024960E+004, -2.249391550E+001] ) ), note = "6/26/95 therm" ) species(name = "o2cho", atoms = " C:1 H:1 O:3 ", thermo = ( NASA( [ 300.00, 1368.00], [ 3.960593090E+000, 1.060022790E-002, -5.257133510E-006, 1.017167260E-009, -2.874876020E-014, -1.735993830E+004, 1.178074830E+001] ), NASA( [ 1368.00, 5000.00], [ 7.240751390E+000, 4.633129510E-003, -1.636939950E-006, 2.597066930E-010, -1.529646990E-014, -1.870276180E+004, -6.495472120E+000] ) ), note = "6/26/95 therm" ) species(name = "ocho", atoms = " C:1 H:1 O:2 ", thermo = ( NASA( [ 300.00, 1690.00], [ 1.352134520E+000, 1.500820040E-002, -1.098961410E-005, 3.736798400E-009, -4.810144980E-013, -2.022536470E+004, 1.743731470E+001] ), NASA( [ 1690.00, 5000.00], [ 6.126287820E+000, 3.756029320E-003, -1.420103520E-006, 2.364292000E-010, -1.441676510E-014, -2.176984660E+004, -8.015746940E+000] ) ), note = "2/14/95 therm" ) species(name = "ch2(s)", atoms = " C:1 H:2 ", thermo = ( NASA( [ 300.00, 1000.00], [ 3.971265000E+000, -1.699089000E-004, 1.025369000E-006, 2.492551000E-009, -1.981266000E-012, 4.989368000E+004, 5.753207000E-002] ), NASA( [ 1000.00, 4000.00], [ 3.552889000E+000, 2.066788000E-003, -1.914116000E-007, -1.104673000E-010, 2.021350000E-014, 4.984975000E+004, 1.686570000E+000] ) ), note = "31287" ) species(name = "c3ket12", atoms = " C:3 H:6 O:3 ", thermo = ( NASA( [ 300.00, 1388.00], [ 1.105072380E+000, 5.273967060E-002, -4.318057740E-005, 1.816182920E-008, -3.105355680E-012, -3.636275360E+004, 2.541116360E+001] ), NASA( [ 1388.00, 5000.00], [ 1.707562250E+001, 1.310134910E-002, -4.619494080E-006, 7.319913290E-010, -4.307886790E-014, -4.170086370E+004, -5.957789520E+001] ) ), note = "7/19/ 0 therm" ) species(name = "c3ket13", atoms = " C:3 H:6 O:3 ", thermo = ( NASA( [ 300.00, 1379.00], [ 3.552410220E+000, 4.187202700E-002, -2.945503700E-005, 1.099829000E-008, -1.750459770E-012, -3.489026710E+004, 1.420828940E+001] ), NASA( [ 1379.00, 5000.00], [ 1.589274790E+001, 1.409909230E-002, -4.961188510E-006, 7.849921980E-010, -4.614889280E-014, -3.937748290E+004, -5.260493410E+001] ) ), note = "7/19/ 0 therm" ) species(name = "c3ket21", atoms = " C:3 H:6 O:3 ", thermo = ( NASA( [ 300.00, 1371.00], [ 4.556863670E+000, 3.570768370E-002, -1.947120540E-005, 4.706954310E-009, -3.697538070E-013, -3.867109750E+004, 9.977616940E+000] ), NASA( [ 1371.00, 5000.00], [ 1.563777760E+001, 1.440593420E-002, -5.088080820E-006, 8.070761190E-010, -4.752956500E-014, -4.306579750E+004, -5.131058690E+001] ) ), note = "7/19/ 0 therm" ) species(name = "nc4ket12", atoms = " C:4 H:8 O:3 ", thermo = ( NASA( [ 300.00, 1388.00], [ 8.053871490E-001, 6.523751190E-002, -5.183736510E-005, 2.134548960E-008, -3.598602550E-012, -3.923959610E+004, 2.849084720E+001] ), NASA( [ 1388.00, 5000.00], [ 2.024584850E+001, 1.764403600E-002, -6.190545980E-006, 9.776880240E-010, -5.740532580E-014, -4.581415110E+004, -7.521454430E+001] ) ), note = "7/19/ 0 therm" ) species(name = "nc4ket13", atoms = " C:4 H:8 O:3 ", thermo = ( NASA( [ 300.00, 1386.00], [ 2.748834610E+000, 5.869367450E-002, -4.496058950E-005, 1.832001300E-008, -3.117653690E-012, -4.010658780E+004, 1.880720900E+001] ), NASA( [ 1386.00, 5000.00], [ 1.964308080E+001, 1.809405660E-002, -6.330632320E-006, 9.978603990E-010, -5.850764580E-014, -4.595888510E+004, -7.169050940E+001] ) ), note = "7/19/ 0 therm" ) species(name = "nc4ket14", atoms = " C:4 H:8 O:3 ", thermo = ( NASA( [ 300.00, 1382.00], [ 3.407971470E+000, 5.373860960E-002, -3.726132330E-005, 1.368628550E-008, -2.137987790E-012, -3.779192330E+004, 1.655801900E+001] ), NASA( [ 1382.00, 5000.00], [ 1.902838220E+001, 1.866047650E-002, -6.536162270E-006, 1.031024820E-009, -6.048332560E-014, -4.346787870E+004, -6.802103730E+001] ) ), note = "7/19/ 0 therm" ) species(name = "nc4ket21", atoms = " C:4 H:8 O:3 ", thermo = ( NASA( [ 300.00, 1376.00], [ 4.697859730E+000, 4.838596230E-002, -3.055769390E-005, 1.027057440E-008, -1.517134830E-012, -4.186655280E+004, 1.067152640E+001] ), NASA( [ 1376.00, 5000.00], [ 1.862314730E+001, 1.909694010E-002, -6.707459980E-006, 1.059946900E-009, -6.225642480E-014, -4.719299330E+004, -6.554778920E+001] ) ), note = "7/19/ 0 therm" ) species(name = "nc4ket23", atoms = " C:4 H:8 O:3 ", thermo = ( NASA( [ 300.00, 1387.00], [ 4.505759610E-001, 6.488625270E-002, -5.044464640E-005, 2.030852200E-008, -3.359524970E-012, -4.287793590E+004, 3.001536760E+001] ), NASA( [ 1387.00, 5000.00], [ 1.995129690E+001, 1.795585960E-002, -6.312308780E-006, 9.982173860E-010, -5.866369730E-014, -4.955854950E+004, -7.430713280E+001] ) ), note = "7/19/ 0 therm" ) species(name = "nc4ket24", atoms = " C:4 H:8 O:3 ", thermo = ( NASA( [ 300.00, 1380.00], [ 2.930072830E+000, 5.392960760E-002, -3.661649190E-005, 1.308801060E-008, -1.992454560E-012, -4.141188150E+004, 1.865675110E+001] ), NASA( [ 1380.00, 5000.00], [ 1.877072010E+001, 1.894908230E-002, -6.651821450E-006, 1.050808600E-009, -6.170693930E-014, -4.723198020E+004, -6.733351070E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ic4ketii", atoms = " C:4 H:8 O:3 ", thermo = ( NASA( [ 300.00, 1387.00], [ 1.155016140E+000, 6.106223450E-002, -4.497113230E-005, 1.705146540E-008, -2.659486020E-012, -3.827479560E+004, 2.696122350E+001] ), NASA( [ 1387.00, 5000.00], [ 1.951430590E+001, 1.823773950E-002, -6.389086060E-006, 1.008015710E-009, -5.914403500E-014, -4.468848360E+004, -7.171675840E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ic4ketit", atoms = " C:4 H:8 O:3 ", thermo = ( NASA( [ 300.00, 1388.00], [ 1.142437410E+000, 6.338407970E-002, -4.730847380E-005, 1.771453730E-008, -2.672654750E-012, -4.093667960E+004, 2.348448670E+001] ), NASA( [ 1388.00, 5000.00], [ 2.093698500E+001, 1.710909550E-002, -6.018921690E-006, 9.523538630E-010, -5.599261760E-014, -4.778198190E+004, -8.277176110E+001] ) ), note = "7/19/ 0 therm" ) species(name = "neoc5ket", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1392.00], [-2.938666650E-001, 8.085892030E-002, -6.334474320E-005, 2.536858920E-008, -4.125049520E-012, -4.214935260E+004, 3.198758450E+001] ), NASA( [ 1392.00, 5000.00], [ 2.411177370E+001, 2.155831590E-002, -7.537564580E-006, 1.187742590E-009, -6.963196860E-014, -5.038656500E+004, -9.826004240E+001] ) ), note = "7/19/ 0 therm" ) species(name = "nc5ket12", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1389.00], [ 5.648456580E-001, 7.748896900E-002, -6.008184270E-005, 2.424328170E-008, -4.023298800E-012, -4.212623140E+004, 3.129107740E+001] ), NASA( [ 1389.00, 5000.00], [ 2.344270490E+001, 2.215406920E-002, -7.748178800E-006, 1.221070950E-009, -7.158836440E-014, -4.993505930E+004, -9.099708120E+001] ) ), note = "7/19/ 0 therm" ) species(name = "nc5ket13", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1387.00], [ 2.539451530E+000, 7.086453190E-002, -5.322663500E-005, 2.129062930E-008, -3.566765360E-012, -4.299887250E+004, 2.145430540E+001] ), NASA( [ 1387.00, 5000.00], [ 2.278975490E+001, 2.263877190E-002, -7.898323540E-006, 1.242603090E-009, -7.276097590E-014, -5.005261930E+004, -8.716761660E+001] ) ), note = "7/19/ 0 therm" ) species(name = "nc5ket14", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1387.00], [ 2.539451530E+000, 7.086453190E-002, -5.322663500E-005, 2.129062930E-008, -3.566765360E-012, -4.299887250E+004, 2.145430540E+001] ), NASA( [ 1387.00, 5000.00], [ 2.278975490E+001, 2.263877190E-002, -7.898323540E-006, 1.242603090E-009, -7.276097590E-014, -5.005261930E+004, -8.716761660E+001] ) ), note = "7/19/ 0 therm" ) species(name = "nc5ket15", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1383.00], [ 3.225651440E+000, 6.576209620E-002, -4.527525420E-005, 1.648108660E-008, -2.544671390E-012, -4.068762660E+004, 1.908512340E+001] ), NASA( [ 1383.00, 5000.00], [ 2.217762390E+001, 2.319398640E-002, -8.097978990E-006, 1.274640470E-009, -7.466251070E-014, -4.756115990E+004, -8.350910330E+001] ) ), note = "7/19/ 0 therm" ) species(name = "nc5ket21", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1379.00], [ 4.566874370E+000, 6.019787390E-002, -3.829355080E-005, 1.292206620E-008, -1.897912270E-012, -4.477034350E+004, 1.295808300E+001] ), NASA( [ 1379.00, 5000.00], [ 2.175346800E+001, 2.366661190E-002, -8.286107590E-006, 1.306636200E-009, -7.663240760E-014, -5.128154670E+004, -8.093409570E+001] ) ), note = "7/19/ 0 therm" ) species(name = "nc5ket23", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1387.00], [ 1.093041510E-001, 7.759977600E-002, -5.941248100E-005, 2.367442700E-008, -3.890943380E-012, -4.574955970E+004, 3.327997950E+001] ), NASA( [ 1387.00, 5000.00], [ 2.314098080E+001, 2.248015340E-002, -7.876629160E-006, 1.242825160E-009, -7.292527290E-014, -5.367840290E+004, -9.005382360E+001] ) ), note = "7/19/ 0 therm" ) species(name = "nc5ket24", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1385.00], [ 2.193336410E+000, 7.040502600E-002, -5.158563120E-005, 2.007415700E-008, -3.285689480E-012, -4.663685240E+004, 2.295202020E+001] ), NASA( [ 1385.00, 5000.00], [ 2.251263870E+001, 2.294955970E-002, -8.022864860E-006, 1.263899750E-009, -7.407774200E-014, -5.381221950E+004, -8.637887370E+001] ) ), note = "7/19/ 0 therm" ) species(name = "nc5ket25", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1382.00], [ 2.762704250E+000, 6.587248770E-002, -4.451445780E-005, 1.582133400E-008, -2.388001450E-012, -4.430936820E+004, 2.111806780E+001] ), NASA( [ 1382.00, 5000.00], [ 2.190996440E+001, 2.350182000E-002, -8.222614970E-006, 1.296067010E-009, -7.599146470E-014, -5.132420060E+004, -8.277089030E+001] ) ), note = "7/19/ 0 therm" ) species(name = "nc5ket31", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1382.00], [ 3.144814990E+000, 6.643105920E-002, -4.752325450E-005, 1.855732340E-008, -3.119959240E-012, -4.462287570E+004, 1.897601160E+001] ), NASA( [ 1382.00, 5000.00], [ 2.177235990E+001, 2.361167060E-002, -8.258138640E-006, 1.301298860E-009, -7.628130000E-014, -5.135433640E+004, -8.163858800E+001] ) ), note = "7/19/ 0 therm" ) species(name = "nc5ket32", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1387.00], [ 7.244971100E-001, 7.716229350E-002, -6.103699020E-005, 2.559094320E-008, -4.446962980E-012, -4.609898300E+004, 3.005225340E+001] ), NASA( [ 1387.00, 5000.00], [ 2.295367440E+001, 2.261926490E-002, -7.919226380E-006, 1.248834400E-009, -7.324677010E-014, -5.367921590E+004, -8.861179680E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ic5ketaa", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1388.00], [ 5.366001030E-001, 7.508968870E-002, -5.599772570E-005, 2.173075060E-008, -3.485634920E-012, -4.110645640E+004, 3.149362710E+001] ), NASA( [ 1388.00, 5000.00], [ 2.270182010E+001, 2.276239830E-002, -7.953177010E-006, 1.252548260E-009, -7.339955640E-014, -4.880492250E+004, -8.744814340E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ic5ketab", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1389.00], [ 9.900302350E-001, 7.524866420E-002, -5.507723720E-005, 2.035823940E-008, -3.046650580E-012, -4.383612160E+004, 2.656839150E+001] ), NASA( [ 1389.00, 5000.00], [ 2.408420060E+001, 2.164341540E-002, -7.580910680E-006, 1.195992680E-009, -7.017323290E-014, -5.187638320E+004, -9.756165360E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ic5ketac", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1391.00], [ 1.993039770E-001, 7.831795420E-002, -6.057226480E-005, 2.419682740E-008, -3.954352150E-012, -4.346389120E+004, 3.229816790E+001] ), NASA( [ 1391.00, 5000.00], [ 2.346835630E+001, 2.207304860E-002, -7.707156350E-006, 1.213309460E-009, -7.108161730E-014, -5.137820350E+004, -9.204033810E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ic5ketad", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1388.00], [ 5.366001030E-001, 7.508968870E-002, -5.599772570E-005, 2.173075060E-008, -3.485634920E-012, -4.110645640E+004, 3.149362710E+001] ), NASA( [ 1388.00, 5000.00], [ 2.270182010E+001, 2.276239830E-002, -7.953177010E-006, 1.252548260E-009, -7.339955640E-014, -4.880492250E+004, -8.744814340E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ic5ketca", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1386.00], [ 5.010269130E-001, 7.320934130E-002, -5.223151140E-005, 1.918938610E-008, -2.910255240E-012, -4.479016920E+004, 3.156228800E+001] ), NASA( [ 1386.00, 5000.00], [ 2.239362250E+001, 2.308307140E-002, -8.077399650E-006, 1.273401110E-009, -7.467436120E-014, -5.254600120E+004, -8.646309730E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ic5ketcb", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1387.00], [ 2.974019950E-001, 7.640358400E-002, -5.586427850E-005, 2.065707590E-008, -3.101853240E-012, -4.742392900E+004, 2.896980430E+001] ), NASA( [ 1387.00, 5000.00], [ 2.383810500E+001, 2.194928280E-002, -7.708458300E-006, 1.218245280E-009, -7.156524580E-014, -5.565275050E+004, -9.765136640E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ic5ketcd", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1383.00], [ 2.271356080E+000, 6.777252870E-002, -4.641278890E-005, 1.655179530E-008, -2.479012570E-012, -4.524856050E+004, 2.285041340E+001] ), NASA( [ 1383.00, 5000.00], [ 2.224451950E+001, 2.324293750E-002, -8.139399360E-006, 1.283751320E-009, -7.530288740E-014, -5.250162140E+004, -8.534965950E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ic5ketda", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1385.00], [ 2.454873800E+000, 6.895623520E-002, -4.946146710E-005, 1.877918290E-008, -3.002012910E-012, -4.169445710E+004, 2.203175000E+001] ), NASA( [ 1385.00, 5000.00], [ 2.237488610E+001, 2.301416060E-002, -8.033413430E-006, 1.264313380E-009, -7.405161680E-014, -4.878037380E+004, -8.534575620E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ic5ketdb", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1386.00], [ 2.392158110E+000, 7.239795370E-002, -5.565272620E-005, 2.279574290E-008, -3.897788380E-012, -4.480117490E+004, 1.891189540E+001] ), NASA( [ 1386.00, 5000.00], [ 2.309638310E+001, 2.241254900E-002, -7.828204770E-006, 1.232510100E-009, -7.220863310E-014, -5.195062330E+004, -9.191366380E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ic5ketdc", atoms = " C:5 H:10 O:3 ", thermo = ( NASA( [ 300.00, 1390.00], [ 4.196114030E-002, 7.962215770E-002, -6.287559710E-005, 2.576400210E-008, -4.321795730E-012, -4.317065630E+004, 3.239178060E+001] ), NASA( [ 1390.00, 5000.00], [ 2.355110200E+001, 2.203704960E-002, -7.702298690E-006, 1.213336120E-009, -7.111483820E-014, -5.110904020E+004, -9.299117160E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ic4h7-i1", atoms = " C:4 H:7 ", thermo = ( NASA( [ 300.00, 1389.00], [ 1.876324340E+000, 3.544861070E-002, -2.131049490E-005, 6.734004920E-009, -9.031663390E-013, 2.587129140E+004, 1.624291610E+001] ), NASA( [ 1389.00, 5000.00], [ 1.109576000E+001, 1.578100490E-002, -5.384196150E-006, 8.343601210E-010, -4.834014810E-014, 2.241758270E+004, -3.404268220E+001] ) ), note = "4/ 2/97 therm" ) species(name = "c3h6oh", atoms = " C:3 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1674.00], [ 1.204943020E+000, 3.308578850E-002, -1.638936370E-005, 3.181039180E-009, -6.842292880E-014, -9.129617200E+003, 2.471552020E+001] ), NASA( [ 1674.00, 5000.00], [ 9.312878160E+000, 1.675792120E-002, -5.755554800E-006, 9.005843620E-010, -5.265668360E-014, -1.201696350E+004, -1.950110640E+001] ) ), note = "1/ 7/98 therm" ) species(name = "hoc3h6o2", atoms = " C:3 H:7 O:3 ", thermo = ( NASA( [ 300.00, 1397.00], [ 3.069542890E+000, 4.431056400E-002, -3.186362600E-005, 1.264092870E-008, -2.127519010E-012, -2.758936760E+004, 1.838912180E+001] ), NASA( [ 1397.00, 5000.00], [ 1.426910040E+001, 1.718378250E-002, -5.834195360E-006, 9.009941910E-010, -5.207162100E-014, -3.145017500E+004, -4.152950350E+001] ) ), note = "1/ 7/98 therm" ) species(name = "o2c2h4o2h", atoms = " C:2 H:5 O:4 ", thermo = ( NASA( [ 300.00, 1387.00], [ 5.900318720E+000, 3.056585280E-002, -1.859059500E-005, 5.678716050E-009, -7.027995770E-013, -1.639165710E+004, 6.330510380E+000] ), NASA( [ 1387.00, 5000.00], [ 1.454710320E+001, 1.233938230E-002, -4.272594690E-006, 6.687633370E-010, -3.901967210E-014, -1.963387610E+004, -4.087842360E+001] ) ), note = "6/28/95 therm" ) species(name = "ch2o2hcho", atoms = " C:2 H:4 O:3 ", thermo = ( NASA( [ 300.00, 1380.00], [ 5.523825460E+000, 2.420683060E-002, -1.528989740E-005, 5.017283620E-009, -6.964063580E-013, -3.234067890E+004, 3.572406450E+000] ), NASA( [ 1380.00, 5000.00], [ 1.240643390E+001, 9.472337840E-003, -3.281079280E-006, 5.137722110E-010, -2.998728030E-014, -3.491231420E+004, -3.394798740E+001] ) ), note = "6/28/95 therm" ) species(name = "ic4h7ooh", atoms = " C:4 H:8 O:2 ", thermo = ( NASA( [ 300.00, 1392.00], [ 2.991174020E+000, 5.033492780E-002, -3.562800610E-005, 1.339521540E-008, -2.110534090E-012, -1.510950460E+004, 1.545374130E+001] ), NASA( [ 1392.00, 5000.00], [ 1.692345640E+001, 1.783967690E-002, -6.142732790E-006, 9.578950280E-010, -5.574383040E-014, -2.000406860E+004, -5.947460700E+001] ) ), note = "7/19/95 therm" ) species(name = "ic3h5cho", atoms = " C:4 H:6 O:1 ", thermo = ( NASA( [ 300.00, 1396.00], [ 6.271837930E-001, 4.667802540E-002, -3.744306310E-005, 1.583305420E-008, -2.739521550E-012, -1.572031170E+004, 2.160342940E+001] ), NASA( [ 1396.00, 5000.00], [ 1.362039580E+001, 1.379171920E-002, -4.733701180E-006, 7.366552260E-010, -4.200979740E-014, -2.000252740E+004, -4.731845310E+001] ) ), note = "7/19/95 therm" ) species(name = "tc3h6ocho", atoms = " C:4 H:7 O:2 ", thermo = ( NASA( [ 300.00, 1394.00], [ 3.708302590E-001, 5.384756610E-002, -3.824775650E-005, 1.328822370E-008, -1.792287300E-012, -2.183912620E+004, 2.581421120E+001] ), NASA( [ 1394.00, 5000.00], [ 1.703712870E+001, 1.544006450E-002, -5.283328860E-006, 8.210853470E-010, -4.768984290E-014, -2.758719410E+004, -6.372712300E+001] ) ), note = "8/25/95 therm" ) species(name = "tc3h6cho", atoms = " C:4 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1389.00], [ 1.870527620E+000, 4.148696770E-002, -2.668157010E-005, 9.015316100E-009, -1.278706330E-012, -8.977307440E+003, 1.661741780E+001] ), NASA( [ 1389.00, 5000.00], [ 1.310130470E+001, 1.663918650E-002, -5.684576230E-006, 8.180835100E-010, -5.112901610E-014, -1.306386470E+004, -4.427058130E+001] ) ), note = "7/19/95 therm" ) species(name = "ic3h7cho", atoms = " C:4 H:8 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [-2.730213820E-001, 4.896963070E-002, -3.127700490E-005, 1.000529450E-008, -1.275120740E-012, -2.760547370E+004, 2.834511390E+001] ), NASA( [ 1391.00, 5000.00], [ 1.375016560E+001, 1.831267220E-002, -6.285726290E-006, 9.782507560E-010, -5.685386530E-014, -3.269367710E+004, -4.772705480E+001] ) ), note = "6/26/95 therm" ) species(name = "ic4h7oh", atoms = " C:4 H:8 O:1 ", thermo = ( NASA( [ 300.00, 1384.00], [ 1.690998990E+000, 4.271688910E-002, -2.492816950E-005, 7.009615220E-009, -7.232628280E-013, -2.145123340E+004, 1.995008330E+001] ), NASA( [ 1384.00, 5000.00], [ 1.350434190E+001, 1.786469680E-002, -5.993043710E-006, 9.187176410E-010, -5.284353020E-014, -2.582556880E+004, -4.446457150E+001] ) ), note = "4/ 8/97 therm" ) species(name = "ic3h6co", atoms = " C:4 H:6 O:1 ", thermo = ( NASA( [ 300.00, 1397.00], [ 2.280390550E+000, 4.170169890E-002, -3.250896610E-005, 1.372434190E-008, -2.405731320E-012, -1.639397120E+004, 1.381877140E+001] ), NASA( [ 1397.00, 5000.00], [ 1.325482320E+001, 1.401427870E-002, -4.789102150E-006, 7.429243420E-010, -4.307375660E-014, -2.005297790E+004, -4.448102210E+001] ) ), note = "03/03/95 therm" ) species(name = "ic4h6oh", atoms = " C:4 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [ 8.633712270E-001, 4.687112820E-002, -3.435803390E-005, 1.330310520E-008, -2.139149750E-012, -3.149483050E+003, 2.290755230E+001] ), NASA( [ 1390.00, 5000.00], [ 1.403109260E+001, 1.553175410E-002, -5.327549610E-006, 8.287859020E-010, -4.815452570E-014, -7.693782280E+003, -4.765553060E+001] ) ), note = "8/19/95 therm" ) species(name = "ic3h5co", atoms = " C:4 H:5 O:1 ", thermo = ( NASA( [ 300.00, 1397.00], [ 1.850970690E+000, 4.188558460E-002, -3.625537310E-005, 1.656906590E-008, -3.058508460E-012, 1.703814410E+002, 1.530144330E+001] ), NASA( [ 1397.00, 5000.00], [ 1.306674370E+001, 1.167042440E-002, -3.991065230E-006, 6.194981480E-010, -3.593482490E-014, -3.365193440E+003, -4.358030900E+001] ) ), note = "4/ 3/ 0 therm" ) species(name = "ic3h7co", atoms = " C:4 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1396.00], [ 4.333842890E-001, 4.462356490E-002, -2.919829090E-005, 9.723412210E-009, -1.304125440E-012, -9.070004440E+003, 2.608989820E+001] ), NASA( [ 1396.00, 5000.00], [ 1.289873400E+001, 1.668097220E-002, -5.671545740E-006, 8.770246510E-010, -5.074261400E-014, -1.350901370E+004, -4.126076680E+001] ) ), note = "1/23/95 therm" ) species(name = "tc3h6o2cho", atoms = " C:4 H:7 O:3 ", thermo = ( NASA( [ 300.00, 1386.00], [ 2.178833830E+000, 5.415958320E-002, -3.834358860E-005, 1.383081040E-008, -2.041901470E-012, -2.273941540E+004, 2.007512640E+001] ), NASA( [ 1386.00, 5000.00], [ 1.855344430E+001, 1.687743890E-002, -5.907529650E-006, 9.315180850E-010, -5.463451870E-014, -2.854471910E+004, -6.824866670E+001] ) ), note = "8/ 2/95 therm" ) species(name = "tc3h6o2hco", atoms = " C:4 H:7 O:3 ", thermo = ( NASA( [ 300.00, 1387.00], [ 2.038644280E+000, 5.804210030E-002, -4.321235280E-005, 1.587920940E-008, -2.322095430E-012, -2.242846730E+004, 2.036809900E+001] ), NASA( [ 1387.00, 5000.00], [ 2.064726780E+001, 1.485265000E-002, -5.251048750E-006, 8.336192190E-010, -4.912560690E-014, -2.887198690E+004, -7.959513890E+001] ) ), note = "8/ 2/95 therm" ) species(name = "ic3h5o2hcho", atoms = " C:4 H:7 O:3 ", thermo = ( NASA( [ 300.00, 1387.00], [ 2.059847700E+000, 5.823317160E-002, -4.376721000E-005, 1.632499180E-008, -2.434620510E-012, -1.634962500E+004, 2.136879210E+001] ), NASA( [ 1387.00, 5000.00], [ 2.062888320E+001, 1.486255390E-002, -5.253052760E-006, 8.337729510E-010, -4.912774010E-014, -2.275890760E+004, -7.829628880E+001] ) ), note = "8/2/95 therm" ) species(name = "tc3h6ohcho", atoms = " C:4 H:8 O:2 ", thermo = ( NASA( [ 300.00, 1396.00], [ 2.100335000E-001, 5.630862840E-002, -3.951586690E-005, 1.377804280E-008, -1.890688050E-012, -4.804026380E+004, 2.678360700E+001] ), NASA( [ 1396.00, 5000.00], [ 1.707889960E+001, 1.740055540E-002, -5.930081120E-006, 9.188609090E-010, -5.325121400E-014, -5.387304270E+004, -6.386387540E+001] ) ), note = "8/ 1/95 therm" ) species(name = "tc3h6oh", atoms = " C:3 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1389.00], [ 2.318039560E+000, 3.173049800E-002, -1.696387060E-005, 4.599987730E-009, -5.182855200E-013, -1.393827120E+004, 1.711058680E+001] ), NASA( [ 1389.00, 5000.00], [ 1.012569200E+001, 1.618684270E-002, -5.524059570E-006, 8.560519320E-010, -4.959355420E-014, -1.700831120E+004, -2.592541630E+001] ) ), note = "8/ 1/95 therm" ) species(name = "ic3h5oh", atoms = " C:3 H:6 O:1 ", thermo = ( NASA( [ 300.00, 1374.00], [ 1.583763910E+000, 3.162153660E-002, -1.736649420E-005, 4.189276630E-009, -2.798996200E-013, -2.126434960E+004, 1.883137660E+001] ), NASA( [ 1374.00, 5000.00], [ 1.073810250E+001, 1.316981940E-002, -4.415296220E-006, 6.770098370E-010, -3.896089010E-014, -2.472983210E+004, -3.136340500E+001] ) ), note = "8/ 1/95 therm" ) species(name = "tc4h8cho", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1397.00], [-9.580782940E-001, 6.420032580E-002, -4.707768270E-005, 1.757376980E-008, -2.648961510E-012, -6.865825010E+003, 3.337811120E+001] ), NASA( [ 1397.00, 5000.00], [ 1.796639330E+001, 1.942071170E-002, -6.674094510E-006, 1.039692210E-009, -6.047026510E-014, -1.333685850E+004, -6.798194240E+001] ) ), note = "9/ 7/95 therm" ) species(name = "o2c4h8cho", atoms = " C:5 H:9 O:3 ", thermo = ( NASA( [ 300.00, 1395.00], [ 1.918476990E+000, 6.672458690E-002, -4.808710460E-005, 1.785886900E-008, -2.711638800E-012, -2.498379840E+004, 2.385778670E+001] ), NASA( [ 1395.00, 5000.00], [ 2.126299040E+001, 2.140722820E-002, -7.383429490E-006, 1.152815230E-009, -6.715084380E-014, -3.168545240E+004, -7.998287030E+001] ) ), note = "9/ 7/95 therm" ) species(name = "o2hc4h8co", atoms = " C:5 H:9 O:3 ", thermo = ( NASA( [ 300.00, 1394.00], [ 1.826072620E+000, 6.934661110E-002, -4.931251400E-005, 1.698483400E-008, -2.261176570E-012, -2.465783110E+004, 2.411675440E+001] ), NASA( [ 1394.00, 5000.00], [ 2.382196300E+001, 1.914114480E-002, -6.679191540E-006, 1.051273030E-009, -6.158768050E-014, -3.230939730E+004, -9.425807550E+001] ) ), note = "9/ 7/95 therm" ) species(name = "o2hc4h7cho", atoms = " C:5 H:9 O:3 ", thermo = ( NASA( [ 300.00, 1398.00], [ 1.862688890E+000, 7.062770930E-002, -5.371341550E-005, 2.063425740E-008, -3.182901610E-012, -1.860400180E+004, 2.484887970E+001] ), NASA( [ 1398.00, 5000.00], [ 2.314142580E+001, 1.947286470E-002, -6.737056250E-006, 1.054248930E-009, -6.151066790E-014, -2.578307410E+004, -8.880778470E+001] ) ), note = "9/ 7/95 therm" ) species(name = "c3h5oh", atoms = " C:3 H:6 O:1 ", thermo = ( NASA( [ 300.00, 1388.00], [ 1.088993140E+000, 3.284817690E-002, -1.913226480E-005, 5.216351360E-009, -4.823945660E-013, -1.662824630E+004, 2.227545350E+001] ), NASA( [ 1388.00, 5000.00], [ 1.028182220E+001, 1.342480120E-002, -4.470394480E-006, 6.819241950E-010, -3.908995530E-014, -1.999601140E+004, -2.777366800E+001] ) ), note = "9/ 8/95 therm" ) species(name = "ch2cch2oh", atoms = " C:3 H:5 O:1 ", thermo = ( NASA( [ 300.00, 1372.00], [ 2.884225440E+000, 2.424280710E-002, -1.141522680E-005, 1.717753340E-009, 1.421774540E-013, 1.179356150E+004, 1.521023350E+001] ), NASA( [ 1372.00, 5000.00], [ 9.707020270E+000, 1.139726600E-002, -3.779939620E-006, 5.752092770E-010, -3.292291250E-014, 9.132128840E+003, -2.250129330E+001] ) ), note = "9/ 8/95 therm" ) species(name = "nc3h7cho", atoms = " C:4 H:8 O:1 ", thermo = ( NASA( [ 300.00, 1378.00], [ 1.874159590E+000, 4.192403150E-002, -2.351487790E-005, 6.269136730E-009, -6.094439080E-013, -2.710321940E+004, 1.915685740E+001] ), NASA( [ 1378.00, 5000.00], [ 1.359880680E+001, 1.816524740E-002, -6.178444580E-006, 9.559802080E-010, -5.534429580E-014, -3.158453480E+004, -4.517902280E+001] ) ), note = "9/27/95 therm" ) species(name = "nc3h7co", atoms = " C:4 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1380.00], [ 2.672568260E+000, 3.711988250E-002, -2.068628590E-005, 5.488738880E-009, -5.358641830E-013, -8.580508880E+003, 1.648489500E+001] ), NASA( [ 1380.00, 5000.00], [ 1.300263310E+001, 1.631048770E-002, -5.576428990E-006, 8.656706290E-010, -5.022556670E-014, -1.255233850E+004, -4.026085150E+001] ) ), note = "9/27/95 therm" ) species(name = "ch2ch2coch3", atoms = " C:4 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1380.00], [ 2.402556090E+000, 3.672942680E-002, -1.973165100E-005, 5.073232160E-009, -4.996552750E-013, -6.150068860E+003, 1.939933860E+001] ), NASA( [ 1380.00, 5000.00], [ 1.246943680E+001, 1.710221430E-002, -5.921567260E-006, 9.268168060E-010, -5.407305040E-014, -1.013782420E+004, -3.621863750E+001] ) ), note = "6/21/95 ther" ) species(name = "c2h5coch2", atoms = " C:4 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1383.00], [ 1.540138560E+000, 4.394862580E-002, -2.970024210E-005, 1.054953130E-008, -1.585987690E-012, -9.507965050E+003, 1.997066410E+001] ), NASA( [ 1383.00, 5000.00], [ 1.420987380E+001, 1.578664590E-002, -5.505291830E-006, 8.658705400E-010, -5.069133290E-014, -1.412849510E+004, -4.871329110E+001] ) ), note = "4/ 3/ 0 therm" ) species(name = "c2h5coch3", atoms = " C:4 H:8 O:1 ", thermo = ( NASA( [ 300.00, 1381.00], [ 1.606647240E+000, 4.139513320E-002, -2.235854440E-005, 5.784560480E-009, -5.695303380E-013, -3.075860090E+004, 2.024296710E+001] ), NASA( [ 1381.00, 5000.00], [ 1.290040800E+001, 1.922117700E-002, -6.638709860E-006, 1.037334110E-009, -6.045095140E-014, -3.520624260E+004, -4.208035990E+001] ) ), note = "4/ 3/ 0 therm" ) species(name = "ch2choohcoch3", atoms = " C:4 H:7 O:3 ", thermo = ( NASA( [ 300.00, 1394.00], [ 1.552047690E+000, 6.082012620E-002, -5.047043830E-005, 2.163475870E-008, -3.756740810E-012, -1.895635400E+004, 2.710118960E+001] ), NASA( [ 1394.00, 5000.00], [ 1.931580160E+001, 1.565926020E-002, -5.453956040E-006, 8.571600860E-010, -5.015828850E-014, -2.477522010E+004, -6.702965810E+001] ) ), note = "6/27/95" ) species(name = "ch3choohcoch3", atoms = " C:4 H:8 O:3 ", thermo = ( NASA( [ 300.00, 1394.00], [ 6.002242130E-001, 6.627927120E-002, -5.440426600E-005, 2.322948260E-008, -4.034795780E-012, -4.354376680E+004, 2.933677050E+001] ), NASA( [ 1394.00, 5000.00], [ 1.972765050E+001, 1.783345110E-002, -6.198585960E-006, 9.728311830E-010, -5.687071180E-014, -4.984096080E+004, -7.210706690E+001] ) ), note = "6/27/95" ) species(name = "ch3choococh3", atoms = " C:4 H:7 O:3 ", thermo = ( NASA( [ 300.00, 1393.00], [ 1.594053120E+000, 5.747294870E-002, -4.650714590E-005, 2.018168050E-008, -3.611756000E-012, -2.534451780E+004, 2.608574800E+001] ), NASA( [ 1393.00, 5000.00], [ 1.721708320E+001, 1.767404530E-002, -6.103873210E-006, 9.537116930E-010, -5.557574090E-014, -3.052803700E+004, -5.679596570E+001] ) ), note = "6/27/95" ) species(name = "ch3chcoch3", atoms = " C:4 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1384.00], [ 8.129410790E-001, 4.292569440E-002, -2.692302520E-005, 8.593268070E-009, -1.131881290E-012, -1.052474810E+004, 2.329526850E+001] ), NASA( [ 1384.00, 5000.00], [ 1.313880320E+001, 1.660910730E-002, -5.769242150E-006, 9.049781650E-010, -5.288265270E-014, -1.511620980E+004, -4.388765800E+001] ) ), note = "4/ 3/ 0 therm" ) species(name = "c2h3coch3", atoms = " C:4 H:6 O:1 ", thermo = ( NASA( [ 300.00, 1386.00], [ 2.455785010E-001, 4.264320490E-002, -2.911268220E-005, 1.034783920E-008, -1.535513810E-012, -1.703053790E+004, 2.644307990E+001] ), NASA( [ 1386.00, 5000.00], [ 1.255719950E+001, 1.496726450E-002, -5.200153510E-006, 8.158643650E-010, -4.768244060E-014, -2.146229580E+004, -4.014342990E+001] ) ), note = "6/19/95 therm" ) species(name = "ch3chco", atoms = " C:3 H:4 O:1 ", thermo = ( NASA( [ 300.00, 1400.00], [ 1.483801190E+000, 3.222030130E-002, -2.702500330E-005, 1.204991640E-008, -2.183659310E-012, -1.152765400E+004, 1.715520680E+001] ), NASA( [ 1400.00, 5000.00], [ 1.002191230E+001, 9.569663000E-003, -3.262216440E-006, 5.052317060E-010, -2.925932570E-014, -1.424827380E+004, -2.778299730E+001] ) ), note = "03/03/95 therm" ) species(name = "ch2ch2cho", atoms = " C:3 H:5 O:1 ", thermo = ( NASA( [ 300.00, 1371.00], [ 2.952027530E+000, 2.482970510E-002, -1.234871530E-005, 2.494498690E-009, -8.448206890E-014, 3.851819440E+002, 1.531813880E+001] ), NASA( [ 1371.00, 5000.00], [ 9.976697300E+000, 1.158993780E-002, -3.935932470E-006, 6.086015070E-010, -3.522468740E-014, -2.411158160E+003, -2.360144200E+001] ) ), note = "6/26/95 therm" ) species(name = "c3h6cho-3", atoms = " C:4 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1387.00], [ 1.351686590E+000, 4.237140830E-002, -2.691231920E-005, 8.701325670E-009, -1.152874550E-012, -6.911666100E+003, 2.093815090E+001] ), NASA( [ 1387.00, 5000.00], [ 1.343017380E+001, 1.622507920E-002, -5.606317130E-006, 8.763562730E-010, -5.108642410E-014, -1.135610980E+004, -4.473712620E+001] ) ), note = "11/15/95 therm" ) species(name = "c3h6cho-2", atoms = " C:4 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1682.00], [ 2.950675310E+000, 3.342230790E-002, -1.453568150E-005, 1.672820480E-009, 2.620115550E-013, -3.790343240E+003, 1.743240720E+001] ), NASA( [ 1682.00, 5000.00], [ 1.119428160E+001, 1.818067720E-002, -6.359166620E-006, 1.007273330E-009, -5.939436180E-014, -6.868264600E+003, -2.802989560E+001] ) ), note = "11/15/95 therm" ) species(name = "c2h5chco", atoms = " C:4 H:6 O:1 ", thermo = ( NASA( [ 300.00, 1400.00], [ 2.766006550E-001, 4.829665930E-002, -4.023769280E-005, 1.765642540E-008, -3.143653570E-012, -1.417173510E+004, 2.471186710E+001] ), NASA( [ 1400.00, 5000.00], [ 1.341005370E+001, 1.387666780E-002, -4.741301430E-006, 7.355041880E-010, -4.264577520E-014, -1.837908370E+004, -4.452953520E+001] ) ), note = "9/27/95 therm" ) species(name = "ic3h5coch3", atoms = " C:5 H:8 O:1 ", thermo = ( NASA( [ 300.00, 1389.00], [ 8.092464540E-001, 5.283770810E-002, -3.550407120E-005, 1.247870590E-008, -1.835444550E-012, -2.113227520E+004, 2.341208200E+001] ), NASA( [ 1389.00, 5000.00], [ 1.571357460E+001, 1.941047170E-002, -6.711605420E-006, 1.049571190E-009, -6.120037300E-014, -2.650710750E+004, -5.722690760E+001] ) ), note = "11/14/95 ther" ) species(name = "ic3h5coch2", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [ 5.488007120E-001, 5.644069350E-002, -4.454922440E-005, 1.832087970E-008, -3.088799490E-012, 1.425693000E+002, 2.399851230E+001] ), NASA( [ 1391.00, 5000.00], [ 1.704073210E+001, 1.592147860E-002, -5.550635980E-006, 8.728913340E-010, -5.109989240E-014, -5.418485210E+003, -6.392283760E+001] ) ), note = "11/14/95 ther" ) species(name = "ac3h4coch3", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1389.00], [-3.841314060E-001, 5.591672040E-002, -4.214249010E-005, 1.673142390E-008, -2.756641060E-012, -3.122329420E+003, 2.934642400E+001] ), NASA( [ 1389.00, 5000.00], [ 1.568803610E+001, 1.743100980E-002, -6.056765100E-006, 9.503429510E-010, -5.554584740E-014, -8.663090580E+003, -5.672775840E+001] ) ), note = "2/22/96 therm" ) species(name = "sc3h5coch2", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1392.00], [ 1.826858410E-001, 5.431411790E-002, -4.113509630E-005, 1.660728480E-008, -2.791577420E-012, -1.084518650E+002, 2.606296110E+001] ), NASA( [ 1392.00, 5000.00], [ 1.532118610E+001, 1.760478890E-002, -6.084925480E-006, 9.513251020E-010, -5.546166510E-014, -5.293568130E+003, -5.486768230E+001] ) ), note = "2/22/96 therm" ) species(name = "ch3chocho", atoms = " C:3 H:5 O:2 ", thermo = ( NASA( [ 300.00, 1395.00], [ 5.060968970E-001, 4.261217020E-002, -3.376283790E-005, 1.394229140E-008, -2.353173190E-012, -1.749521360E+004, 2.587429160E+001] ), NASA( [ 1395.00, 5000.00], [ 1.278275390E+001, 1.215293470E-002, -4.212281030E-006, 6.598440070E-010, -3.852286840E-014, -2.159468460E+004, -3.945120360E+001] ) ), note = "11/14/95 therm" ) species(name = "ch3chcho", atoms = " C:3 H:5 O:1 ", thermo = ( NASA( [ 300.00, 1385.00], [ 1.541969140E+000, 3.032973910E-002, -1.889226900E-005, 5.922633580E-009, -7.537623160E-013, -4.017610980E+003, 1.837070110E+001] ), NASA( [ 1385.00, 5000.00], [ 1.026475280E+001, 1.172950610E-002, -4.062675610E-006, 6.360867510E-010, -3.712201900E-014, -7.259104880E+003, -2.916466380E+001] ) ), note = "4/ 3/ 0 therm" ) species(name = "sc3h5cho", atoms = " C:4 H:6 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [ 4.357951710E-001, 4.487193140E-002, -3.365829310E-005, 1.330668700E-008, -2.178391280E-012, -1.603946510E+004, 2.375974520E+001] ), NASA( [ 1390.00, 5000.00], [ 1.316959040E+001, 1.424844340E-002, -4.908439980E-006, 7.657890410E-010, -4.458348960E-014, -2.040326130E+004, -4.436732050E+001] ) ), note = "11/15/95 ther" ) species(name = "sc3h5co", atoms = " C:4 H:5 O:1 ", thermo = ( NASA( [ 300.00, 1392.00], [ 1.741913430E+000, 3.972295360E-002, -3.200619010E-005, 1.382279250E-008, -2.462720170E-012, -6.644281000E+002, 1.707620230E+001] ), NASA( [ 1392.00, 5000.00], [ 1.255147540E+001, 1.225219480E-002, -4.223821010E-006, 6.591848960E-010, -3.838188260E-014, -4.253497950E+003, -4.028641450E+001] ) ), note = "11/15/95 therm" ) species(name = "ic3h6cho", atoms = " C:4 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [ 5.214817670E-001, 4.431143570E-002, -2.866173140E-005, 9.303198940E-009, -1.207615630E-012, -2.996770860E+003, 2.681821300E+001] ), NASA( [ 1390.00, 5000.00], [ 1.331022500E+001, 1.620979590E-002, -5.575758910E-006, 8.690037180E-010, -5.055542020E-014, -7.621779310E+003, -4.250508540E+001] ) ), note = "2/22/96 therm" ) species(name = "c3h6cho-1", atoms = " C:4 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1379.00], [ 2.676723030E+000, 3.730641280E-002, -2.112814050E-005, 5.804726810E-009, -6.096882360E-013, -2.497141830E+003, 1.757509330E+001] ), NASA( [ 1379.00, 5000.00], [ 1.303229540E+001, 1.624183730E-002, -5.543881240E-006, 8.597236850E-010, -4.984597260E-014, -6.459159750E+003, -3.923990210E+001] ) ), note = "9/27/95 therm" ) species(name = "c2h5coc2h5", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1376.00], [ 1.590946110E+000, 5.455415590E-002, -3.334076410E-005, 1.059313870E-008, -1.420029140E-012, -3.392827400E+004, 2.099830800E+001] ), NASA( [ 1376.00, 5000.00], [ 1.671318960E+001, 2.247698050E-002, -7.618301620E-006, 1.176584920E-009, -6.804568880E-014, -3.960204460E+004, -6.153620040E+001] ) ), note = "2/22/96 therm" ) species(name = "c2h5coc2h4p", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1376.00], [ 2.394494610E+000, 4.987318390E-002, -3.073943870E-005, 9.950802600E-009, -1.375708320E-012, -9.321239540E+003, 2.011628070E+001] ), NASA( [ 1376.00, 5000.00], [ 1.620008270E+001, 2.051066470E-002, -6.969779820E-006, 1.078262300E-009, -6.243244060E-014, -1.450672210E+004, -5.522726100E+001] ) ), note = "2/22/96 thrm" ) species(name = "c2h5coc2h4s", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1385.00], [ 1.107281060E+000, 5.489029700E-002, -3.676959390E-005, 1.328674260E-008, -2.069666900E-012, -1.374353630E+004, 2.328043150E+001] ), NASA( [ 1385.00, 5000.00], [ 1.619044700E+001, 2.121692930E-002, -7.354129190E-006, 1.151873770E-009, -6.723808640E-014, -1.926507630E+004, -5.849372650E+001] ) ), note = "2/22/96 thrm" ) species(name = "c2h5coc2h3", atoms = " C:5 H:8 O:1 ", thermo = ( NASA( [ 300.00, 1387.00], [ 4.891264320E-001, 5.499518230E-002, -3.969891010E-005, 1.557003730E-008, -2.600708180E-012, -2.024584990E+004, 2.594111420E+001] ), NASA( [ 1387.00, 5000.00], [ 1.559169470E+001, 1.960283020E-002, -6.797372850E-006, 1.064960150E-009, -6.217671890E-014, -2.559883510E+004, -5.533028180E+001] ) ), note = "2/22/96 therm" ) species(name = "pc2h4coc2h3", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1404.00], [ 7.625396790E-001, 5.358056550E-002, -4.364650220E-005, 1.992326990E-008, -3.733353860E-012, 4.422608000E+003, 2.666047510E+001] ), NASA( [ 1404.00, 5000.00], [ 1.267328410E+001, 2.023661920E-002, -6.610892030E-006, 9.938787460E-010, -5.634577330E-014, 7.740112250E+002, -3.545435940E+001] ) ), note = "2/22/96 thrm" ) species(name = "sc2h4coc2h3", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1389.00], [-1.601140350E-001, 5.579540710E-002, -4.313532980E-005, 1.764574440E-008, -2.993842610E-012, -3.120602180E+001, 2.834406090E+001] ), NASA( [ 1389.00, 5000.00], [ 1.580742130E+001, 1.697210220E-002, -5.913176080E-006, 9.294490820E-010, -5.439031610E-014, -5.492303890E+003, -5.698672050E+001] ) ), note = "2/22/96 thrm" ) species(name = "ic3h6chcho", atoms = " C:5 H:8 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [ 9.930607720E-001, 5.496460740E-002, -3.976148600E-005, 1.527586560E-008, -2.454671800E-012, -2.085668340E+004, 2.162965320E+001] ), NASA( [ 1390.00, 5000.00], [ 1.636758230E+001, 1.874512500E-002, -6.458191460E-006, 1.007557910E-009, -5.865566820E-014, -2.622135240E+004, -6.092724240E+001] ) ), note = "2/22/96 therm" ) species(name = "ic3h6chco", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [ 2.231896810E+000, 5.011071120E-002, -3.848703290E-005, 1.596628930E-008, -2.765468770E-012, -5.471697160E+003, 1.525677630E+001] ), NASA( [ 1391.00, 5000.00], [ 1.580854130E+001, 1.664037900E-002, -5.723824600E-006, 8.919512530E-010, -5.188125800E-014, -1.008698370E+004, -5.716315690E+001] ) ), note = "2/22/96 therm" ) species(name = "ac3h5chcho", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [ 1.738217310E-001, 5.865622590E-002, -4.787116100E-005, 2.036907780E-008, -3.540936150E-012, -2.546319560E+003, 2.463356430E+001] ), NASA( [ 1390.00, 5000.00], [ 1.728756440E+001, 1.576752340E-002, -5.510227660E-006, 8.679360680E-010, -5.086700210E-014, -8.245988600E+003, -6.632665540E+001] ) ), note = "2/22/96 therm" ) species(name = "ic3h6chcoch3", atoms = " C:6 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1386.00], [ 8.854273220E-001, 6.253112800E-002, -4.000289980E-005, 1.333601390E-008, -1.875370150E-012, -2.622818180E+004, 2.475951840E+001] ), NASA( [ 1386.00, 5000.00], [ 1.846638500E+001, 2.442594500E-002, -8.472138740E-006, 1.327610500E-009, -7.752246140E-014, -3.273963610E+004, -7.089684960E+001] ) ), note = "3/4/96 thrm" ) species(name = "ac3h5chcoch3", atoms = " C:6 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1386.00], [ 3.321948440E-001, 6.509254720E-002, -4.644837780E-005, 1.731656940E-008, -2.694075900E-012, -7.959524570E+003, 2.652013350E+001] ), NASA( [ 1386.00, 5000.00], [ 1.940935800E+001, 2.128034500E-002, -7.433947920E-006, 1.170589280E-009, -6.858798380E-014, -1.473436690E+004, -7.632961540E+001] ) ), note = "3/4/96 thrm" ) species(name = "ic3h6chcoch2", atoms = " C:6 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1388.00], [ 6.526121170E-001, 6.460891810E-002, -4.712133840E-005, 1.823505550E-008, -2.958815860E-012, -4.909023850E+003, 2.437286540E+001] ), NASA( [ 1388.00, 5000.00], [ 1.905765220E+001, 2.144197830E-002, -7.458011140E-006, 1.170936500E-009, -6.846686400E-014, -1.137187450E+004, -7.456172620E+001] ) ), note = "3/4/96 thrm" ) species(name = "nc3h7coch3", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1383.00], [ 1.240373610E+000, 5.424940470E-002, -3.148253320E-005, 9.144923210E-009, -1.076655660E-012, -3.362764720E+004, 2.361500680E+001] ), NASA( [ 1383.00, 5000.00], [ 1.618415640E+001, 2.352458810E-002, -8.096750550E-006, 1.262306900E-009, -7.344878390E-014, -3.933754740E+004, -5.829806150E+001] ) ), note = "2/22/96 therm" ) species(name = "nc3h7coch2", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1389.00], [ 9.582992710E-001, 5.681625320E-002, -3.991127810E-005, 1.526715140E-008, -2.492210470E-012, -1.230622380E+004, 2.341128840E+001] ), NASA( [ 1389.00, 5000.00], [ 1.615024190E+001, 2.140934660E-002, -7.360596140E-006, 1.146568160E-009, -6.667127220E-014, -1.769685610E+004, -5.838648840E+001] ) ), note = "2/22/96 therm" ) species(name = "c3h6coch3-1", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1381.00], [ 2.000332690E+000, 4.960745650E-002, -2.874706000E-005, 8.266668300E-009, -9.510742120E-013, -9.010108450E+003, 2.227617910E+001] ), NASA( [ 1381.00, 5000.00], [ 1.580529480E+001, 2.127874570E-002, -7.318424960E-006, 1.140493550E-009, -6.634463810E-014, -1.428275870E+004, -5.340166780E+001] ) ), note = "2/22/96 thrm" ) species(name = "c3h6coch3-2", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 2017.00], [ 2.205851840E+000, 4.596056970E-002, -2.231755530E-005, 4.036453320E-009, -1.915852520E-014, -1.029184460E+004, 2.245563040E+001] ), NASA( [ 2017.00, 5000.00], [ 1.369947630E+001, 2.339976020E-002, -8.208380830E-006, 1.302684990E-009, -7.691511980E-014, -1.447735170E+004, -4.048200650E+001] ) ), note = "2/22/96 thrm" ) species(name = "c3h6coch3-3", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1389.00], [ 6.368293930E-001, 5.500477190E-002, -3.532205380E-005, 1.182378070E-008, -1.655500230E-012, -1.342217680E+004, 2.578392380E+001] ), NASA( [ 1389.00, 5000.00], [ 1.579767890E+001, 2.170910540E-002, -7.464877690E-006, 1.163002530E-009, -6.763660220E-014, -1.896704890E+004, -5.650476950E+001] ) ), note = "2/22/96 thrm" ) species(name = "ic3h7coch3", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1389.00], [-9.318154200E-001, 6.115776940E-002, -3.863690730E-005, 1.223371410E-008, -1.551330660E-012, -3.412052610E+004, 3.297002760E+001] ), NASA( [ 1389.00, 5000.00], [ 1.660645190E+001, 2.320196470E-002, -7.994190960E-006, 1.247269040E-009, -7.261445950E-014, -4.054451590E+004, -6.234415650E+001] ) ), note = "2/22/96 therm" ) species(name = "ic3h7coch2", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1392.00], [-1.394388340E+000, 6.437602520E-002, -4.761054910E-005, 1.842191340E-008, -2.947714010E-012, -1.276956530E+004, 3.362409840E+001] ), NASA( [ 1392.00, 5000.00], [ 1.713580060E+001, 2.041359310E-002, -7.078256230E-006, 1.109048670E-009, -6.475754440E-014, -1.917597630E+004, -6.572035480E+001] ) ), note = "2/22/96 therm" ) species(name = "ic3h6coch3", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1388.00], [-4.447492740E-001, 5.795874260E-002, -3.825562150E-005, 1.302319610E-008, -1.838588520E-012, -9.468059360E+003, 3.284654460E+001] ), NASA( [ 1388.00, 5000.00], [ 1.617235420E+001, 2.124150580E-002, -7.365602800E-006, 1.154054510E-009, -6.738332250E-014, -1.550929680E+004, -5.724440930E+001] ) ), note = "2/22/96 therm" ) species(name = "tc3h6coch3", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1384.00], [ 1.494966420E+000, 5.231126850E-002, -3.183573570E-005, 9.764629810E-009, -1.223032320E-012, -1.553290860E+004, 1.994455430E+001] ), NASA( [ 1384.00, 5000.00], [ 1.635305100E+001, 2.106764900E-002, -7.300827550E-006, 1.143419300E-009, -6.674208490E-014, -2.112076710E+004, -6.121895360E+001] ) ), note = "2/22/96 therm" ) species(name = "nc3h7coc2h5", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1378.00], [ 1.283004890E+000, 6.708498810E-002, -4.199849820E-005, 1.368042650E-008, -1.869871550E-012, -3.680394300E+004, 2.480548410E+001] ), NASA( [ 1378.00, 5000.00], [ 1.996278930E+001, 2.680784510E-002, -9.085272690E-006, 1.402883300E-009, -8.111763450E-014, -4.372157190E+004, -7.687027680E+001] ) ), note = "2/22/96 thrm" ) species(name = "c3h6coc2h5-1", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1380.00], [ 2.089587030E+000, 6.248781150E-002, -3.972570780E-005, 1.337529410E-008, -1.921937950E-012, -1.219925570E+004, 2.320352070E+001] ), NASA( [ 1380.00, 5000.00], [ 1.923911480E+001, 2.516591470E-002, -8.575080830E-006, 1.328472550E-009, -7.697748080E-014, -1.854048900E+004, -7.006170260E+001] ) ), note = "2/22/96 trm" ) species(name = "c3h6coc2h5-2", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1369.00], [ 2.839743340E+000, 5.594715690E-002, -2.819548890E-005, 5.561032210E-009, -1.031639810E-013, -1.355315690E+004, 2.094582740E+001] ), NASA( [ 1369.00, 5000.00], [ 1.910836480E+001, 2.490044380E-002, -8.412466920E-006, 1.296613830E-009, -7.488827920E-014, -1.993342700E+004, -6.895653900E+001] ) ), note = "2/22/96 trm" ) species(name = "c3h6coc2h5-3", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1386.00], [ 8.238304060E-001, 6.746268970E-002, -4.571473590E-005, 1.667075860E-008, -2.604167400E-012, -1.662636150E+004, 2.625651740E+001] ), NASA( [ 1386.00, 5000.00], [ 1.934096440E+001, 2.569270900E-002, -8.883655380E-006, 1.389172720E-009, -8.099822550E-014, -2.334161770E+004, -7.394805310E+001] ) ), note = "2/22/96 trm" ) species(name = "nc3h7coc2h4p", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1380.00], [ 2.089587030E+000, 6.248781150E-002, -3.972570780E-005, 1.337529410E-008, -1.921937950E-012, -1.219925570E+004, 2.320352070E+001] ), NASA( [ 1380.00, 5000.00], [ 1.923911480E+001, 2.516591470E-002, -8.575080830E-006, 1.328472550E-009, -7.697748080E-014, -1.854048900E+004, -7.006170260E+001] ) ), note = "2/22/96 trm" ) species(name = "nc3h7coc2h4s", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1386.00], [ 8.238304060E-001, 6.746268970E-002, -4.571473590E-005, 1.667075860E-008, -2.604167400E-012, -1.662636150E+004, 2.625651740E+001] ), NASA( [ 1386.00, 5000.00], [ 1.934096440E+001, 2.569270900E-002, -8.883655380E-006, 1.389172720E-009, -8.099822550E-014, -2.334161770E+004, -7.394805310E+001] ) ), note = "2/22/96 trm" ) species(name = "ic3h7coc2h5", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1388.00], [-6.166800770E-001, 7.326425230E-002, -4.899790810E-005, 1.738493820E-008, -2.611372710E-012, -3.734812240E+004, 3.281346780E+001] ), NASA( [ 1388.00, 5000.00], [ 1.957426240E+001, 2.791539550E-002, -9.622408240E-006, 1.501590410E-009, -8.742729230E-014, -4.464958380E+004, -7.644997120E+001] ) ), note = "2/22/96 thrm" ) species(name = "ic3h6coc2h5", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1388.00], [ 1.857925670E-001, 6.856818890E-002, -4.632018560E-005, 1.664035860E-008, -2.533942380E-012, -1.274058500E+004, 3.125003040E+001] ), NASA( [ 1388.00, 5000.00], [ 1.914271690E+001, 2.579975690E-002, -8.906988430E-006, 1.391398040E-009, -8.107045510E-014, -1.958120030E+004, -7.127543310E+001] ) ), note = "2/22/96 thrm" ) species(name = "tc3h6coc2h5", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1385.00], [ 1.539437270E+000, 6.563023190E-002, -4.391378250E-005, 1.590158190E-008, -2.485209030E-012, -1.872037990E+004, 2.103663850E+001] ), NASA( [ 1385.00, 5000.00], [ 1.940964290E+001, 2.564609080E-002, -8.869902490E-006, 1.387247010E-009, -8.089435230E-014, -2.525440060E+004, -7.581779410E+001] ) ), note = "2/22/96 thrm" ) species(name = "ic3h7coc2h4p", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1388.00], [ 1.857925670E-001, 6.856818890E-002, -4.632018560E-005, 1.664035860E-008, -2.533942380E-012, -1.274058500E+004, 3.125003040E+001] ), NASA( [ 1388.00, 5000.00], [ 1.914271690E+001, 2.579975690E-002, -8.906988430E-006, 1.391398040E-009, -8.107045510E-014, -1.958120030E+004, -7.127543310E+001] ) ), note = "2/22/96 trm" ) species(name = "ic3h7coc2h4s", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [-1.705581010E+000, 7.609037080E-002, -5.546692170E-005, 2.139402430E-008, -3.444990970E-012, -1.706925850E+004, 3.723598080E+001] ), NASA( [ 1391.00, 5000.00], [ 1.982037390E+001, 2.535802980E-002, -8.785181350E-006, 1.375644740E-009, -8.028751520E-014, -2.457975430E+004, -7.834710520E+001] ) ), note = "2/22/96 trm" ) species(name = "ic3h7coc2h3", atoms = " C:6 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1392.00], [-1.880272620E+000, 7.406234060E-002, -5.508425770E-005, 2.155652310E-008, -3.496289580E-012, -2.363428560E+004, 3.787146800E+001] ), NASA( [ 1392.00, 5000.00], [ 1.920389560E+001, 2.372019470E-002, -8.211777100E-006, 1.285261530E-009, -7.498921230E-014, -3.090113180E+004, -7.506745620E+001] ) ), note = "2/22/96 thrm" ) species(name = "ic3h6coc2h3", atoms = " C:6 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1392.00], [-1.123869810E+000, 6.955984150E-002, -5.266476460E-005, 2.094403280E-008, -3.442294350E-012, 9.804156350E+002, 3.652316350E+001] ), NASA( [ 1392.00, 5000.00], [ 1.879305020E+001, 2.156202060E-002, -7.476334360E-006, 1.171400150E-009, -6.839717790E-014, -5.837270410E+003, -7.000218740E+001] ) ), note = "2/22/96 thrm" ) species(name = "tc3h6coc2h3", atoms = " C:6 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1382.00], [ 1.882195880E+000, 5.334205590E-002, -2.883220440E-005, 6.816791580E-009, -4.635042950E-013, -1.794762130E+003, 2.351726230E+001] ), NASA( [ 1382.00, 5000.00], [ 1.748891190E+001, 2.273873920E-002, -7.897613310E-006, 1.238765710E-009, -7.238484540E-014, -7.864748520E+003, -6.248625750E+001] ) ), note = "2/22/96 thrm" ) species(name = "ic3h5coc2h5", atoms = " C:6 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1388.00], [ 9.324485740E-001, 6.578998720E-002, -4.706088710E-005, 1.830437780E-008, -3.030658420E-012, -2.433094380E+004, 2.414436480E+001] ), NASA( [ 1388.00, 5000.00], [ 1.875077880E+001, 2.399711180E-002, -8.281684600E-006, 1.293366200E-009, -7.534308800E-014, -3.063119140E+004, -7.170818590E+001] ) ), note = "2/22/96 thrm" ) species(name = "ac3h4coc2h5", atoms = " C:6 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1389.00], [ 2.222574900E-002, 6.989244850E-002, -5.574418820E-005, 2.369231950E-008, -4.168239860E-012, -6.007204130E+003, 2.756716540E+001] ), NASA( [ 1389.00, 5000.00], [ 1.971605670E+001, 2.091056840E-002, -7.281025840E-006, 1.143982540E-009, -6.692503850E-014, -1.266017030E+004, -7.733342560E+001] ) ), note = "2/22/96 thrm" ) species(name = "ic3h5coc2h4p", atoms = " C:6 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1388.00], [ 1.734829090E+000, 6.108991330E-002, -4.437105380E-005, 1.754667500E-008, -2.949221110E-012, 2.767163970E+002, 2.258221780E+001] ), NASA( [ 1388.00, 5000.00], [ 1.832427460E+001, 2.187036960E-002, -7.561008620E-006, 1.182211420E-009, -6.892467340E-014, -5.564086620E+003, -6.656023090E+001] ) ), note = "2/22/96 trm" ) species(name = "ic3h5coc2h4s", atoms = " C:6 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [ 3.030366380E-001, 6.646349130E-002, -5.024326000E-005, 2.021286680E-008, -3.387707240E-012, -4.118510530E+003, 2.646223280E+001] ), NASA( [ 1391.00, 5000.00], [ 1.898239440E+001, 2.138032880E-002, -7.408355240E-006, 1.160181200E-009, -6.771757140E-014, -1.054074680E+004, -7.347874960E+001] ) ), note = "2/22/96 trm" ) species(name = "nc4h9cho", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1381.00], [ 1.596634720E+000, 5.435414160E-002, -3.210206510E-005, 9.357735590E-009, -1.066889320E-012, -2.998410250E+004, 2.212814980E+001] ), NASA( [ 1381.00, 5000.00], [ 1.679651630E+001, 2.256845190E-002, -7.676315880E-006, 1.187693690E-009, -6.875455540E-014, -3.568260800E+004, -6.090633120E+001] ) ), note = "2/29/96 therm" ) species(name = "nc4h9co", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1382.00], [ 2.435302380E+000, 4.936823760E-002, -2.898830820E-005, 8.428638120E-009, -9.682871720E-013, -1.146755410E+004, 1.926958790E+001] ), NASA( [ 1382.00, 5000.00], [ 1.617829390E+001, 2.079919200E-002, -7.117878920E-006, 1.105599750E-009, -6.416971870E-014, -1.665377520E+004, -5.589435790E+001] ) ), note = "2/29/96 therm" ) species(name = "ac3h5cho", atoms = " C:4 H:6 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [ 1.596531210E-001, 4.257613470E-002, -2.919005930E-005, 1.040442550E-008, -1.536829040E-012, -1.078596560E+004, 2.820873230E+001] ), NASA( [ 1390.00, 5000.00], [ 1.228111610E+001, 1.501673970E-002, -5.176053030E-006, 8.077969720E-010, -4.703793600E-014, -1.509852830E+004, -3.720557100E+001] ) ), note = "2/29/96 therm" ) species(name = "ac3h5co", atoms = " C:4 H:5 O:1 ", thermo = ( NASA( [ 300.00, 1389.00], [ 9.343000270E-001, 3.777518240E-002, -2.613845810E-005, 9.340410360E-009, -1.375982940E-012, 7.742236390E+003, 2.566362310E+001] ), NASA( [ 1389.00, 5000.00], [ 1.186465900E+001, 1.288528320E-002, -4.454608880E-006, 6.966130450E-010, -4.062154900E-014, 3.863444520E+003, -3.329899990E+001] ) ), note = "2/29/96 therm" ) species(name = "c2h3chcho", atoms = " C:4 H:5 O:1 ", thermo = ( NASA( [ 300.00, 1382.00], [-8.779929830E-003, 3.986305090E-002, -2.661308500E-005, 8.746445090E-009, -1.141287590E-012, 6.224750380E+003, 2.795916640E+001] ), NASA( [ 1382.00, 5000.00], [ 1.240740590E+001, 1.273197110E-002, -4.471993960E-006, 7.068199220E-010, -4.152455360E-014, 1.717065850E+003, -3.940394640E+001] ) ), note = "2/29/96 therm" ) species(name = "c4h8cho-1", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1382.00], [ 2.418428320E+000, 4.962721270E-002, -2.949959660E-005, 8.760686530E-009, -1.040844760E-012, -5.380556160E+003, 2.046094220E+001] ), NASA( [ 1382.00, 5000.00], [ 1.623873850E+001, 2.067855030E-002, -7.062165760E-006, 1.095530030E-009, -6.353073820E-014, -1.057178720E+004, -5.504469530E+001] ) ), note = "2/29/96 therm" ) species(name = "c4h8cho-2", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 2014.00], [ 2.670050260E+000, 4.581930920E-002, -2.294103930E-005, 4.537614360E-009, -1.265937720E-013, -6.670027120E+003, 2.042499410E+001] ), NASA( [ 2014.00, 5000.00], [ 1.414076670E+001, 2.283578860E-002, -7.969042100E-006, 1.260403790E-009, -7.424668340E-014, -1.079600870E+004, -4.220995850E+001] ) ), note = "2/29/96 therm" ) species(name = "c4h8cho-3", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 2014.00], [ 2.670050260E+000, 4.581930920E-002, -2.294103930E-005, 4.537614360E-009, -1.265937720E-013, -6.670027120E+003, 2.042499410E+001] ), NASA( [ 2014.00, 5000.00], [ 1.414076670E+001, 2.283578860E-002, -7.969042100E-006, 1.260403790E-009, -7.424668340E-014, -1.079600870E+004, -4.220995850E+001] ) ), note = "2/29/96 therm" ) species(name = "c4h8cho-4", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1388.00], [ 1.164942710E+000, 5.439454610E-002, -3.490007920E-005, 1.145827110E-008, -1.546973750E-012, -9.806197290E+003, 2.348971100E+001] ), NASA( [ 1388.00, 5000.00], [ 1.659696150E+001, 2.071969990E-002, -7.149692120E-006, 1.116591880E-009, -6.504920390E-014, -1.545394990E+004, -6.031801920E+001] ) ), note = "2/29/96 therm" ) species(name = "neoc5h9q2", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1390.00], [ 5.362249090E-001, 9.285315980E-002, -7.761068670E-005, 3.322251370E-008, -5.750836710E-012, -1.891328040E+004, 3.153724330E+001] ), NASA( [ 1390.00, 5000.00], [ 2.849248170E+001, 2.231694310E-002, -7.852390930E-006, 1.242550700E-009, -7.305665680E-014, -2.812591850E+004, -1.167986350E+002] ) ), note = "7/19/ 0 therm" ) species(name = "neoc5h9q2-n", atoms = " C:5 H:11 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 2.051912350E+000, 8.763085650E-002, -7.112488330E-005, 2.972244100E-008, -5.056754320E-012, -2.175046340E+004, 2.440108340E+001] ), NASA( [ 1389.00, 5000.00], [ 2.842836060E+001, 2.236196350E-002, -7.865474420E-006, 1.244309120E-009, -7.314662950E-014, -3.058551900E+004, -1.160319820E+002] ) ), note = "7/19/ 0 thrm" ) species(name = "ic4h6q2-ii", atoms = " C:4 H:8 O:4 ", thermo = ( NASA( [ 300.00, 1395.00], [ 5.233279600E+000, 6.087356780E-002, -4.907870990E-005, 2.079663680E-008, -3.605502300E-012, -2.649880620E+004, 1.018818620E+001] ), NASA( [ 1395.00, 5000.00], [ 2.240515810E+001, 1.755624290E-002, -6.073641560E-006, 9.501669570E-010, -5.541973500E-014, -3.218185750E+004, -8.096612090E+001] ) ), note = "3/27/97 therm" ) species(name = "hoch2o", atoms = " C:1 H:3 O:2 ", thermo = ( NASA( [ 300.00, 1452.00], [ 4.111831450E+000, 7.538506970E-003, 3.773373700E-006, -5.387460050E-009, 1.456158870E-012, -2.124719180E+004, 7.468072540E+000] ), NASA( [ 1452.00, 5000.00], [ 6.395215150E+000, 7.436730430E-003, -2.504223540E-006, 3.848797120E-010, -2.217786890E-014, -2.255577580E+004, -6.638655830E+000] ) ), note = "4/ 9/98 therm" ) species(name = "hocho", atoms = " C:1 H:2 O:2 ", thermo = ( NASA( [ 300.00, 1376.00], [ 1.435481850E+000, 1.633630160E-002, -1.062574210E-005, 3.321329770E-009, -4.021761030E-013, -4.646165040E+004, 1.728857980E+001] ), NASA( [ 1376.00, 5000.00], [ 6.687330130E+000, 5.142893680E-003, -1.822385130E-006, 2.897191630E-010, -1.708921990E-014, -4.839954000E+004, -1.131047980E+001] ) ), note = "4/ 9/98 therm" ) species(name = "ic6h14", atoms = " C:6 H:14 ", thermo = ( NASA( [ 300.00, 1392.00], [-1.490393550E+000, 7.497838880E-002, -4.664347100E-005, 1.493489630E-008, -1.972510900E-012, -2.382325440E+004, 3.410611530E+001] ), NASA( [ 1392.00, 5000.00], [ 1.892189680E+001, 3.077146650E-002, -1.055239350E-005, 1.640943070E-009, -9.530432160E-014, -3.134070830E+004, -7.688807610E+001] ) ), note = "7/19/ 0" ) species(name = "ac6h13", atoms = " C:6 H:13 ", thermo = ( NASA( [ 300.00, 1392.00], [-7.212755210E-001, 7.042189540E-002, -4.415090220E-005, 1.428431170E-008, -1.911644740E-012, 7.894821510E+002, 3.269853810E+001] ), NASA( [ 1392.00, 5000.00], [ 1.850740390E+001, 2.862182710E-002, -9.821051870E-006, 1.527838800E-009, -8.876099340E-014, -6.276461610E+003, -7.180434320E+001] ) ), note = "7/19/ 0" ) species(name = "bc6h13", atoms = " C:6 H:13 ", thermo = ( NASA( [ 300.00, 1381.00], [ 2.414818930E+000, 5.371010550E-002, -2.008950840E-005, 2.388119690E-010, 1.016940010E-012, -1.904012030E+003, 1.908324620E+001] ), NASA( [ 1381.00, 5000.00], [ 1.698421940E+001, 2.994379850E-002, -1.028293750E-005, 1.600515990E-009, -9.301521130E-014, -8.093892370E+003, -6.297798970E+001] ) ), note = "7/19/ 0" ) species(name = "cc6h13", atoms = " C:6 H:13 ", thermo = ( NASA( [ 300.00, 1385.00], [-3.903168520E-001, 6.595320540E-002, -3.610955920E-005, 8.794739100E-009, -6.273015180E-013, -5.050453780E+002, 3.234709490E+001] ), NASA( [ 1385.00, 5000.00], [ 1.822416820E+001, 2.848848670E-002, -9.698006100E-006, 1.501051270E-009, -8.690829140E-014, -7.584138100E+003, -6.978092620E+001] ) ), note = "7/19/ 0" ) species(name = "dc6h13", atoms = " C:6 H:13 ", thermo = ( NASA( [ 300.00, 1385.00], [-3.903168520E-001, 6.595320540E-002, -3.610955920E-005, 8.794739100E-009, -6.273015180E-013, -5.050453780E+002, 3.234709490E+001] ), NASA( [ 1385.00, 5000.00], [ 1.822416820E+001, 2.848848670E-002, -9.698006100E-006, 1.501051270E-009, -8.690829140E-014, -7.584138100E+003, -6.978092620E+001] ) ), note = "7/19/ 0" ) species(name = "ec6h13", atoms = " C:6 H:13 ", thermo = ( NASA( [ 300.00, 1392.00], [-7.212755210E-001, 7.042189540E-002, -4.415090220E-005, 1.428431170E-008, -1.911644740E-012, 7.894821510E+002, 3.269853810E+001] ), NASA( [ 1392.00, 5000.00], [ 1.850740390E+001, 2.862182710E-002, -9.821051870E-006, 1.527838800E-009, -8.876099340E-014, -6.276461610E+003, -7.180434320E+001] ) ), note = "7/19/ 0" ) species(name = "ac6h12", atoms = " C:6 H:12 ", thermo = ( NASA( [ 300.00, 1391.00], [-5.117751700E-001, 6.755158390E-002, -4.359313150E-005, 1.471746350E-008, -2.072088230E-012, -9.281962800E+003, 3.017333840E+001] ), NASA( [ 1391.00, 5000.00], [ 1.779193140E+001, 2.688829750E-002, -9.175975630E-006, 1.422327760E-009, -8.242507410E-014, -1.590890990E+004, -6.897336050E+001] ) ), note = "2/14/95" ) species(name = "bc6h12", atoms = " C:6 H:12 ", thermo = ( NASA( [ 300.00, 1389.00], [ 6.612367590E-003, 6.410166470E-002, -3.850520170E-005, 1.175982180E-008, -1.462182930E-012, -1.080219400E+004, 2.762943620E+001] ), NASA( [ 1389.00, 5000.00], [ 1.731949680E+001, 2.731434550E-002, -9.328254040E-006, 1.446636990E-009, -8.386192420E-014, -1.725368530E+004, -6.677084020E+001] ) ), note = "2/14/95" ) species(name = "cc6h12", atoms = " C:6 H:12 ", thermo = ( NASA( [ 300.00, 1362.00], [-3.262722360E-001, 6.518410290E-002, -3.156323620E-005, 4.417774690E-009, 4.861651240E-013, -1.695883830E+004, 2.927287740E+001] ), NASA( [ 1362.00, 5000.00], [ 2.175626430E+001, 2.517254270E-002, -8.960827580E-006, 1.428878090E-009, -8.445870130E-014, -2.585294250E+004, -9.355073490E+001] ) ), note = "2/14/95" ) species(name = "dc6h12", atoms = " C:6 H:12 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.910031400E+000, 7.209138030E-002, -4.892831540E-005, 1.754365860E-008, -2.633385180E-012, -8.380849390E+003, 3.658708790E+001] ), NASA( [ 1393.00, 5000.00], [ 1.780168540E+001, 2.705034420E-002, -9.268808830E-006, 1.440607260E-009, -8.364096020E-014, -1.538953900E+004, -6.973780050E+001] ) ), note = "2/14/95" ) species(name = "ic6h11", atoms = " C:6 H:11 ", thermo = ( NASA( [ 300.00, 1388.00], [-9.073138740E-001, 6.610086220E-002, -4.330827990E-005, 1.476954800E-008, -2.108341720E-012, 7.757431940E+003, 3.092897830E+001] ), NASA( [ 1388.00, 5000.00], [ 1.774210480E+001, 2.497479700E-002, -8.646870470E-006, 1.353372020E-009, -7.896150960E-014, 9.500977410E+002, -7.024106890E+001] ) ), note = "2/14/95" ) species(name = "ac6h13o2", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1388.00], [ 8.344674570E-001, 7.861370670E-002, -5.273155980E-005, 1.898430540E-008, -2.923323180E-012, -1.763628530E+004, 2.923778650E+001] ), NASA( [ 1388.00, 5000.00], [ 2.228861480E+001, 3.039100520E-002, -1.050024760E-005, 1.641071360E-009, -9.564725080E-014, -2.542662770E+004, -8.690831270E+001] ) ), note = "7/19/ 0" ) species(name = "bc6h13o2", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1389.00], [ 3.729407000E-001, 8.393431090E-002, -6.176796630E-005, 2.477595150E-008, -4.211983060E-012, -2.068579390E+004, 2.794659100E+001] ), NASA( [ 1389.00, 5000.00], [ 2.304587420E+001, 2.977066450E-002, -1.029107690E-005, 1.608903610E-009, -9.379312460E-014, -2.861187300E+004, -9.368457100E+001] ) ), note = "7/19/ 0 therm" ) species(name = "cc6h13o2", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1391.00], [-2.036461100E-001, 8.521440480E-002, -6.261741510E-005, 2.485902570E-008, -4.161080780E-012, -1.989411330E+004, 3.255283870E+001] ), NASA( [ 1391.00, 5000.00], [ 2.304898410E+001, 2.972470240E-002, -1.026594610E-005, 1.604040200E-009, -9.347270490E-014, -2.799330310E+004, -9.214936470E+001] ) ), note = "7/19/ 0 therm" ) species(name = "dc6h13o2", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1391.00], [-2.036461100E-001, 8.521440480E-002, -6.261741510E-005, 2.485902570E-008, -4.161080780E-012, -1.989411330E+004, 3.255283870E+001] ), NASA( [ 1391.00, 5000.00], [ 2.304898410E+001, 2.972470240E-002, -1.026594610E-005, 1.604040200E-009, -9.347270490E-014, -2.799330310E+004, -9.214936470E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ec6h13o2", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1388.00], [ 8.344674570E-001, 7.861370670E-002, -5.273155980E-005, 1.898430540E-008, -2.923323180E-012, -1.763628530E+004, 2.854830480E+001] ), NASA( [ 1388.00, 5000.00], [ 2.228861480E+001, 3.039100520E-002, -1.050024760E-005, 1.641071360E-009, -9.564725080E-014, -2.542662770E+004, -8.759779430E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ac6h13o2h", atoms = " C:6 H:14 O:2 ", thermo = ( NASA( [ 300.00, 1389.00], [-1.208940770E-001, 8.741895340E-002, -6.086328280E-005, 2.225962830E-008, -3.406423190E-012, -3.448647170E+004, 3.296797570E+001] ), NASA( [ 1389.00, 5000.00], [ 2.474612060E+001, 3.056906590E-002, -1.059535460E-005, 1.659607570E-009, -9.688167600E-014, -4.334149910E+004, -1.011834350E+002] ) ), note = "7/19/ 0" ) species(name = "bc6h13o2h", atoms = " C:6 H:14 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [-3.847452990E-001, 9.176870450E-002, -6.840947170E-005, 2.711471580E-008, -4.486815700E-012, -3.756317930E+004, 3.078159190E+001] ), NASA( [ 1390.00, 5000.00], [ 2.547963830E+001, 2.996199170E-002, -1.038925630E-005, 1.627764660E-009, -9.504026440E-014, -4.651828160E+004, -1.078221330E+002] ) ), note = "7/19/ 0 therm" ) species(name = "cc6h13o2h", atoms = " C:6 H:14 O:2 ", thermo = ( NASA( [ 300.00, 1391.00], [-1.145026920E+000, 9.380361450E-002, -7.020308250E-005, 2.771753760E-008, -4.542823880E-012, -3.674291440E+004, 3.624699450E+001] ), NASA( [ 1391.00, 5000.00], [ 2.555872440E+001, 2.988202020E-002, -1.035932810E-005, 1.622888970E-009, -9.474938180E-014, -4.594539150E+004, -1.067617560E+002] ) ), note = "7/19/ 0 therm" ) species(name = "dc6h13o2h", atoms = " C:6 H:14 O:2 ", thermo = ( NASA( [ 300.00, 1391.00], [-1.145026920E+000, 9.380361450E-002, -7.020308250E-005, 2.771753760E-008, -4.542823880E-012, -3.674291440E+004, 3.624699450E+001] ), NASA( [ 1391.00, 5000.00], [ 2.555872440E+001, 2.988202020E-002, -1.035932810E-005, 1.622888970E-009, -9.474938180E-014, -4.594539150E+004, -1.067617560E+002] ) ), note = "7/19/ 0 therm" ) species(name = "ec6h13o2h", atoms = " C:6 H:14 O:2 ", thermo = ( NASA( [ 300.00, 1389.00], [-1.208940770E-001, 8.741895340E-002, -6.086328280E-005, 2.225962830E-008, -3.406423190E-012, -3.448647170E+004, 3.227849400E+001] ), NASA( [ 1389.00, 5000.00], [ 2.474612060E+001, 3.056906590E-002, -1.059535460E-005, 1.659607570E-009, -9.688167600E-014, -4.334149910E+004, -1.018729170E+002] ) ), note = "7/19/ 0 therm" ) species(name = "ac6h13o", atoms = " C:6 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.999237740E+000, 8.060247390E-002, -5.489081240E-005, 1.950451920E-008, -2.867213340E-012, -1.572439530E+004, 4.087033790E+001] ), NASA( [ 1393.00, 5000.00], [ 2.042532480E+001, 2.931932810E-002, -1.001590810E-005, 1.553749070E-009, -9.009549690E-014, -2.365418080E+004, -8.000748420E+001] ) ), note = "1/16/95 therm" ) species(name = "bc6h13o", atoms = " C:6 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1394.00], [-2.040747030E+000, 8.405332650E-002, -6.128881880E-005, 2.378038630E-008, -3.844395430E-012, -1.923910620E+004, 3.809700320E+001] ), NASA( [ 1394.00, 5000.00], [ 2.104943920E+001, 2.889245100E-002, -9.890050540E-006, 1.536218440E-009, -8.915678010E-014, -2.719648210E+004, -8.557967090E+001] ) ), note = "1/16/95 therm" ) species(name = "cc6h13o", atoms = " C:6 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1396.00], [-2.219835430E+000, 8.375170830E-002, -6.025796940E-005, 2.298320160E-008, -3.649125480E-012, -1.795698010E+004, 3.970664350E+001] ), NASA( [ 1396.00, 5000.00], [ 2.081883700E+001, 2.916695610E-002, -1.000101420E-005, 1.555145330E-009, -9.032105900E-014, -2.593494890E+004, -8.384225630E+001] ) ), note = "1/16/95 therm" ) species(name = "dc6h13o", atoms = " C:6 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1396.00], [-2.219835430E+000, 8.375170830E-002, -6.025796940E-005, 2.298320160E-008, -3.649125480E-012, -1.795698010E+004, 3.970664350E+001] ), NASA( [ 1396.00, 5000.00], [ 2.081883700E+001, 2.916695610E-002, -1.000101420E-005, 1.555145330E-009, -9.032105900E-014, -2.593494890E+004, -8.384225630E+001] ) ), note = "1/16/95 therm" ) species(name = "ec6h13o", atoms = " C:6 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.999237740E+000, 8.060247390E-002, -5.489081240E-005, 1.950451920E-008, -2.867213340E-012, -1.572439530E+004, 4.018085620E+001] ), NASA( [ 1393.00, 5000.00], [ 2.042532480E+001, 2.931932810E-002, -1.001590810E-005, 1.553749070E-009, -9.009549690E-014, -2.365418080E+004, -8.069696590E+001] ) ), note = "1/16/95 therm" ) species(name = "ac6h12ooh-a", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1391.00], [ 6.025746750E-001, 8.326733330E-002, -5.936837530E-005, 2.247822470E-008, -3.567753090E-012, -9.870918580E+003, 3.132922980E+001] ), NASA( [ 1391.00, 5000.00], [ 2.382464340E+001, 2.904505980E-002, -1.002774480E-005, 1.566535910E-009, -9.127807500E-014, -1.803012960E+004, -9.355096130E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "ac6h12ooh-b", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1383.00], [ 3.800802510E+000, 6.626437950E-002, -3.490497430E-005, 8.197777020E-009, -5.891573990E-013, -1.257310750E+004, 1.853301050E+001] ), NASA( [ 1383.00, 5000.00], [ 2.227303420E+001, 3.038703490E-002, -1.049555910E-005, 1.640032750E-009, -9.557559220E-014, -1.983387590E+004, -8.345294120E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "ac6h12ooh-c", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1385.00], [ 6.190779760E-001, 7.992147190E-002, -5.239214990E-005, 1.716605360E-008, -2.229742690E-012, -1.111256320E+004, 3.288797260E+001] ), NASA( [ 1385.00, 5000.00], [ 2.396789010E+001, 2.812149500E-002, -9.545240620E-006, 1.475191320E-009, -8.534293550E-014, -1.946474800E+004, -9.343376120E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "ac6h12ooh-d", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1385.00], [ 6.190779760E-001, 7.992147190E-002, -5.239214990E-005, 1.716605360E-008, -2.229742690E-012, -1.111256320E+004, 3.288797260E+001] ), NASA( [ 1385.00, 5000.00], [ 2.396789010E+001, 2.812149500E-002, -9.545240620E-006, 1.475191320E-009, -8.534293550E-014, -1.946474800E+004, -9.343376120E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "ac6h12ooh-e", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1391.00], [ 6.025746750E-001, 8.326733330E-002, -5.936837530E-005, 2.247822470E-008, -3.567753090E-012, -9.870918580E+003, 3.132922980E+001] ), NASA( [ 1391.00, 5000.00], [ 2.382464340E+001, 2.904505980E-002, -1.002774480E-005, 1.566535910E-009, -9.127807500E-014, -1.803012960E+004, -9.355096130E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "bc6h12ooh-a", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [ 3.299720450E-001, 8.744154780E-002, -6.624169530E-005, 2.665363360E-008, -4.465477960E-012, -1.294190280E+004, 2.962843090E+001] ), NASA( [ 1390.00, 5000.00], [ 2.507248220E+001, 2.779971560E-002, -9.652217570E-006, 1.513637920E-009, -8.843220220E-014, -2.145668930E+004, -1.027801000E+002] ) ), note = "7/19/ 0 thrm" ) species(name = "bc6h12ooh-c", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1388.00], [ 7.284678400E-001, 8.273510380E-002, -5.794773320E-005, 2.104026800E-008, -3.154643710E-012, -1.424799890E+004, 2.936053780E+001] ), NASA( [ 1388.00, 5000.00], [ 2.463645120E+001, 2.785163740E-002, -9.602127760E-006, 1.498932370E-009, -8.730344390E-014, -2.268542950E+004, -9.944827960E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "bc6h12ooh-d", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1388.00], [ 7.284678400E-001, 8.273510380E-002, -5.794773320E-005, 2.104026800E-008, -3.154643710E-012, -1.424799890E+004, 2.936053780E+001] ), NASA( [ 1388.00, 5000.00], [ 2.463645120E+001, 2.785163740E-002, -9.602127760E-006, 1.498932370E-009, -8.730344390E-014, -2.268542950E+004, -9.944827960E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "bc6h12ooh-e", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [ 3.299720450E-001, 8.744154780E-002, -6.624169530E-005, 2.665363360E-008, -4.465477960E-012, -1.294190280E+004, 2.962843090E+001] ), NASA( [ 1390.00, 5000.00], [ 2.507248220E+001, 2.779971560E-002, -9.652217570E-006, 1.513637920E-009, -8.843220220E-014, -2.145668930E+004, -1.027801000E+002] ) ), note = "7/19/ 0 thrm" ) species(name = "cc6h12ooh-a", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1393.00], [-3.872429890E-001, 8.947694530E-002, -6.840123170E-005, 2.772727520E-008, -4.655477610E-012, -1.213213410E+004, 3.486068160E+001] ), NASA( [ 1393.00, 5000.00], [ 2.464798320E+001, 2.835233400E-002, -9.790548930E-006, 1.529719330E-009, -8.914356950E-014, -2.064022630E+004, -9.878769730E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "cc6h12ooh-b", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1387.00], [ 3.035368990E+000, 7.175976700E-002, -4.276232520E-005, 1.261729830E-008, -1.474868710E-012, -1.487831970E+004, 1.985147600E+001] ), NASA( [ 1387.00, 5000.00], [ 2.325059240E+001, 2.954131710E-002, -1.020092620E-005, 1.593781810E-009, -9.287331840E-014, -2.248799880E+004, -9.064101490E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "cc6h12ooh-d", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1391.00], [ 1.413336600E-001, 8.423816120E-002, -5.959868190E-005, 2.182732250E-008, -3.276021210E-012, -1.345731230E+004, 3.358249900E+001] ), NASA( [ 1391.00, 5000.00], [ 2.420943450E+001, 2.816489270E-002, -9.607709300E-006, 1.489316250E-009, -8.632485800E-014, -2.182432310E+004, -9.572178430E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "cc6h12ooh-e", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1393.00], [-3.872429890E-001, 8.947694530E-002, -6.840123170E-005, 2.772727520E-008, -4.655477610E-012, -1.213213410E+004, 3.445303190E+001] ), NASA( [ 1393.00, 5000.00], [ 2.464798320E+001, 2.835233400E-002, -9.790548930E-006, 1.529719330E-009, -8.914356950E-014, -2.064022630E+004, -9.919534700E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "dc6h12ooh-a", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1393.00], [-3.872429890E-001, 8.947694530E-002, -6.840123170E-005, 2.772727520E-008, -4.655477610E-012, -1.213213410E+004, 3.486068160E+001] ), NASA( [ 1393.00, 5000.00], [ 2.464798320E+001, 2.835233400E-002, -9.790548930E-006, 1.529719330E-009, -8.914356950E-014, -2.064022630E+004, -9.878769730E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "dc6h12ooh-b", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1387.00], [ 3.035368990E+000, 7.175976700E-002, -4.276232520E-005, 1.261729830E-008, -1.474868710E-012, -1.487831970E+004, 1.985147600E+001] ), NASA( [ 1387.00, 5000.00], [ 2.325059240E+001, 2.954131710E-002, -1.020092620E-005, 1.593781810E-009, -9.287331840E-014, -2.248799880E+004, -9.064101490E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "dc6h12ooh-c", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1391.00], [ 1.413336600E-001, 8.423816120E-002, -5.959868190E-005, 2.182732250E-008, -3.276021210E-012, -1.345731230E+004, 3.358249900E+001] ), NASA( [ 1391.00, 5000.00], [ 2.420943450E+001, 2.816489270E-002, -9.607709300E-006, 1.489316250E-009, -8.632485800E-014, -2.182432310E+004, -9.572178430E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "dc6h12ooh-e", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1393.00], [-3.872429890E-001, 8.947694530E-002, -6.840123170E-005, 2.772727520E-008, -4.655477610E-012, -1.213213410E+004, 3.445303190E+001] ), NASA( [ 1393.00, 5000.00], [ 2.464798320E+001, 2.835233400E-002, -9.790548930E-006, 1.529719330E-009, -8.914356950E-014, -2.064022630E+004, -9.919534700E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "ec6h12ooh-a", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1391.00], [ 6.025746750E-001, 8.326733330E-002, -5.936837530E-005, 2.247822470E-008, -3.567753090E-012, -9.870918580E+003, 3.104739790E+001] ), NASA( [ 1391.00, 5000.00], [ 2.382464340E+001, 2.904505980E-002, -1.002774480E-005, 1.566535910E-009, -9.127807500E-014, -1.803012960E+004, -9.383279320E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "ec6h12ooh-b", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1383.00], [ 3.800802510E+000, 6.626437950E-002, -3.490497430E-005, 8.197777020E-009, -5.891573990E-013, -1.257310750E+004, 1.605188310E+001] ), NASA( [ 1383.00, 5000.00], [ 2.227303420E+001, 3.038703490E-002, -1.049555910E-005, 1.640032750E-009, -9.557559220E-014, -1.983387590E+004, -8.593406860E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "ec6h12ooh-c", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1385.00], [ 6.190779760E-001, 7.992147190E-002, -5.239214990E-005, 1.716605360E-008, -2.229742690E-012, -1.111256320E+004, 3.110135960E+001] ), NASA( [ 1385.00, 5000.00], [ 2.396789010E+001, 2.812149500E-002, -9.545240620E-006, 1.475191320E-009, -8.534293550E-014, -1.946474800E+004, -9.522037420E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "ec6h12ooh-d", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1385.00], [ 6.190779760E-001, 7.992147190E-002, -5.239214990E-005, 1.716605360E-008, -2.229742690E-012, -1.111256320E+004, 3.110135960E+001] ), NASA( [ 1385.00, 5000.00], [ 2.396789010E+001, 2.812149500E-002, -9.545240620E-006, 1.475191320E-009, -8.534293550E-014, -1.946474800E+004, -9.522037420E+001] ) ), note = "7/19/ 0 thrm" ) species(name = "a-ac6h12o", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1377.00], [-3.742797440E+000, 7.973170220E-002, -5.205681390E-005, 1.720114900E-008, -2.314542150E-012, -1.981166010E+004, 4.523012690E+001] ), NASA( [ 1377.00, 5000.00], [ 1.991562550E+001, 2.805706450E-002, -9.600260240E-006, 1.492373530E-009, -8.670759470E-014, -2.843576640E+004, -8.319126880E+001] ) ), note = "1/22/95 therm" ) species(name = "a-bc6h12o", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1389.00], [-3.104406280E+000, 8.565195360E-002, -6.674887310E-005, 2.817940430E-008, -4.970559010E-012, -2.315023500E+004, 4.057519200E+001] ), NASA( [ 1389.00, 5000.00], [ 2.019134000E+001, 2.796785110E-002, -9.674215250E-006, 1.513195970E-009, -8.824565590E-014, -3.107963420E+004, -8.365824320E+001] ) ), note = "1/22/95 therm" ) species(name = "a-cc6h12o", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1380.00], [-4.390455100E+000, 8.466570040E-002, -5.984616800E-005, 2.197492060E-008, -3.341629030E-012, -2.197728790E+004, 4.812763440E+001] ), NASA( [ 1380.00, 5000.00], [ 2.050311090E+001, 2.753830430E-002, -9.416672710E-006, 1.463212800E-009, -8.498862310E-014, -3.077332810E+004, -8.601599130E+001] ) ), note = "1/22/95 therm" ) species(name = "a-dc6h12o", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1387.00], [-5.610842400E+000, 8.622621930E-002, -6.173114530E-005, 2.380787030E-008, -3.895556310E-012, -3.190603400E+004, 5.448804670E+001] ), NASA( [ 1387.00, 5000.00], [ 1.830583030E+001, 3.049723780E-002, -1.056537660E-005, 1.654343260E-009, -9.655008910E-014, -4.038483610E+004, -7.427719020E+001] ) ), note = "1/22/95 therm" ) species(name = "a-ec6h12o", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1367.00], [-5.112885910E+000, 8.042606230E-002, -4.358392930E-005, 9.209180580E-009, -2.778756840E-013, -3.282067880E+004, 4.725005480E+001] ), NASA( [ 1367.00, 5000.00], [ 2.151755400E+001, 2.917061210E-002, -1.033535280E-005, 1.643058350E-009, -9.691805130E-014, -4.321292190E+004, -9.974652940E+001] ) ), note = "1/22/95 therm" ) species(name = "b-cc6h12o", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [-3.516009900E+000, 8.950130990E-002, -7.289320290E-005, 3.194665180E-008, -5.779806290E-012, -2.535068070E+004, 4.101256010E+001] ), NASA( [ 1391.00, 5000.00], [ 2.074127610E+001, 2.752904090E-002, -9.528628580E-006, 1.491034850E-009, -8.697689210E-014, -3.340947020E+004, -8.765953100E+001] ) ), note = "1/22/95 therm" ) species(name = "b-dc6h12o", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1387.00], [-4.250897710E+000, 8.770219140E-002, -6.652641840E-005, 2.710340810E-008, -4.630169870E-012, -2.552661090E+004, 4.445182410E+001] ), NASA( [ 1387.00, 5000.00], [ 2.031301070E+001, 2.849533690E-002, -9.903568790E-006, 1.554074830E-009, -9.083586050E-014, -3.402963350E+004, -8.708603000E+001] ) ), note = "1/22/95 therm" ) species(name = "b-ec6h12o", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1382.00], [-5.340103110E+000, 8.585549740E-002, -6.112099230E-005, 2.311210320E-008, -3.675332880E-012, -3.319734640E+004, 5.111714300E+001] ), NASA( [ 1382.00, 5000.00], [ 1.910744750E+001, 2.925300400E-002, -1.002498280E-005, 1.559440670E-009, -9.062880790E-014, -4.184615000E+004, -8.054643490E+001] ) ), note = "1/22/95 therm" ) species(name = "c-dc6h12o", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1393.00], [-3.972385800E+000, 9.036381570E-002, -7.342836090E-005, 3.196357550E-008, -5.732281710E-012, -2.402532660E+004, 4.460717440E+001] ), NASA( [ 1393.00, 5000.00], [ 2.063125890E+001, 2.755694570E-002, -9.523760400E-006, 1.488766770E-009, -8.678386720E-014, -3.217569610E+004, -8.587178180E+001] ) ), note = "1/22/95 therm" ) species(name = "c-ec6h12o", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1380.00], [-4.390455100E+000, 8.466570040E-002, -5.984616800E-005, 2.197492060E-008, -3.341629030E-012, -2.197728790E+004, 4.743815280E+001] ), NASA( [ 1380.00, 5000.00], [ 2.050311090E+001, 2.753830430E-002, -9.416672710E-006, 1.463212800E-009, -8.498862310E-014, -3.077332810E+004, -8.670547300E+001] ) ), note = "1/22/95 therm" ) species(name = "d-ec6h12o", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [-3.325941880E+000, 8.549214400E-002, -6.584817870E-005, 2.739963700E-008, -4.767021470E-012, -2.186064460E+004, 4.239001390E+001] ), NASA( [ 1391.00, 5000.00], [ 2.001427750E+001, 2.813869210E-002, -9.737359470E-006, 1.523466120E-009, -8.885960910E-014, -2.983389280E+004, -8.221048500E+001] ) ), note = "1/22/95 therm" ) species(name = "ac6h12ooh-ao2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1386.00], [ 1.909942600E+000, 9.225959210E-002, -6.860122210E-005, 2.724075840E-008, -4.546697540E-012, -2.825258740E+004, 2.810705530E+001] ), NASA( [ 1386.00, 5000.00], [ 2.819443550E+001, 3.006158540E-002, -1.048755630E-005, 1.649889330E-009, -9.660663900E-014, -3.746083440E+004, -1.130448050E+002] ) ), note = "7/19/ 0 tm" ) species(name = "ac6h12ooh-bo2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1387.00], [ 1.811571490E+000, 9.585058580E-002, -7.498525020E-005, 3.134874120E-008, -5.456681910E-012, -3.135378030E+004, 2.584311450E+001] ), NASA( [ 1387.00, 5000.00], [ 2.892715590E+001, 2.943095770E-002, -1.026801950E-005, 1.615399320E-009, -9.458899370E-014, -4.063097710E+004, -1.189774820E+002] ) ), note = "7/19/ 0 tm" ) species(name = "ac6h12ooh-co2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 1.239040030E+000, 9.718918470E-002, -7.612952680E-005, 3.170704620E-008, -5.480019530E-012, -3.056381320E+004, 3.110911410E+001] ), NASA( [ 1389.00, 5000.00], [ 2.885063020E+001, 2.945138910E-002, -1.026519370E-005, 1.613929710E-009, -9.446182140E-014, -3.997252350E+004, -1.162768350E+002] ) ), note = "7/19/ 0 tm" ) species(name = "ac6h12ooh-do2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 1.239040030E+000, 9.718918470E-002, -7.612952680E-005, 3.170704620E-008, -5.480019530E-012, -3.056381320E+004, 3.110911410E+001] ), NASA( [ 1389.00, 5000.00], [ 2.885063020E+001, 2.945138910E-002, -1.026519370E-005, 1.613929710E-009, -9.446182140E-014, -3.997252350E+004, -1.162768350E+002] ) ), note = "7/19/ 0 tm" ) species(name = "ac6h12ooh-eo2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1386.00], [ 1.909942600E+000, 9.225959210E-002, -6.860122210E-005, 2.724075840E-008, -4.546697540E-012, -2.825258740E+004, 2.879653700E+001] ), NASA( [ 1386.00, 5000.00], [ 2.819443550E+001, 3.006158540E-002, -1.048755630E-005, 1.649889330E-009, -9.660663900E-014, -3.746083440E+004, -1.123553240E+002] ) ), note = "7/19/ 0 tm" ) species(name = "bc6h12ooh-ao2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1387.00], [ 1.811571490E+000, 9.585058580E-002, -7.498525020E-005, 3.134874120E-008, -5.456681910E-012, -3.135378030E+004, 2.584311450E+001] ), NASA( [ 1387.00, 5000.00], [ 2.892715590E+001, 2.943095770E-002, -1.026801950E-005, 1.615399320E-009, -9.458899370E-014, -4.063097710E+004, -1.189774820E+002] ) ), note = "7/19/ 0 tm" ) species(name = "bc6h12ooh-co2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 1.453684710E+000, 1.002225360E-001, -8.210497590E-005, 3.569798620E-008, -6.383000140E-012, -3.373692800E+004, 2.652640780E+001] ), NASA( [ 1389.00, 5000.00], [ 2.970407490E+001, 2.872849010E-002, -1.001607710E-005, 1.575054770E-009, -9.219818500E-014, -4.315572050E+004, -1.235119330E+002] ) ), note = "7/19/ 0 tm" ) species(name = "bc6h12ooh-do2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 1.453684710E+000, 1.002225360E-001, -8.210497590E-005, 3.569798620E-008, -6.383000140E-012, -3.373692800E+004, 2.652640780E+001] ), NASA( [ 1389.00, 5000.00], [ 2.970407490E+001, 2.872849010E-002, -1.001607710E-005, 1.575054770E-009, -9.219818500E-014, -4.315572050E+004, -1.235119330E+002] ) ), note = "7/19/ 0 tm" ) species(name = "bc6h12ooh-eo2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1387.00], [ 1.811571490E+000, 9.585058580E-002, -7.498525020E-005, 3.134874120E-008, -5.456681910E-012, -3.135378030E+004, 2.584311450E+001] ), NASA( [ 1387.00, 5000.00], [ 2.892715590E+001, 2.943095770E-002, -1.026801950E-005, 1.615399320E-009, -9.458899370E-014, -4.063097710E+004, -1.189774820E+002] ) ), note = "7/19/ 0 tm" ) species(name = "cc6h12ooh-ao2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 1.239040030E+000, 9.718918470E-002, -7.612952680E-005, 3.170704620E-008, -5.480019530E-012, -3.056381320E+004, 3.110911410E+001] ), NASA( [ 1389.00, 5000.00], [ 2.885063020E+001, 2.945138910E-002, -1.026519370E-005, 1.613929710E-009, -9.446182140E-014, -3.997252350E+004, -1.162768350E+002] ) ), note = "7/19/ 0 tm" ) species(name = "cc6h12ooh-bo2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 1.453684710E+000, 1.002225360E-001, -8.210497590E-005, 3.569798620E-008, -6.383000140E-012, -3.373692800E+004, 2.652640780E+001] ), NASA( [ 1389.00, 5000.00], [ 2.970407490E+001, 2.872849010E-002, -1.001607710E-005, 1.575054770E-009, -9.219818500E-014, -4.315572050E+004, -1.235119330E+002] ) ), note = "7/19/ 0 tm" ) species(name = "cc6h12ooh-do2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1391.00], [ 6.885889520E-001, 1.015959550E-001, -8.286298610E-005, 3.567402900E-008, -6.302436530E-012, -3.289380190E+004, 3.217570150E+001] ), NASA( [ 1391.00, 5000.00], [ 2.951693250E+001, 2.883208970E-002, -1.003963400E-005, 1.577469760E-009, -9.228796510E-014, -4.248763930E+004, -1.209381300E+002] ) ), note = "7/19/ 0 tm" ) species(name = "cc6h12ooh-eo2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 1.239040030E+000, 9.718918470E-002, -7.612952680E-005, 3.170704620E-008, -5.480019530E-012, -3.056381320E+004, 3.041963250E+001] ), NASA( [ 1389.00, 5000.00], [ 2.885063020E+001, 2.945138910E-002, -1.026519370E-005, 1.613929710E-009, -9.446182140E-014, -3.997252350E+004, -1.169663170E+002] ) ), note = "7/19/ 0 tm" ) species(name = "dc6h12ooh-ao2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 1.239040030E+000, 9.718918470E-002, -7.612952680E-005, 3.170704620E-008, -5.480019530E-012, -3.056381320E+004, 3.110911410E+001] ), NASA( [ 1389.00, 5000.00], [ 2.885063020E+001, 2.945138910E-002, -1.026519370E-005, 1.613929710E-009, -9.446182140E-014, -3.997252350E+004, -1.162768350E+002] ) ), note = "7/19/ 0 tm" ) species(name = "dc6h12ooh-bo2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 1.453684710E+000, 1.002225360E-001, -8.210497590E-005, 3.569798620E-008, -6.383000140E-012, -3.373692800E+004, 2.652640780E+001] ), NASA( [ 1389.00, 5000.00], [ 2.970407490E+001, 2.872849010E-002, -1.001607710E-005, 1.575054770E-009, -9.219818500E-014, -4.315572050E+004, -1.235119330E+002] ) ), note = "7/19/ 0 tm" ) species(name = "dc6h12ooh-co2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1391.00], [ 6.885889520E-001, 1.015959550E-001, -8.286298610E-005, 3.567402900E-008, -6.302436530E-012, -3.289380190E+004, 3.217570150E+001] ), NASA( [ 1391.00, 5000.00], [ 2.951693250E+001, 2.883208970E-002, -1.003963400E-005, 1.577469760E-009, -9.228796510E-014, -4.248763930E+004, -1.209381300E+002] ) ), note = "7/19/ 0 tm" ) species(name = "dc6h12ooh-eo2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 1.239040030E+000, 9.718918470E-002, -7.612952680E-005, 3.170704620E-008, -5.480019530E-012, -3.056381320E+004, 3.041963250E+001] ), NASA( [ 1389.00, 5000.00], [ 2.885063020E+001, 2.945138910E-002, -1.026519370E-005, 1.613929710E-009, -9.446182140E-014, -3.997252350E+004, -1.169663170E+002] ) ), note = "7/19/ 0 tm" ) species(name = "ec6h12ooh-ao2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1386.00], [ 1.909942600E+000, 9.225959210E-002, -6.860122210E-005, 2.724075840E-008, -4.546697540E-012, -2.825258740E+004, 2.879653700E+001] ), NASA( [ 1386.00, 5000.00], [ 2.819443550E+001, 3.006158540E-002, -1.048755630E-005, 1.649889330E-009, -9.660663900E-014, -3.746083440E+004, -1.123553240E+002] ) ), note = "7/19/ 0 tm" ) species(name = "ec6h12ooh-bo2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1387.00], [ 1.811571490E+000, 9.585058580E-002, -7.498525020E-005, 3.134874120E-008, -5.456681910E-012, -3.135378030E+004, 2.584311450E+001] ), NASA( [ 1387.00, 5000.00], [ 2.892715590E+001, 2.943095770E-002, -1.026801950E-005, 1.615399320E-009, -9.458899370E-014, -4.063097710E+004, -1.189774820E+002] ) ), note = "7/19/ 0 tm" ) species(name = "ec6h12ooh-co2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 1.239040030E+000, 9.718918470E-002, -7.612952680E-005, 3.170704620E-008, -5.480019530E-012, -3.056381320E+004, 3.041963250E+001] ), NASA( [ 1389.00, 5000.00], [ 2.885063020E+001, 2.945138910E-002, -1.026519370E-005, 1.613929710E-009, -9.446182140E-014, -3.997252350E+004, -1.169663170E+002] ) ), note = "7/19/ 0 tm" ) species(name = "ec6h12ooh-do2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 1.239040030E+000, 9.718918470E-002, -7.612952680E-005, 3.170704620E-008, -5.480019530E-012, -3.056381320E+004, 3.041963250E+001] ), NASA( [ 1389.00, 5000.00], [ 2.885063020E+001, 2.945138910E-002, -1.026519370E-005, 1.613929710E-009, -9.446182140E-014, -3.997252350E+004, -1.169663170E+002] ) ), note = "7/19/ 0 tm" ) species(name = "ic6ketaa", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1389.00], [ 3.749265990E-001, 8.696542510E-002, -6.375997540E-005, 2.436249040E-008, -3.855956590E-012, -4.400366690E+004, 3.393733000E+001] ), NASA( [ 1389.00, 5000.00], [ 2.584888520E+001, 2.729767290E-002, -9.515696140E-006, 1.496292150E-009, -8.758723760E-014, -5.290104820E+004, -1.029305980E+002] ) ), note = "7/19/ 0 therm" ) species(name = "ic6ketab", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1389.00], [ 8.361042380E-001, 8.712229040E-002, -6.285378550E-005, 2.299968630E-008, -3.418611340E-012, -4.673544040E+004, 2.896913440E+001] ), NASA( [ 1389.00, 5000.00], [ 2.723663760E+001, 2.616658280E-002, -9.137607980E-006, 1.438658380E-009, -8.429133770E-014, -5.597137770E+004, -1.130673580E+002] ) ), note = "7/19/ 0 therm" ) species(name = "ic6ketac", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1391.00], [ 5.927467920E-003, 9.035220360E-002, -6.842527070E-005, 2.681354080E-008, -4.310536770E-012, -4.635787000E+004, 3.487937970E+001] ), NASA( [ 1391.00, 5000.00], [ 2.669651760E+001, 2.654607310E-002, -9.249847600E-006, 1.454143980E-009, -8.510785530E-014, -5.551042110E+004, -1.079993920E+002] ) ), note = "7/19/ 0 therm" ) species(name = "ic6ketad", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1391.00], [ 5.927467920E-003, 9.035220360E-002, -6.842527070E-005, 2.681354080E-008, -4.310536770E-012, -4.635787000E+004, 3.487937970E+001] ), NASA( [ 1391.00, 5000.00], [ 2.669651760E+001, 2.654607310E-002, -9.249847600E-006, 1.454143980E-009, -8.510785530E-014, -5.551042110E+004, -1.079993920E+002] ) ), note = "7/19/ 0 therm" ) species(name = "ic6ketae", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1389.00], [ 3.749265990E-001, 8.696542510E-002, -6.375997540E-005, 2.436249040E-008, -3.855956590E-012, -4.400366690E+004, 3.393733000E+001] ), NASA( [ 1389.00, 5000.00], [ 2.584888520E+001, 2.729767290E-002, -9.515696140E-006, 1.496292150E-009, -8.758723760E-014, -5.290104820E+004, -1.029305980E+002] ) ), note = "7/19/ 0 therm" ) species(name = "ic6ketca", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1386.00], [ 6.415699380E-001, 8.613066220E-002, -6.380403710E-005, 2.507159800E-008, -4.127312760E-012, -4.799259460E+004, 3.220524140E+001] ), NASA( [ 1386.00, 5000.00], [ 2.541588930E+001, 2.771429610E-002, -9.669831060E-006, 1.521404300E-009, -8.909097450E-014, -5.666955290E+004, -1.008719750E+002] ) ), note = "7/19/ 0 therm" ) species(name = "ic6ketcb", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1387.00], [ 8.686981840E-001, 8.735536120E-002, -6.447541970E-005, 2.468107180E-008, -3.903905580E-012, -5.068993080E+004, 2.762969210E+001] ), NASA( [ 1387.00, 5000.00], [ 2.682987180E+001, 2.657439880E-002, -9.291665120E-006, 1.464065020E-009, -8.582457470E-014, -5.975434880E+004, -1.118568080E+002] ) ), note = "7/19/ 0 therm" ) species(name = "ic6ketcd", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1391.00], [-2.054818200E+000, 9.793062620E-002, -7.866427750E-005, 3.285122530E-008, -5.608142140E-012, -4.942339860E+004, 4.390489040E+001] ), NASA( [ 1391.00, 5000.00], [ 2.667926690E+001, 2.667825640E-002, -9.321970060E-006, 1.468205230E-009, -8.604130110E-014, -5.904852160E+004, -1.090519590E+002] ) ), note = "7/19/ 0 therm" ) species(name = "ic6ketce", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1386.00], [ 6.415699380E-001, 8.613066220E-002, -6.380403710E-005, 2.507159800E-008, -4.127312760E-012, -4.799259460E+004, 3.151575970E+001] ), NASA( [ 1386.00, 5000.00], [ 2.541588930E+001, 2.771429610E-002, -9.669831060E-006, 1.521404300E-009, -8.909097450E-014, -5.666955290E+004, -1.015614560E+002] ) ), note = "7/19/ 0 therm" ) species(name = "ic6ketda", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1384.00], [ 1.835146490E+000, 8.094024730E-002, -5.647663920E-005, 2.076508130E-008, -3.219288030E-012, -4.821467870E+004, 2.647660890E+001] ), NASA( [ 1384.00, 5000.00], [ 2.524974890E+001, 2.786200640E-002, -9.722314860E-006, 1.529761570E-009, -8.958443200E-014, -5.663604670E+004, -1.000657470E+002] ) ), note = "7/19/ 0 therm" ) species(name = "ic6ketdb", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1386.00], [ 1.726263210E+000, 8.460944920E-002, -6.301452150E-005, 2.499607360E-008, -4.161968170E-012, -5.131508180E+004, 2.357061160E+001] ), NASA( [ 1386.00, 5000.00], [ 2.597771180E+001, 2.725381890E-002, -9.514587110E-006, 1.497538120E-009, -8.771586510E-014, -5.980777390E+004, -1.066641150E+002] ) ), note = "7/19/ 0 therm" ) species(name = "ic6ketdc", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1389.00], [-6.117451990E-001, 9.176815000E-002, -7.013461140E-005, 2.790143540E-008, -4.572539180E-012, -4.968607590E+004, 3.699654200E+001] ), NASA( [ 1389.00, 5000.00], [ 2.643036790E+001, 2.688272530E-002, -9.390798430E-006, 1.478757690E-009, -8.664756060E-014, -5.896661700E+004, -1.077323690E+002] ) ), note = "7/19/ 0 therm" ) species(name = "ic6ketde", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1382.00], [ 3.609126670E+000, 7.541783440E-002, -5.049918220E-005, 1.802696910E-008, -2.766591200E-012, -4.867156770E+004, 1.776324450E+001] ), NASA( [ 1382.00, 5000.00], [ 2.508889830E+001, 2.803998550E-002, -9.792374700E-006, 1.541559540E-009, -9.030495610E-014, -5.659244480E+004, -9.889656650E+001] ) ), note = "7/19/ 0 therm" ) species(name = "ic6ketea", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1386.00], [ 2.251077690E+000, 8.106800800E-002, -5.758893880E-005, 2.162857280E-008, -3.417567000E-012, -4.458678190E+004, 2.465947560E+001] ), NASA( [ 1386.00, 5000.00], [ 2.553580960E+001, 2.752412210E-002, -9.584188430E-006, 1.505909250E-009, -8.810145400E-014, -5.287636810E+004, -1.008957940E+002] ) ), note = "7/19/ 0 therm" ) species(name = "ic6keteb", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1387.00], [ 2.212246860E+000, 8.440980880E-002, -6.364575740E-005, 2.557335360E-008, -4.299783270E-012, -4.769723230E+004, 2.142795710E+001] ), NASA( [ 1387.00, 5000.00], [ 2.624915760E+001, 2.693783500E-002, -9.386077640E-006, 1.475398730E-009, -8.634109920E-014, -5.604448520E+004, -1.074196720E+002] ) ), note = "7/19/ 0 therm" ) species(name = "ic6ketec", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1388.00], [ 1.707076790E+000, 8.545446310E-002, -6.445123310E-005, 2.577803240E-008, -4.298691920E-012, -4.691698540E+004, 2.569456700E+001] ), NASA( [ 1388.00, 5000.00], [ 2.611797570E+001, 2.701679010E-002, -9.406012280E-006, 1.477741110E-009, -8.644609470E-014, -5.536431350E+004, -1.050939350E+002] ) ), note = "7/19/ 0 therm" ) species(name = "ic6keted", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1370.00], [ 3.945096670E+000, 7.372233220E-002, -4.235037360E-005, 1.062974960E-008, -8.233534280E-013, -4.630373980E+004, 2.628536610E+001] ), NASA( [ 1370.00, 5000.00], [ 2.793334260E+001, 2.621763230E-002, -9.302771790E-006, 1.480226340E-009, -8.736358700E-014, -5.556505830E+004, -1.057093670E+002] ) ), note = "7/19/ 0 therm" ) species(name = "nc4h9cho-2", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [-4.694768210E-001, 6.103655820E-002, -3.931852640E-005, 1.278714270E-008, -1.673125870E-012, -3.049862810E+004, 3.163060950E+001] ), NASA( [ 1391.00, 5000.00], [ 1.692440290E+001, 2.279674870E-002, -7.824571470E-006, 1.217689530E-009, -7.076671590E-014, -3.679381000E+004, -6.265968280E+001] ) ), note = "2/22/96 therm" ) species(name = "nc4h9co-2", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [ 3.096794390E-001, 5.621692000E-002, -3.624055880E-005, 1.170867490E-008, -1.509461270E-012, -1.197114570E+004, 2.906432920E+001] ), NASA( [ 1391.00, 5000.00], [ 1.650461330E+001, 2.067172300E-002, -7.106068690E-006, 1.107034340E-009, -6.438375680E-014, -1.783070590E+004, -5.873487990E+001] ) ), note = "2/22/96 therm" ) species(name = "c4h8cho1-2", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [ 3.469354800E-001, 5.628697080E-002, -3.657904640E-005, 1.201915480E-008, -1.593307930E-012, -5.893368300E+003, 3.000116490E+001] ), NASA( [ 1391.00, 5000.00], [ 1.647444830E+001, 2.071383280E-002, -7.123907880E-006, 1.110137470E-009, -6.457649790E-014, -1.171922130E+004, -5.738394350E+001] ) ), note = "2/22/96 therm" ) species(name = "c4h8cho2-2", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1386.00], [ 1.915884040E+000, 5.235277440E-002, -3.272629470E-005, 1.042772360E-008, -1.365325770E-012, -1.190425430E+004, 1.949549480E+001] ), NASA( [ 1386.00, 5000.00], [ 1.667510770E+001, 2.065499420E-002, -7.127548110E-006, 1.113138030E-009, -6.484770260E-014, -1.737084340E+004, -6.086283380E+001] ) ), note = "2/22/96 therm" ) species(name = "c4h8cho3-2", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 2025.00], [ 2.342611410E-001, 5.395560250E-002, -3.192596490E-005, 8.725078920E-009, -8.354749160E-013, -7.124779020E+003, 3.167236230E+001] ), NASA( [ 2025.00, 5000.00], [ 1.462592010E+001, 2.240573280E-002, -7.819176080E-006, 1.237079040E-009, -7.289979230E-014, -1.202182260E+004, -4.591347890E+001] ) ), note = "2/22/96 therm" ) species(name = "c4h8cho4-2", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [ 3.469354800E-001, 5.628697080E-002, -3.657904640E-005, 1.201915480E-008, -1.593307930E-012, -5.893368300E+003, 3.000116490E+001] ), NASA( [ 1391.00, 5000.00], [ 1.647444830E+001, 2.071383280E-002, -7.123907880E-006, 1.110137470E-009, -6.457649790E-014, -1.171922130E+004, -5.738394350E+001] ) ), note = "2/22/96 therm" ) species(name = "ic4h9cho", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1383.00], [ 8.610331630E-001, 5.734416830E-002, -3.591786440E-005, 1.139518930E-008, -1.462057060E-012, -3.099513540E+004, 2.422641510E+001] ), NASA( [ 1383.00, 5000.00], [ 1.701940590E+001, 2.235415460E-002, -7.597608950E-006, 1.174967540E-009, -6.799751640E-014, -3.691433020E+004, -6.358715750E+001] ) ), note = "2/22/96 therm" ) species(name = "ic4h9co", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1381.00], [ 1.623350660E+000, 5.256054070E-002, -3.281030150E-005, 1.023408930E-008, -1.268667430E-012, -1.246434540E+004, 2.174469460E+001] ), NASA( [ 1381.00, 5000.00], [ 1.669124510E+001, 2.007501580E-002, -6.811464310E-006, 1.052427070E-009, -6.087431840E-014, -1.798503120E+004, -6.017155260E+001] ) ), note = "2/22/96 therm" ) species(name = "ic3h6ch2cho", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1379.00], [ 1.622262720E+000, 5.273635840E-002, -3.316562800E-005, 1.043847870E-008, -1.307869350E-012, -6.379499350E+003, 2.287006190E+001] ), NASA( [ 1379.00, 5000.00], [ 1.683085240E+001, 1.982513710E-002, -6.700631330E-006, 1.032891450E-009, -5.965631300E-014, -1.193479380E+004, -5.976029000E+001] ) ), note = "2/22/96 thrm" ) species(name = "tc3h6ch2cho", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 2007.00], [ 4.514562210E+000, 3.778701940E-002, -1.295189750E-005, -4.000556440E-010, 7.379218470E-013, -9.151222610E+003, 1.026780130E+001] ), NASA( [ 2007.00, 5000.00], [ 1.286943050E+001, 2.438772370E-002, -8.600770740E-006, 1.368407370E-009, -8.089201780E-014, -1.249884380E+004, -3.658105980E+001] ) ), note = "2/22/96 thrm" ) species(name = "ic3h7chcho", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [ 3.713296700E-001, 5.763627310E-002, -3.907960920E-005, 1.370275630E-008, -1.983458840E-012, -1.080829750E+004, 2.585787710E+001] ), NASA( [ 1390.00, 5000.00], [ 1.682470160E+001, 2.048256730E-002, -7.058773430E-006, 1.101494290E-009, -6.413485990E-014, -1.668307140E+004, -6.301670840E+001] ) ), note = "2/22/96 therm" ) species(name = "ic5h11cho", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1384.00], [ 5.964481840E-001, 6.970176130E-002, -4.437068620E-005, 1.439950340E-008, -1.901977270E-012, -3.387768220E+004, 2.714034020E+001] ), NASA( [ 1384.00, 5000.00], [ 2.022131980E+001, 2.677053700E-002, -9.103667280E-006, 1.408333190E-009, -8.151896320E-014, -4.101899980E+004, -7.935049310E+001] ) ), note = "2/22/96 therm" ) species(name = "ic5h11co", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1383.00], [ 1.366810670E+000, 6.491505200E-002, -4.132678630E-005, 1.333041720E-008, -1.738282450E-012, -1.534875910E+004, 2.461577670E+001] ), NASA( [ 1383.00, 5000.00], [ 1.981883040E+001, 2.461697670E-002, -8.372690970E-006, 1.295489670E-009, -7.499981100E-014, -2.206232740E+004, -7.552208730E+001] ) ), note = "2/22/96 therm" ) species(name = "ac5h10cho", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1383.00], [ 1.375225070E+000, 6.509852860E-002, -4.180360110E-005, 1.369962410E-008, -1.829850290E-012, -9.266314300E+003, 2.568876720E+001] ), NASA( [ 1383.00, 5000.00], [ 1.981772880E+001, 2.460439870E-002, -8.365547020E-006, 1.294095960E-009, -7.490778910E-014, -1.595975870E+004, -7.432901920E+001] ) ), note = "2/22/96 therm" ) species(name = "bc5h10cho", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1367.00], [ 4.696570630E+000, 4.760493680E-002, -1.660556850E-005, -1.055585240E-009, 1.258021180E-012, -1.208966150E+004, 1.121155160E+001] ), NASA( [ 1367.00, 5000.00], [ 1.829080670E+001, 2.590264070E-002, -8.813524570E-006, 1.364023720E-009, -7.897904370E-014, -1.786634800E+004, -6.545042370E+001] ) ), note = "2/22/96 therm" ) species(name = "cc5h10cho", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1370.00], [ 2.070204700E+000, 5.884239810E-002, -3.072374180E-005, 6.099631920E-009, -4.145886100E-014, -1.061284100E+004, 2.367880160E+001] ), NASA( [ 1370.00, 5000.00], [ 1.977913610E+001, 2.410367980E-002, -8.090507910E-006, 1.241691060E-009, -7.150881570E-014, -1.736553410E+004, -7.368294770E+001] ) ), note = "2/22/96 therm" ) species(name = "dc5h10cho", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [ 1.863735730E-001, 6.965532380E-002, -4.706678330E-005, 1.646074890E-008, -2.377894180E-012, -1.370318710E+004, 2.840043510E+001] ), NASA( [ 1390.00, 5000.00], [ 1.999072350E+001, 2.497611650E-002, -8.601410360E-006, 1.341577280E-009, -7.808726860E-014, -2.078001100E+004, -7.859171230E+001] ) ), note = "2/22/96 therm" ) species(name = "c4h7cho1-4", atoms = " C:5 H:8 O:1 ", thermo = ( NASA( [ 300.00, 1379.00], [ 1.306882610E+000, 5.079118580E-002, -3.315099800E-005, 1.103912950E-008, -1.495783910E-012, -1.455957530E+004, 2.402342190E+001] ), NASA( [ 1379.00, 5000.00], [ 1.592997300E+001, 1.844328870E-002, -6.219973620E-006, 9.575373060E-010, -5.525801260E-014, -1.983110710E+004, -5.517717370E+001] ) ), note = "5/ 6/96 therm" ) species(name = "c4h7co1-4", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1378.00], [ 2.093470050E+000, 4.594840080E-002, -3.006514880E-005, 9.993063350E-009, -1.347098110E-012, 3.966593700E+003, 2.142109590E+001] ), NASA( [ 1378.00, 5000.00], [ 1.546370010E+001, 1.641586850E-002, -5.546724810E-006, 8.550552950E-010, -4.939287500E-014, -8.558586190E+002, -5.100655640E+001] ) ), note = "5/ 6/96 therm" ) species(name = "c4h6cho1-43", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1382.00], [ 1.137284120E+000, 4.856774150E-002, -3.213959140E-005, 1.087148020E-008, -1.516244480E-012, 2.440808240E+003, 2.369174990E+001] ), NASA( [ 1382.00, 5000.00], [ 1.541788550E+001, 1.716725360E-002, -5.952147510E-006, 9.327133680E-010, -5.447052370E-014, -2.759584610E+003, -5.377647720E+001] ) ), note = "5/ 6/96 thrm" ) species(name = "c4h6cho1-44", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [ 7.500378940E-001, 5.148057140E-002, -3.710710560E-005, 1.400095790E-008, -2.190067030E-012, 5.635429790E+003, 2.594884650E+001] ), NASA( [ 1390.00, 5000.00], [ 1.547215950E+001, 1.701648790E-002, -5.875132550E-006, 9.179413590E-010, -5.349453630E-014, 4.991222070E+002, -5.314455050E+001] ) ), note = "5/ 6/96 thrm" ) species(name = "c4h7cho2-1", atoms = " C:5 H:8 O:1 ", thermo = ( NASA( [ 300.00, 1387.00], [ 4.197204490E-001, 5.143381170E-002, -3.241109080E-005, 1.033057380E-008, -1.335363120E-012, -1.518943690E+004, 2.855257610E+001] ), NASA( [ 1387.00, 5000.00], [ 1.502658980E+001, 1.985338320E-002, -6.834131300E-006, 1.065612880E-009, -6.201178220E-014, -2.055627620E+004, -5.086433390E+001] ) ), note = "2/29/96 therm" ) species(name = "c4h7co2-1", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1387.00], [ 1.191833260E+000, 4.664896930E-002, -2.938988420E-005, 9.289373210E-009, -1.180247850E-012, 3.339030760E+003, 2.601826260E+001] ), NASA( [ 1387.00, 5000.00], [ 1.460696360E+001, 1.772785480E-002, -6.115394660E-006, 9.549164110E-010, -5.562627220E-014, -1.593183510E+003, -4.694029800E+001] ) ), note = "2/29/96 therm" ) species(name = "c4h6cho2-11", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1382.00], [ 2.351029100E-001, 4.904809530E-002, -3.062479880E-005, 9.276003760E-009, -1.087438780E-012, 1.817416910E+003, 2.832772220E+001] ), NASA( [ 1382.00, 5000.00], [ 1.507704410E+001, 1.763523200E-002, -6.152835530E-006, 9.681108060E-010, -5.669582650E-014, -3.690274370E+003, -5.258621800E+001] ) ), note = "2/29/96 thrm" ) species(name = "nc5h11cho-2", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [-6.639950240E-001, 7.309550330E-002, -4.734922430E-005, 1.556316500E-008, -2.070025600E-012, -3.339208990E+004, 3.421753400E+001] ), NASA( [ 1391.00, 5000.00], [ 2.009822910E+001, 2.728177900E-002, -9.363878790E-006, 1.457214240E-009, -8.468512640E-014, -4.089388060E+004, -7.827966180E+001] ) ), note = "2/22/96 thrm" ) species(name = "nc5h11co-2", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [ 1.167581240E-001, 6.826934940E-002, -4.426209720E-005, 1.447930010E-008, -1.905219930E-012, -1.486486490E+004, 3.164373630E+001] ), NASA( [ 1391.00, 5000.00], [ 1.967840770E+001, 2.515680480E-002, -8.645402480E-006, 1.346564340E-009, -7.830252960E-014, -2.193074800E+004, -7.435461470E+001] ) ), note = "2/22/96 therm" ) species(name = "c5h10cho1-2", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [ 2.506482710E-001, 6.791732990E-002, -4.401604710E-005, 1.447615710E-008, -1.930019640E-012, -8.801711620E+003, 3.213250340E+001] ), NASA( [ 1391.00, 5000.00], [ 1.960308670E+001, 2.528911230E-002, -8.705361330E-006, 1.357351540E-009, -7.898643030E-014, -1.580876150E+004, -7.276434550E+001] ) ), note = "2/22/96 thrm" ) species(name = "c5h10cho2-2", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1387.00], [ 1.731824660E+000, 6.436636440E-002, -4.070069460E-005, 1.317565250E-008, -1.757202810E-012, -1.479926280E+004, 2.203408790E+001] ), NASA( [ 1387.00, 5000.00], [ 1.984223170E+001, 2.514797480E-002, -8.670061620E-006, 1.353208670E-009, -7.879965240E-014, -2.146831290E+004, -7.644447750E+001] ) ), note = "2/22/96 thrm" ) species(name = "c5h10cho3-2", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1371.00], [ 4.169998420E-001, 6.373542620E-002, -3.536617170E-005, 7.907934280E-009, -2.839915370E-013, -1.006332390E+004, 3.261518740E+001] ), NASA( [ 1371.00, 5000.00], [ 2.012270620E+001, 2.387971020E-002, -8.029295090E-006, 1.233891720E-009, -7.112842760E-014, -1.741617610E+004, -7.522956500E+001] ) ), note = "2/22/96 thrm" ) species(name = "c5h10cho4-2", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1371.00], [ 4.169998420E-001, 6.373542620E-002, -3.536617170E-005, 7.907934280E-009, -2.839915370E-013, -1.006332390E+004, 3.261518740E+001] ), NASA( [ 1371.00, 5000.00], [ 2.012270620E+001, 2.387971020E-002, -8.029295090E-006, 1.233891720E-009, -7.112842760E-014, -1.741617610E+004, -7.522956500E+001] ) ), note = "2/22/96 thrm" ) species(name = "c5h10cho5-2", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [ 2.506482710E-001, 6.791732990E-002, -4.401604710E-005, 1.447615710E-008, -1.930019640E-012, -8.801711620E+003, 3.213250340E+001] ), NASA( [ 1391.00, 5000.00], [ 1.960308670E+001, 2.528911230E-002, -8.705361330E-006, 1.357351540E-009, -7.898643030E-014, -1.580876150E+004, -7.276434550E+001] ) ), note = "2/22/96 thrm" ) species(name = "ic4h9coch3", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1385.00], [ 2.158428290E-001, 6.959905300E-002, -4.361272970E-005, 1.401491970E-008, -1.858715580E-012, -3.751496740E+004, 2.876558900E+001] ), NASA( [ 1385.00, 5000.00], [ 1.967160270E+001, 2.761378710E-002, -9.472810070E-006, 1.473720730E-009, -8.562876650E-014, -4.469685240E+004, -7.708602830E+001] ) ), note = "2/22/96 therm" ) species(name = "ic4h9coch2", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1388.00], [-8.851095550E-003, 7.184850990E-002, -5.136442290E-005, 1.958068690E-008, -3.140880230E-012, -1.620148990E+004, 2.830413020E+001] ), NASA( [ 1388.00, 5000.00], [ 2.005507420E+001, 2.502895340E-002, -8.642955380E-006, 1.350453240E-009, -7.869963810E-014, -2.326929030E+004, -7.962953980E+001] ) ), note = "2/22/96 therm" ) species(name = "ic3h6ch2coch3", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1384.00], [ 9.980480490E-001, 6.496433850E-002, -4.102652480E-005, 1.331004920E-008, -1.785383380E-012, -1.290338200E+004, 2.730306090E+001] ), NASA( [ 1384.00, 5000.00], [ 1.923506850E+001, 2.546918300E-002, -8.740195790E-006, 1.360105580E-009, -7.904309080E-014, -1.961996800E+004, -7.186606400E+001] ) ), note = "2/22/96 tm" ) species(name = "ic3h7chcoch3", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1388.00], [-2.516049810E-001, 6.971411270E-002, -4.635577380E-005, 1.593083500E-008, -2.269175010E-012, -1.732987350E+004, 3.030766410E+001] ), NASA( [ 1388.00, 5000.00], [ 1.965628230E+001, 2.541848780E-002, -8.788938780E-006, 1.374479680E-009, -8.014972930E-014, -2.452708160E+004, -7.749938690E+001] ) ), note = "2/22/96 trm" ) species(name = "tc3h6ch2coch3", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1371.00], [ 4.314032120E+000, 4.748509970E-002, -1.584041620E-005, -1.443673050E-009, 1.303230000E-012, -1.572566660E+004, 1.284759630E+001] ), NASA( [ 1371.00, 5000.00], [ 1.771130320E+001, 2.676019970E-002, -9.184680220E-006, 1.429384490E-009, -8.307240090E-014, -2.152755610E+004, -6.300968900E+001] ) ), note = "2/22/96 tm" ) species(name = "neoc6h14", atoms = " C:6 H:14 ", thermo = ( NASA( [ 300.00, 1397.00], [-3.127478320E+000, 8.447277150E-002, -5.930304270E-005, 2.151573980E-008, -3.184660660E-012, -2.510212820E+004, 3.788881010E+001] ), NASA( [ 1397.00, 5000.00], [ 2.068832860E+001, 2.887817960E-002, -9.817892360E-006, 1.518248340E-009, -8.784826870E-014, -3.334946820E+004, -8.998447460E+001] ) ), note = "7/19/ 0 therm" ) species(name = "fc6h13", atoms = " C:6 H:13 ", thermo = ( NASA( [ 300.00, 1397.00], [-2.366065540E+000, 7.995616620E-002, -5.688096400E-005, 2.091075620E-008, -3.133603570E-012, -4.883299980E+002, 3.760808990E+001] ), NASA( [ 1397.00, 5000.00], [ 2.026342400E+001, 2.673797860E-002, -9.089844940E-006, 1.405654770E-009, -8.133429710E-014, -8.279205710E+003, -8.374565020E+001] ) ), note = "7/19/ 0 therm" ) species(name = "gc6h13", atoms = " C:6 H:13 ", thermo = ( NASA( [ 300.00, 1390.00], [-1.928224480E+000, 7.496794800E-002, -4.802723380E-005, 1.489639040E-008, -1.732014110E-012, -1.797828760E+003, 3.567876940E+001] ), NASA( [ 1390.00, 5000.00], [ 2.009830900E+001, 2.642730800E-002, -8.894309230E-006, 1.366799720E-009, -7.876128580E-014, -9.643248920E+003, -8.349255320E+001] ) ), note = "7/19/ 0 therm" ) species(name = "hc6h13", atoms = " C:6 H:13 ", thermo = ( NASA( [ 300.00, 1397.00], [-2.366065540E+000, 7.995616620E-002, -5.688096400E-005, 2.091075620E-008, -3.133603570E-012, -4.883299980E+002, 3.651095850E+001] ), NASA( [ 1397.00, 5000.00], [ 2.026342400E+001, 2.673797860E-002, -9.089844940E-006, 1.405654770E-009, -8.133429710E-014, -8.279205710E+003, -8.484278150E+001] ) ), note = "7/19/ 0 therm" ) species(name = "neoc6h12", atoms = " C:6 H:12 ", thermo = ( NASA( [ 300.00, 1398.00], [-3.568989870E+000, 8.166652790E-002, -6.158532510E-005, 2.401427340E-008, -3.800414110E-012, -9.148313490E+003, 4.047110100E+001] ), NASA( [ 1398.00, 5000.00], [ 1.970129000E+001, 2.492829690E-002, -8.432671540E-006, 1.299899390E-009, -7.505578930E-014, -1.693248960E+004, -8.356193190E+001] ) ), note = "2/14/95" ) species(name = "neoc6h11", atoms = " C:6 H:11 ", thermo = ( NASA( [ 300.00, 1397.00], [-1.790520010E+000, 7.317499680E-002, -5.406286220E-005, 2.063339310E-008, -3.198558980E-012, 1.927492940E+004, 3.347509870E+001] ), NASA( [ 1397.00, 5000.00], [ 1.906790220E+001, 2.296974480E-002, -7.767823620E-006, 1.197189330E-009, -6.911686130E-014, 1.223010630E+004, -7.793771250E+001] ) ), note = "2/14/95" ) species(name = "fc6h13o2", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1392.00], [-5.614624070E-001, 8.718830250E-002, -6.447830240E-005, 2.538310950E-008, -4.170083140E-012, -1.895386640E+004, 3.228946640E+001] ), NASA( [ 1392.00, 5000.00], [ 2.371024790E+001, 2.913952920E-002, -1.005974090E-005, 1.571469270E-009, -9.156288440E-014, -2.733968850E+004, -9.773955040E+001] ) ), note = "7/19/ 0 therm" ) species(name = "gc6h13o2", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1394.00], [-1.555565820E+000, 9.342390860E-002, -7.357777310E-005, 3.068534550E-008, -5.271294580E-012, -2.121446970E+004, 3.433532310E+001] ), NASA( [ 1394.00, 5000.00], [ 2.452605730E+001, 2.844902650E-002, -9.822401190E-006, 1.534536410E-009, -8.941784410E-014, -2.994572630E+004, -1.044347310E+002] ) ), note = "7/19/ 0 therm" ) species(name = "hc6h13o2", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1392.00], [-5.614624070E-001, 8.718830250E-002, -6.447830240E-005, 2.538310950E-008, -4.170083140E-012, -1.895386640E+004, 3.119233510E+001] ), NASA( [ 1392.00, 5000.00], [ 2.371024790E+001, 2.913952920E-002, -1.005974090E-005, 1.571469270E-009, -9.156288440E-014, -2.733968850E+004, -9.883668170E+001] ) ), note = "7/19/ 0 therm" ) species(name = "fc6h13o2h", atoms = " C:6 H:14 O:2 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.548116680E+000, 9.613429000E-002, -7.281159000E-005, 2.877222410E-008, -4.675863400E-012, -3.579941170E+004, 3.616398560E+001] ), NASA( [ 1393.00, 5000.00], [ 2.617801870E+001, 2.929667100E-002, -1.014499870E-005, 1.588199210E-009, -9.268142650E-014, -4.525655090E+004, -1.120684210E+002] ) ), note = "7/19/ 0 therm" ) species(name = "gc6h13o2h", atoms = " C:6 H:14 O:2 ", thermo = ( NASA( [ 300.00, 1395.00], [-2.646650270E+000, 1.025725550E-001, -8.192501670E-005, 3.399483310E-008, -5.750160840E-012, -3.803761880E+004, 3.874569100E+001] ), NASA( [ 1395.00, 5000.00], [ 2.703395810E+001, 2.861776720E-002, -9.921905540E-006, 1.554568100E-009, -9.077259440E-014, -4.790551550E+004, -1.190569910E+002] ) ), note = "7/19/ 0 therm" ) species(name = "hc6h13o2h", atoms = " C:6 H:14 O:2 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.548116680E+000, 9.613429000E-002, -7.281159000E-005, 2.877222410E-008, -4.675863400E-012, -3.579941170E+004, 3.506685420E+001] ), NASA( [ 1393.00, 5000.00], [ 2.617801870E+001, 2.929667100E-002, -1.014499870E-005, 1.588199210E-009, -9.268142650E-014, -4.525655090E+004, -1.131655530E+002] ) ), note = "7/19/ 0 therm" ) species(name = "fc6h13o", atoms = " C:6 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1398.00], [-3.496178240E+000, 8.952746910E-002, -6.700201570E-005, 2.601629910E-008, -4.118011840E-012, -1.702443570E+004, 4.440827310E+001] ), NASA( [ 1398.00, 5000.00], [ 2.195068020E+001, 2.788078460E-002, -9.490933060E-006, 1.469036380E-009, -8.505801330E-014, -2.560260610E+004, -9.141074850E+001] ) ), note = "1/16/95 therm" ) species(name = "gc6h13o", atoms = " C:6 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1401.00], [-3.656436610E+000, 9.247424470E-002, -7.217141670E-005, 2.944680550E-008, -4.903024260E-012, -1.926766250E+004, 4.254514510E+001] ), NASA( [ 1401.00, 5000.00], [ 2.227477660E+001, 2.785367080E-002, -9.532533460E-006, 1.480528500E-009, -8.591985530E-014, -2.785959360E+004, -9.527029100E+001] ) ), note = "1/16/95 therm" ) species(name = "hc6h13o", atoms = " C:6 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1398.00], [-3.496178240E+000, 8.952746910E-002, -6.700201570E-005, 2.601629910E-008, -4.118011840E-012, -1.702443570E+004, 4.331114170E+001] ), NASA( [ 1398.00, 5000.00], [ 2.195068020E+001, 2.788078460E-002, -9.490933060E-006, 1.469036380E-009, -8.505801330E-014, -2.560260610E+004, -9.250787990E+001] ) ), note = "1/16/95 therm" ) species(name = "fc6h12ooh-f", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1395.00], [-9.243232570E-001, 9.238664830E-002, -7.185995090E-005, 2.928258510E-008, -4.892912300E-012, -1.116784660E+004, 3.540203210E+001] ), NASA( [ 1395.00, 5000.00], [ 2.529223370E+001, 2.770426200E-002, -9.545775390E-006, 1.489390080E-009, -8.671227630E-014, -1.995619110E+004, -1.042235940E+002] ) ), note = "7/19/ 0 thrm" ) species(name = "fc6h12ooh-g", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1388.00], [-8.405079590E-001, 8.862491150E-002, -6.403141470E-005, 2.325457920E-008, -3.364366180E-012, -1.241728140E+004, 3.626166700E+001] ), NASA( [ 1388.00, 5000.00], [ 2.576768210E+001, 2.622580010E-002, -8.822707920E-006, 1.356212490E-009, -7.819314370E-014, -2.151879600E+004, -1.063662550E+002] ) ), note = "7/19/ 0 thrm" ) species(name = "fc6h12ooh-h", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1395.00], [-9.243232570E-001, 9.238664830E-002, -7.185995090E-005, 2.928258510E-008, -4.892912300E-012, -1.116784660E+004, 3.540203210E+001] ), NASA( [ 1395.00, 5000.00], [ 2.529223370E+001, 2.770426200E-002, -9.545775390E-006, 1.489390080E-009, -8.671227630E-014, -1.995619110E+004, -1.042235940E+002] ) ), note = "7/19/ 0 thrm" ) species(name = "gc6h12ooh-f", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1397.00], [-1.728919220E+000, 9.762041700E-002, -7.920481970E-005, 3.343243230E-008, -5.735793330E-012, -1.345376940E+004, 3.769063230E+001] ), NASA( [ 1397.00, 5000.00], [ 2.615127850E+001, 2.705523980E-002, -9.339983200E-006, 1.459171900E-009, -8.503049260E-014, -2.260632590E+004, -1.101382740E+002] ) ), note = "7/19/ 0 thrm" ) species(name = "gc6h12ooh-h", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1397.00], [-1.728919220E+000, 9.762041700E-002, -7.920481970E-005, 3.343243230E-008, -5.735793330E-012, -1.345376940E+004, 3.659350100E+001] ), NASA( [ 1397.00, 5000.00], [ 2.615127850E+001, 2.705523980E-002, -9.339983200E-006, 1.459171900E-009, -8.503049260E-014, -2.260632590E+004, -1.112354060E+002] ) ), note = "7/19/ 0 thrm" ) species(name = "hc6h12ooh-f", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1393.00], [-7.733981330E-001, 9.154302650E-002, -7.026739130E-005, 2.809554330E-008, -4.610638690E-012, -1.118720620E+004, 3.473279270E+001] ), NASA( [ 1393.00, 5000.00], [ 2.575483190E+001, 2.716431020E-002, -9.421767020E-006, 1.476581430E-009, -8.623346950E-014, -2.019088780E+004, -1.069400270E+002] ) ), note = "7/19/ 0 thrm" ) species(name = "hc6h12ooh-g", atoms = " C:6 H:13 O:2 ", thermo = ( NASA( [ 300.00, 1387.00], [-7.732083470E-001, 8.827441100E-002, -6.342563030E-005, 2.285941990E-008, -3.287190660E-012, -1.242637570E+004, 3.486200480E+001] ), NASA( [ 1387.00, 5000.00], [ 2.592998950E+001, 2.616807250E-002, -8.905786230E-006, 1.379260080E-009, -7.992363770E-014, -2.163451670E+004, -1.084957160E+002] ) ), note = "7/19/ 0 thrm" ) species(name = "fc6h12ooh-fo2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1390.00], [ 5.369072520E-001, 1.006759800E-001, -8.010532370E-005, 3.350421890E-008, -5.767451630E-012, -2.957185130E+004, 3.175026990E+001] ), NASA( [ 1390.00, 5000.00], [ 2.958694360E+001, 2.885791390E-002, -1.006842440E-005, 1.584115170E-009, -9.276450640E-014, -3.936857410E+004, -1.230394300E+002] ) ), note = "7/19/ 0 tm" ) species(name = "fc6h12ooh-go2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1392.00], [-2.055062400E-001, 1.058283780E-001, -8.781939810E-005, 3.803036270E-008, -6.706779900E-012, -3.187013330E+004, 3.441663060E+001] ), NASA( [ 1392.00, 5000.00], [ 3.028380410E+001, 2.822473930E-002, -9.840855260E-006, 1.547638990E-009, -9.060199810E-014, -4.190668630E+004, -1.272134220E+002] ) ), note = "7/19/ 0 tm" ) species(name = "fc6h12ooh-ho2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1390.00], [ 5.369072520E-001, 1.006759800E-001, -8.010532370E-005, 3.350421890E-008, -5.767451630E-012, -2.957185130E+004, 3.175026990E+001] ), NASA( [ 1390.00, 5000.00], [ 2.958694360E+001, 2.885791390E-002, -1.006842440E-005, 1.584115170E-009, -9.276450640E-014, -3.936857410E+004, -1.230394300E+002] ) ), note = "7/19/ 0 tm" ) species(name = "gc6h12ooh-fo2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1392.00], [-2.055062400E-001, 1.058283780E-001, -8.781939810E-005, 3.803036270E-008, -6.706779900E-012, -3.187013330E+004, 3.441663060E+001] ), NASA( [ 1392.00, 5000.00], [ 3.028380410E+001, 2.822473930E-002, -9.840855260E-006, 1.547638990E-009, -9.060199810E-014, -4.190668630E+004, -1.272134220E+002] ) ), note = "7/19/ 0 tm" ) species(name = "gc6h12ooh-ho2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1392.00], [-2.055062400E-001, 1.058283780E-001, -8.781939810E-005, 3.803036270E-008, -6.706779900E-012, -3.187013330E+004, 3.331949920E+001] ), NASA( [ 1392.00, 5000.00], [ 3.028380410E+001, 2.822473930E-002, -9.840855260E-006, 1.547638990E-009, -9.060199810E-014, -4.190668630E+004, -1.283105540E+002] ) ), note = "7/19/ 0 tm" ) species(name = "hc6h12ooh-fo2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1390.00], [ 5.369072520E-001, 1.006759800E-001, -8.010532370E-005, 3.350421890E-008, -5.767451630E-012, -2.957185130E+004, 3.175026990E+001] ), NASA( [ 1390.00, 5000.00], [ 2.958694360E+001, 2.885791390E-002, -1.006842440E-005, 1.584115170E-009, -9.276450640E-014, -3.936857410E+004, -1.230394300E+002] ) ), note = "7/19/ 0 tm" ) species(name = "hc6h12ooh-go2", atoms = " C:6 H:13 O:4 ", thermo = ( NASA( [ 300.00, 1392.00], [-2.055062400E-001, 1.058283780E-001, -8.781939810E-005, 3.803036270E-008, -6.706779900E-012, -3.187013330E+004, 3.331949920E+001] ), NASA( [ 1392.00, 5000.00], [ 3.028380410E+001, 2.822473930E-002, -9.840855260E-006, 1.547638990E-009, -9.060199810E-014, -4.190668630E+004, -1.283105540E+002] ) ), note = "7/19/ 0 tm" ) species(name = "f-fc6h12o", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1382.00], [-5.177960400E+000, 8.845962820E-002, -6.399320490E-005, 2.368227710E-008, -3.572247580E-012, -2.112284100E+004, 4.915179840E+001] ), NASA( [ 1382.00, 5000.00], [ 2.136060680E+001, 2.675424400E-002, -9.135644520E-006, 1.418385220E-009, -8.234393380E-014, -3.035372900E+004, -9.346024340E+001] ) ), note = "1/22/95 therm" ) species(name = "f-gc6h12o", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1385.00], [-5.823008350E+000, 9.336328950E-002, -7.170446820E-005, 2.840385030E-008, -4.588654640E-012, -2.328849020E+004, 5.135600200E+001] ), NASA( [ 1385.00, 5000.00], [ 2.196235940E+001, 2.623588570E-002, -8.955137640E-006, 1.390024540E-009, -8.068484440E-014, -3.270287570E+004, -9.706437860E+001] ) ), note = "1/22/95 therm" ) species(name = "f-hc6h12o", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1387.00], [-6.610454430E+000, 9.079339890E-002, -6.663263700E-005, 2.565890870E-008, -4.095828040E-012, -3.101634890E+004, 5.652236790E+001] ), NASA( [ 1387.00, 5000.00], [ 1.947729490E+001, 2.913309610E-002, -1.001927850E-005, 1.561716230E-009, -9.087294030E-014, -4.005950840E+004, -8.342540620E+001] ) ), note = "1/22/95 therm" ) species(name = "g-hc6h12o", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1394.00], [-4.916271070E+000, 9.490261730E-002, -7.877675100E-005, 3.446828320E-008, -6.148480320E-012, -2.314823650E+004, 4.593931300E+001] ), NASA( [ 1394.00, 5000.00], [ 2.148002200E+001, 2.679401650E-002, -9.252611150E-006, 1.445718330E-009, -8.425140100E-014, -3.175615260E+004, -9.368251350E+001] ) ), note = "1/22/95 therm" ) species(name = "neoc6ketff", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1392.00], [-4.719790440E-001, 9.285293980E-002, -7.129754230E-005, 2.811253620E-008, -4.518093030E-012, -4.504544680E+004, 3.518668780E+001] ), NASA( [ 1392.00, 5000.00], [ 2.727276720E+001, 2.606882070E-002, -9.088731820E-006, 1.429426550E-009, -8.368819390E-014, -5.448340950E+004, -1.131221060E+002] ) ), note = "7/19/ 0 therm" ) species(name = "neoc6ketfg", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1394.00], [-1.321567320E+000, 9.828482910E-002, -7.901444580E-005, 3.250642270E-008, -5.414286300E-012, -4.732393110E+004, 3.769208430E+001] ), NASA( [ 1394.00, 5000.00], [ 2.810447780E+001, 2.540011640E-002, -8.866791900E-006, 1.395723620E-009, -8.176481610E-014, -5.711231440E+004, -1.188484310E+002] ) ), note = "7/19/ 0 therm" ) species(name = "neoc6ketfh", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1392.00], [-4.719790440E-001, 9.285293980E-002, -7.129754230E-005, 2.811253620E-008, -4.518093030E-012, -4.504544680E+004, 3.449720620E+001] ), NASA( [ 1392.00, 5000.00], [ 2.727276720E+001, 2.606882070E-002, -9.088731820E-006, 1.429426550E-009, -8.368819390E-014, -5.448340950E+004, -1.138115880E+002] ) ), note = "7/19/ 0 therm" ) species(name = "neoc6ketgf", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1390.00], [-1.021314200E+000, 9.332236110E-002, -7.108723560E-005, 2.782351000E-008, -4.449834020E-012, -4.865321680E+004, 3.693667660E+001] ), NASA( [ 1390.00, 5000.00], [ 2.697964230E+001, 2.643613120E-002, -9.242054060E-006, 1.456165180E-009, -8.535969020E-014, -5.824525960E+004, -1.129505190E+002] ) ), note = "7/19/ 0 therm" ) species(name = "neoc6ketgh", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1387.00], [ 8.686981840E-001, 8.735536120E-002, -6.447541970E-005, 2.468107180E-008, -3.903905580E-012, -4.912978980E+004, 2.726230410E+001] ), NASA( [ 1387.00, 5000.00], [ 2.682987180E+001, 2.657439880E-002, -9.291665120E-006, 1.464065020E-009, -8.582457470E-014, -5.819420790E+004, -1.122241960E+002] ) ), note = "7/19/ 0 therm" ) species(name = "neoc6kethf", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1390.00], [ 7.035657130E-001, 9.029258360E-002, -7.025923070E-005, 2.857223080E-008, -4.779424270E-012, -4.588092140E+004, 2.841244780E+001] ), NASA( [ 1390.00, 5000.00], [ 2.697354340E+001, 2.625332750E-002, -9.135711090E-006, 1.434922610E-009, -8.393065980E-014, -5.479614020E+004, -1.118273330E+002] ) ), note = "7/19/ 0 therm" ) species(name = "neoc6kethg", atoms = " C:6 H:12 O:3 ", thermo = ( NASA( [ 300.00, 1394.00], [-1.993975890E+000, 1.023647490E-001, -8.590632340E-005, 3.703168510E-008, -6.442162620E-012, -4.731778570E+004, 3.965918860E+001] ), NASA( [ 1394.00, 5000.00], [ 2.815238970E+001, 2.533524360E-002, -8.838434420E-006, 1.390623940E-009, -8.143903450E-014, -5.713745120E+004, -1.199223250E+002] ) ), note = "7/19/ 0 therm" ) species(name = "tc4h9cho", atoms = " C:5 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1396.00], [-1.755882330E+000, 6.887412160E-002, -4.971610710E-005, 1.829216500E-008, -2.720569340E-012, -3.147406290E+004, 3.313344800E+001] ), NASA( [ 1396.00, 5000.00], [ 1.840563590E+001, 2.152824230E-002, -7.386555300E-006, 1.149419990E-009, -6.680037450E-014, -3.840928870E+004, -7.498869110E+001] ) ), note = "8/16/95 therm" ) species(name = "tc4h9co", atoms = " C:5 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1397.00], [-9.778333630E-001, 6.405734840E-002, -4.664088680E-005, 1.721426820E-008, -2.556813050E-012, -1.294635460E+004, 3.057273930E+001] ), NASA( [ 1397.00, 5000.00], [ 1.798643640E+001, 1.940143640E-002, -6.667158700E-006, 1.038596460E-009, -6.040645720E-014, -1.944631680E+004, -7.106692490E+001] ) ), note = "8/30/95 therm" ) species(name = "neoc5h11cho", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1389.00], [-8.550557900E-001, 7.841417060E-002, -5.611187260E-005, 2.065528150E-008, -3.093166110E-012, -3.518461200E+004, 3.115795840E+001] ), NASA( [ 1389.00, 5000.00], [ 2.182019270E+001, 2.523771740E-002, -8.541431050E-006, 1.317482410E-009, -7.611620710E-014, -4.300142870E+004, -9.048865770E+001] ) ), note = "2/22/96 thrm" ) species(name = "neoc5h11co", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1389.00], [-7.520803070E-002, 7.360399550E-002, -5.306397350E-005, 1.959153760E-008, -2.931377300E-012, -1.665751900E+004, 2.858612680E+001] ), NASA( [ 1389.00, 5000.00], [ 2.142127950E+001, 2.306603250E-002, -7.801411980E-006, 1.202977000E-009, -6.949135080E-014, -2.404359670E+004, -8.667265800E+001] ) ), note = "2/22/96 therm" ) species(name = "tc4h9chcho", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1396.00], [-1.312625030E+000, 7.862011200E-002, -5.929091290E-005, 2.307559550E-008, -3.656963220E-012, -1.500357520E+004, 3.263187840E+001] ), NASA( [ 1396.00, 5000.00], [ 2.147528900E+001, 2.360142410E-002, -8.103975280E-006, 1.261665390E-009, -7.334742470E-014, -2.271194170E+004, -8.907522420E+001] ) ), note = "2/22/96 therm" ) species(name = "tc4h8ch2cho", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1389.00], [-6.565743660E-002, 7.378233890E-002, -5.353278100E-005, 1.995762230E-008, -3.022723890E-012, -1.057524940E+004, 2.965384540E+001] ), NASA( [ 1389.00, 5000.00], [ 2.141800440E+001, 2.305962740E-002, -7.797300440E-006, 1.202146390E-009, -6.943561310E-014, -1.794081390E+004, -8.546901880E+001] ) ), note = "2/22/96 thrm" ) species(name = "ic4h7cho", atoms = " C:5 H:8 O:1 ", thermo = ( NASA( [ 300.00, 1389.00], [ 7.356143890E-001, 5.259138410E-002, -3.517856030E-005, 1.230245440E-008, -1.797510730E-012, -1.560619670E+004, 2.599573750E+001] ), NASA( [ 1389.00, 5000.00], [ 1.548554570E+001, 1.950465020E-002, -6.722176680E-006, 1.048946820E-009, -6.107224500E-014, -2.091916750E+004, -5.379643970E+001] ) ), note = "2/9/96 therm" ) species(name = "ic4h7co", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1389.00], [ 1.513842220E+000, 4.777049790E-002, -3.208990570E-005, 1.121211240E-008, -1.630360120E-012, 2.921545310E+003, 2.343474210E+001] ), NASA( [ 1389.00, 5000.00], [ 1.507198780E+001, 1.736991540E-002, -5.999459080E-006, 9.375522010E-010, -5.464319900E-014, -1.958610470E+003, -4.990691510E+001] ) ), note = "2/9/96 therm" ) species(name = "ac3h4ch2cho", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [-1.834215790E-001, 5.694258720E-002, -4.443682800E-005, 1.813168030E-008, -3.044885100E-012, 2.713374330E+003, 2.941143050E+001] ), NASA( [ 1390.00, 5000.00], [ 1.641947200E+001, 1.646166030E-002, -5.739854440E-006, 9.027362160E-010, -5.285045860E-014, -2.925931740E+003, -5.922827750E+001] ) ), note = "2/9/96 therm" ) species(name = "ic3h5chcho", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1384.00], [ 4.500978870E-001, 5.064620970E-002, -3.397611910E-005, 1.155954450E-008, -1.609194940E-012, 1.415729910E+003, 2.623773230E+001] ), NASA( [ 1384.00, 5000.00], [ 1.558790260E+001, 1.721452430E-002, -6.010316310E-006, 9.461103800E-010, -5.542394880E-014, -4.071763380E+003, -5.581062800E+001] ) ), note = "2/9/96 therm" ) species(name = "ic5h11cho-b", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1396.00], [-1.950865980E+000, 8.093621730E-002, -5.775639180E-005, 2.107850010E-008, -3.120585590E-012, -3.436746010E+004, 3.681955760E+001] ), NASA( [ 1396.00, 5000.00], [ 2.157441300E+001, 2.602240490E-002, -8.929992520E-006, 1.389684290E-009, -8.076547160E-014, -4.250783800E+004, -8.948419330E+001] ) ), note = "2/22/96 term" ) species(name = "ic5h11co-b", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1396.00], [-1.171195940E+000, 7.611298140E-002, -5.467210400E-005, 1.999513160E-008, -2.955636430E-012, -1.584001780E+004, 3.425118250E+001] ), NASA( [ 1396.00, 5000.00], [ 2.115522820E+001, 2.389544020E-002, -8.210512730E-006, 1.278845110E-009, -7.437054520E-014, -2.354480090E+004, -8.556232320E+001] ) ), note = "2/22/96 therm" ) species(name = "ic5h10cho-ba", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1396.00], [-1.090370680E+000, 7.601010550E-002, -5.487020300E-005, 2.026287940E-008, -3.035698920E-012, -9.768702150E+003, 3.498546670E+001] ), NASA( [ 1396.00, 5000.00], [ 2.108281090E+001, 2.394757670E-002, -8.226152380E-006, 1.281020480E-009, -7.448576940E-014, -1.740868720E+004, -8.394761350E+001] ) ), note = "2/22/96 trm" ) species(name = "ic5h10cho-bc", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1384.00], [-8.060065240E-001, 7.138743480E-002, -4.572213610E-005, 1.348006610E-008, -1.357391690E-012, -1.104990180E+004, 3.490686630E+001] ), NASA( [ 1384.00, 5000.00], [ 2.146792980E+001, 2.273712530E-002, -7.635685270E-006, 1.172550870E-009, -6.756218590E-014, -1.895981280E+004, -8.564638550E+001] ) ), note = "2/22/96 trm" ) species(name = "ic5h10cho-bd", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1396.00], [-1.090370680E+000, 7.601010550E-002, -5.487020300E-005, 2.026287940E-008, -3.035698920E-012, -9.768702150E+003, 3.498546670E+001] ), NASA( [ 1396.00, 5000.00], [ 2.108281090E+001, 2.394757670E-002, -8.226152380E-006, 1.281020480E-009, -7.448576940E-014, -1.740868720E+004, -8.394761350E+001] ) ), note = "2/22/96 trm" ) species(name = "c4h7cho1-2", atoms = " C:5 H:8 O:1 ", thermo = ( NASA( [ 300.00, 1396.00], [-6.618118760E-001, 6.328008940E-002, -5.162380220E-005, 2.207837560E-008, -3.842611000E-012, -1.835601390E+004, 2.950705190E+001] ), NASA( [ 1396.00, 5000.00], [ 1.703140210E+001, 1.799858140E-002, -6.161164440E-006, 9.571523600E-010, -5.555945770E-014, -2.412251130E+004, -6.414409810E+001] ) ), note = "2/22/96 therm" ) species(name = "c4h7co1-2", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1397.00], [ 5.788974180E-001, 5.842821210E-002, -5.036423540E-005, 2.278499820E-008, -4.158144870E-012, -2.971574170E+003, 2.312342790E+001] ), NASA( [ 1397.00, 5000.00], [ 1.646517680E+001, 1.590622510E-002, -5.432303230E-006, 8.425210960E-010, -4.884615700E-014, -7.985165090E+003, -6.033942560E+001] ) ), note = "2/22/96 therm" ) species(name = "c4h6cho1-23", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1393.00], [-9.316285560E-001, 6.123410220E-002, -5.028681480E-005, 2.130049770E-008, -3.657593550E-012, -1.335405340E+003, 2.968398810E+001] ), NASA( [ 1393.00, 5000.00], [ 1.707006050E+001, 1.584297310E-002, -5.512361510E-006, 8.658050320E-010, -5.064401280E-014, -7.262508220E+003, -6.582891980E+001] ) ), note = "2/22/96 thrm" ) species(name = "c4h6cho1-24", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1396.00], [ 1.381215540E-001, 5.860728580E-002, -4.900753150E-005, 2.139146530E-008, -3.781474260E-012, 6.251683440E+003, 2.794836830E+001] ), NASA( [ 1396.00, 5000.00], [ 1.657878860E+001, 1.591937500E-002, -5.462032120E-006, 8.498602810E-010, -4.938506690E-014, 9.530243810E+002, -5.885865890E+001] ) ), note = "2/22/96 thrm" ) species(name = "c4h7cho2-2", atoms = " C:5 H:8 O:1 ", thermo = ( NASA( [ 300.00, 1373.00], [ 6.159359920E-001, 5.513346150E-002, -3.471299840E-005, 1.025793260E-008, -1.132565810E-012, -2.166778430E+004, 3.394796180E+001] ), NASA( [ 1373.00, 5000.00], [ 1.857422050E+001, 1.769388360E-002, -6.284248510E-006, 1.000581280E-009, -5.908221280E-014, -2.838556970E+004, -6.415443900E+001] ) ), note = "2/22/96 therm" ) species(name = "c4h7co2-2", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1374.00], [ 1.780332700E+000, 5.059014270E-002, -3.384106220E-005, 1.114620500E-008, -1.476654170E-012, -6.271227300E+003, 2.792282000E+001] ), NASA( [ 1374.00, 5000.00], [ 1.805230430E+001, 1.551681130E-002, -5.516195740E-006, 8.788296450E-010, -5.191484640E-014, -1.225985790E+004, -6.058798230E+001] ) ), note = "2/22/96 therm" ) species(name = "c4h6cho2-21", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1375.00], [-7.655596190E-001, 6.093117780E-002, -4.449352070E-005, 1.548969470E-008, -2.087294270E-012, -3.268967390E+003, 3.960023090E+001] ), NASA( [ 1375.00, 5000.00], [ 2.004986720E+001, 1.398510050E-002, -5.027912770E-006, 8.070754460E-010, -4.792660250E-014, -1.059388640E+004, -7.267225650E+001] ) ), note = "2/22/96 thrm" ) species(name = "c4h6cho2-24", atoms = " C:5 H:7 O:1 ", thermo = ( NASA( [ 300.00, 1375.00], [-7.655596190E-001, 6.093117780E-002, -4.449352070E-005, 1.548969470E-008, -2.087294270E-012, -3.268967390E+003, 3.960023090E+001] ), NASA( [ 1375.00, 5000.00], [ 2.004986720E+001, 1.398510050E-002, -5.027912770E-006, 8.070754460E-010, -4.792660250E-014, -1.059388640E+004, -7.267225650E+001] ) ), note = "2/22/96 thrm" ) species(name = "ch2cchch3", atoms = " C:4 H:6 ", thermo = ( NASA( [ 300.00, 1381.00], [ 1.479767710E+000, 3.294824860E-002, -1.831377980E-005, 4.761682990E-009, -4.438862610E-013, 5.790998250E+003, 8.240351640E+000] ), NASA( [ 1381.00, 5000.00], [ 1.089058990E+001, 1.419943720E-002, -4.921255650E-006, 7.708071100E-010, -4.499530940E-014, 2.143693820E+003, -4.354294260E+001] ) ), note = "11/10/98 therm" ) species(name = "tc4h9coch3", atoms = " C:6 H:12 O:1 ", thermo = ( NASA( [ 300.00, 1393.00], [-2.356415650E+000, 8.091056380E-002, -5.709013840E-005, 2.067898140E-008, -3.058728670E-012, -3.799990220E+004, 3.856812630E+001] ), NASA( [ 1393.00, 5000.00], [ 2.116272680E+001, 2.657263650E-002, -9.163355710E-006, 1.430583850E-009, -8.332594680E-014, -4.622690520E+004, -8.795676280E+001] ) ), note = "2/22/96 therm" ) species(name = "tc4h9coch2", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1395.00], [-2.767560400E+000, 8.391871180E-002, -6.566548500E-005, 2.651774390E-008, -4.356005710E-012, -1.665781120E+004, 3.897197940E+001] ), NASA( [ 1395.00, 5000.00], [ 2.176681060E+001, 2.361614950E-002, -8.166844210E-006, 1.277479300E-009, -7.451048350E-014, -2.486614910E+004, -9.171119150E+001] ) ), note = "2/22/96" ) species(name = "tc4h8coch3", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.569344020E+000, 7.625769050E-002, -5.443910680E-005, 1.992940630E-008, -2.976314430E-012, -1.338944930E+004, 3.707574840E+001] ), NASA( [ 1393.00, 5000.00], [ 2.073847860E+001, 2.444429310E-002, -8.442090950E-006, 1.319325250E-009, -7.690075700E-014, -2.116085090E+004, -8.282810020E+001] ) ), note = "2/22/96 therm" ) species(name = "ch2ccho", atoms = " C:3 H:3 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [ 1.998061920E+000, 2.723427400E-002, -2.240503310E-005, 9.682572380E-009, -1.711380820E-012, 1.678308310E+004, 1.623599190E+001] ), NASA( [ 1390.00, 5000.00], [ 9.781115160E+000, 7.509692430E-003, -2.615563400E-006, 4.110469550E-010, -2.405146030E-014, 1.420551630E+004, -2.506564890E+001] ) ), note = "2/22/96" ) species(name = "c7h162-4", atoms = " C:7 H:16 ", thermo = ( NASA( [ 300.00, 1391.00], [-2.256578810E+000, 8.934375360E-002, -5.762906540E-005, 1.939917310E-008, -2.728811060E-012, -2.775317480E+004, 3.803087270E+001] ), NASA( [ 1391.00, 5000.00], [ 2.225878340E+001, 3.524603420E-002, -1.211653330E-005, 1.887315240E-009, -1.097419510E-013, -3.668655650E+004, -9.492732950E+001] ) ), note = "7/19/ 0 therm" ) species(name = "xc7h15", atoms = " C:7 H:15 ", thermo = ( NASA( [ 300.00, 1391.00], [-1.487927790E+000, 8.479350300E-002, -5.514775460E-005, 1.875613450E-008, -2.669661320E-012, -3.140491120E+003, 3.661949930E+001] ), NASA( [ 1391.00, 5000.00], [ 2.184424310E+001, 3.309705110E-002, -1.138555070E-005, 1.774280490E-009, -1.032032050E-013, -1.162210520E+004, -8.984809810E+001] ) ), note = "7/19/ 0 therm" ) species(name = "yc7h15", atoms = " C:7 H:15 ", thermo = ( NASA( [ 300.00, 1384.00], [ 1.308971060E+000, 6.961364420E-002, -3.311500570E-005, 5.828882560E-009, 3.544273140E-014, -5.785125130E+003, 2.456582350E+001] ), NASA( [ 1384.00, 5000.00], [ 2.045814710E+001, 3.430763610E-002, -1.181026350E-005, 1.841296110E-009, -1.071338060E-013, -1.349787740E+004, -8.182122640E+001] ) ), note = "7/19/ 0 therm" ) species(name = "zc7h15", atoms = " C:7 H:15 ", thermo = ( NASA( [ 300.00, 1388.00], [-1.204117850E+000, 8.056018210E-002, -4.757101950E-005, 1.362132680E-008, -1.473019030E-012, -4.427977570E+003, 3.648923740E+001] ), NASA( [ 1388.00, 5000.00], [ 2.141250230E+001, 3.317218880E-002, -1.134998590E-005, 1.762564380E-009, -1.022790530E-013, -1.286650960E+004, -8.697380450E+001] ) ), note = "7/19/ 0 therm" ) species(name = "xc7h14", atoms = " C:7 H:14 ", thermo = ( NASA( [ 300.00, 1392.00], [-1.330814970E+000, 8.210823520E-002, -5.491233030E-005, 1.942849480E-008, -2.888865420E-012, -1.320213840E+004, 3.435497460E+001] ), NASA( [ 1392.00, 5000.00], [ 2.101640300E+001, 3.152145970E-002, -1.080739470E-005, 1.680401910E-009, -9.758923130E-014, -2.121170500E+004, -8.638187850E+001] ) ), note = "7/19/ 0 therm" ) species(name = "yc7h14", atoms = " C:7 H:14 ", thermo = ( NASA( [ 300.00, 1392.00], [-8.422326490E-001, 7.897982970E-002, -5.045744750E-005, 1.689340480E-008, -2.372019870E-012, -1.459715380E+004, 3.190961890E+001] ), NASA( [ 1392.00, 5000.00], [ 2.050743230E+001, 3.196441670E-002, -1.096187780E-005, 1.704637360E-009, -9.900361200E-014, -2.239456090E+004, -8.392665610E+001] ) ), note = "7/19/ 0 therm" ) species(name = "xc7h13", atoms = " C:7 H:13 ", thermo = ( NASA( [ 300.00, 1389.00], [-3.067832920E-001, 7.206911450E-002, -4.202339160E-005, 1.200500880E-008, -1.326052140E-012, 1.237404490E+003, 2.872845750E+001] ), NASA( [ 1389.00, 5000.00], [ 1.961534680E+001, 3.070741050E-002, -1.055304680E-005, 1.643459590E-009, -9.554997280E-014, -6.276378290E+003, -8.023097700E+001] ) ), note = "7/19/ 0 therm" ) species(name = "xc7h15o2", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [-3.847520070E-002, 9.345591050E-002, -6.435401600E-005, 2.370929020E-008, -3.704601890E-012, -2.155044680E+004, 3.365468740E+001] ), NASA( [ 1390.00, 5000.00], [ 2.564141290E+001, 3.472827200E-002, -1.198960680E-005, 1.872913220E-009, -1.091231520E-013, -3.074105590E+004, -1.049548250E+002] ) ), note = "7/19/ 0 therm" ) species(name = "yc7h15o2", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [-1.761942270E-001, 9.725676340E-002, -7.108357840E-005, 2.804869660E-008, -4.668779030E-012, -2.464661460E+004, 3.088133710E+001] ), NASA( [ 1390.00, 5000.00], [ 2.637773680E+001, 3.409959340E-002, -1.177185480E-005, 1.838818000E-009, -1.071332050E-013, -3.391335840E+004, -1.115945720E+002] ) ), note = "7/19/ 0 therm" ) species(name = "zc7h15o2", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1392.00], [-1.094101590E+000, 9.992875890E-002, -7.397935560E-005, 2.940684150E-008, -4.901564230E-012, -2.379934170E+004, 3.640806290E+001] ), NASA( [ 1392.00, 5000.00], [ 2.635460140E+001, 3.409761290E-002, -1.176662530E-005, 1.837547870E-009, -1.070415200E-013, -3.329662180E+004, -1.106294310E+002] ) ), note = "7/19/ 0 therm" ) species(name = "xc7h15o2h", atoms = " C:7 H:16 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [-1.079982010E+000, 1.026329300E-001, -7.301142350E-005, 2.728178630E-008, -4.247304140E-012, -3.838738780E+004, 3.778571090E+001] ), NASA( [ 1390.00, 5000.00], [ 2.812167770E+001, 3.485957800E-002, -1.206266460E-005, 1.887402930E-009, -1.100978700E-013, -4.866108590E+004, -1.193508590E+002] ) ), note = "7/19/ 0 therm" ) species(name = "yc7h15o2h", atoms = " C:7 H:16 O:2 ", thermo = ( NASA( [ 300.00, 1391.00], [-1.201610390E+000, 1.063452580E-001, -7.961238310E-005, 3.155436090E-008, -5.199796960E-012, -4.148542800E+004, 3.494192770E+001] ), NASA( [ 1391.00, 5000.00], [ 2.884470040E+001, 3.425841240E-002, -1.185792140E-005, 1.855699040E-009, -1.082615800E-013, -5.183205160E+004, -1.259237390E+002] ) ), note = "7/19/ 0 therm" ) species(name = "zc7h15o2h", atoms = " C:7 H:16 O:2 ", thermo = ( NASA( [ 300.00, 1392.00], [-2.586407120E+000, 1.115606220E-001, -8.671884250E-005, 3.572077700E-008, -6.085053380E-012, -4.058003740E+004, 4.253412570E+001] ), NASA( [ 1392.00, 5000.00], [ 2.882294760E+001, 3.432272870E-002, -1.189017070E-005, 1.861774600E-009, -1.086572830E-013, -5.121364110E+004, -1.249714910E+002] ) ), note = "7/19/ 0 therm" ) species(name = "xc7h15o", atoms = " C:7 H:15 O:1 ", thermo = ( NASA( [ 300.00, 1394.00], [-2.123924570E+000, 9.423371390E-002, -6.562139100E-005, 2.387667200E-008, -3.588074000E-012, -1.970934970E+004, 4.144400600E+001] ), NASA( [ 1394.00, 5000.00], [ 2.416169090E+001, 3.326394100E-002, -1.135543450E-005, 1.760736070E-009, -1.020657800E-013, -2.890368430E+004, -9.991719270E+001] ) ), note = "7/19/ 0 therm" ) species(name = "yc7h15o", atoms = " C:7 H:15 O:1 ", thermo = ( NASA( [ 300.00, 1395.00], [-2.148648650E+000, 9.761372250E-002, -7.192067950E-005, 2.809672160E-008, -4.553979770E-012, -2.322668350E+004, 3.859224130E+001] ), NASA( [ 1395.00, 5000.00], [ 2.478092810E+001, 3.284553780E-002, -1.123336960E-005, 1.743881230E-009, -1.011695960E-013, -3.244433140E+004, -1.054622690E+002] ) ), note = "7/19/ 0 therm" ) species(name = "zc7h15o", atoms = " C:7 H:15 O:1 ", thermo = ( NASA( [ 300.00, 1394.00], [-2.840449820E+000, 9.938759240E-002, -7.379662390E-005, 2.919642050E-008, -4.812157120E-012, -2.186179420E+004, 4.261764050E+001] ), NASA( [ 1394.00, 5000.00], [ 2.458983340E+001, 3.334105010E-002, -1.147647610E-005, 1.789224340E-009, -1.041052380E-013, -3.128309560E+004, -1.041553360E+002] ) ), note = "7/19/ 0 therm" ) species(name = "xc7h14ooh-x1", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [-2.517272350E-001, 9.781459200E-002, -7.014721520E-005, 2.642341330E-008, -4.145397530E-012, -1.378353690E+004, 3.610450180E+001] ), NASA( [ 1390.00, 5000.00], [ 2.768669340E+001, 3.275194480E-002, -1.135115150E-005, 1.777941060E-009, -1.037884940E-013, -2.359261730E+004, -1.141594150E+002] ) ), note = "7/19/ 0 trm" ) species(name = "xc7h14ooh-y1", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1384.00], [ 2.956810820E+000, 8.078463960E-002, -4.564616310E-005, 1.211205670E-008, -1.157942250E-012, -1.648787560E+004, 2.284852100E+001] ), NASA( [ 1384.00, 5000.00], [ 2.614145920E+001, 3.407782750E-002, -1.181108070E-005, 1.849966340E-009, -1.079906580E-013, -2.539531240E+004, -1.044972560E+002] ) ), note = "7/19/ 0 trm" ) species(name = "xc7h14ooh-z", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1386.00], [-2.957634400E-001, 9.482480780E-002, -6.388825800E-005, 2.167898850E-008, -2.953226940E-012, -1.501767430E+004, 3.752151270E+001] ), NASA( [ 1386.00, 5000.00], [ 2.764890220E+001, 3.211243160E-002, -1.099079120E-005, 1.707824910E-009, -9.916618740E-014, -2.495535980E+004, -1.134323290E+002] ) ), note = "7/19/ 0 thrm" ) species(name = "xc7h14ooh-y2", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1384.00], [ 2.956810820E+000, 8.078463960E-002, -4.564616310E-005, 1.211205670E-008, -1.157942250E-012, -1.648787560E+004, 2.284852100E+001] ), NASA( [ 1384.00, 5000.00], [ 2.614145920E+001, 3.407782750E-002, -1.181108070E-005, 1.849966340E-009, -1.079906580E-013, -2.539531240E+004, -1.044972560E+002] ) ), note = "7/19/ 0 trm" ) species(name = "xc7h14ooh-x2", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [-2.517272350E-001, 9.781459200E-002, -7.014721520E-005, 2.642341330E-008, -4.145397530E-012, -1.378353690E+004, 3.610450180E+001] ), NASA( [ 1390.00, 5000.00], [ 2.768669340E+001, 3.275194480E-002, -1.135115150E-005, 1.777941060E-009, -1.037884940E-013, -2.359261730E+004, -1.141594150E+002] ) ), note = "7/19/ 0 trm" ) species(name = "yc7h14ooh-x1", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1391.00], [-4.184547200E-001, 1.017273050E-001, -7.703060530E-005, 3.085111420E-008, -5.127827740E-012, -1.687483450E+004, 3.346413920E+001] ), NASA( [ 1391.00, 5000.00], [ 2.842639010E+001, 3.211571000E-002, -1.112979100E-005, 1.743181130E-009, -1.017558300E-013, -2.676660140E+004, -1.208240590E+002] ) ), note = "7/19/ 0 trm" ) species(name = "yc7h14ooh-z", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1387.00], [-4.535559240E-001, 9.868676410E-002, -7.069039160E-005, 2.603544490E-008, -3.915505430E-012, -1.810996650E+004, 3.484738600E+001] ), NASA( [ 1387.00, 5000.00], [ 2.843176320E+001, 3.138461010E-002, -1.072715690E-005, 1.665465940E-009, -9.665399190E-014, -2.814255440E+004, -1.203226580E+002] ) ), note = "7/19/ 0 thrm" ) species(name = "yc7h14ooh-y2", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1385.00], [ 2.669957360E+000, 8.522762020E-002, -5.332797840E-005, 1.705798350E-008, -2.260302530E-012, -1.956083980E+004, 2.077066740E+001] ), NASA( [ 1385.00, 5000.00], [ 2.687315500E+001, 3.348451500E-002, -1.161241450E-005, 1.819561670E-009, -1.062441960E-013, -2.857504050E+004, -1.111344630E+002] ) ), note = "7/19/ 0 trm" ) species(name = "yc7h14ooh-x2", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1391.00], [-4.184547200E-001, 1.017273050E-001, -7.703060530E-005, 3.085111420E-008, -5.127827740E-012, -1.687483450E+004, 3.346413920E+001] ), NASA( [ 1391.00, 5000.00], [ 2.842639010E+001, 3.211571000E-002, -1.112979100E-005, 1.743181130E-009, -1.017558300E-013, -2.676660140E+004, -1.208240590E+002] ) ), note = "7/19/ 0 trm" ) species(name = "zc7h14ooh-x", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1392.00], [-1.218527430E+000, 1.038795170E-001, -7.890284320E-005, 3.147588600E-008, -5.186343730E-012, -1.604726710E+004, 3.843510610E+001] ), NASA( [ 1392.00, 5000.00], [ 2.852502120E+001, 3.204671090E-002, -1.110976170E-005, 1.740488220E-009, -1.016178680E-013, -2.621168970E+004, -1.205906360E+002] ) ), note = "7/19/ 0 thrm" ) species(name = "zc7h14ooh-y", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1386.00], [ 2.168263050E+000, 8.626856350E-002, -5.335449120E-005, 1.639700100E-008, -2.009306910E-012, -1.878675360E+004, 2.430163020E+001] ), NASA( [ 1386.00, 5000.00], [ 2.714105200E+001, 3.323030010E-002, -1.151964860E-005, 1.804620200E-009, -1.053576770E-013, -2.806963570E+004, -1.118329600E+002] ) ), note = "7/19/ 0 thrm" ) species(name = "xc7h14ooh-x1o2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1388.00], [ 9.600777950E-001, 1.074248610E-001, -8.071554790E-005, 3.229159450E-008, -5.404667480E-012, -3.215443590E+004, 3.425897120E+001] ), NASA( [ 1388.00, 5000.00], [ 3.153227550E+001, 3.443712440E-002, -1.199562140E-005, 1.885212080E-009, -1.103075380E-013, -4.277603380E+004, -1.296487510E+002] ) ), note = "7/19/ 0 m" ) species(name = "xc7h14ooh-x2o2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1388.00], [ 9.600777950E-001, 1.074248610E-001, -8.071554790E-005, 3.229159450E-008, -5.404667480E-012, -3.215443590E+004, 3.425897120E+001] ), NASA( [ 1388.00, 5000.00], [ 3.153227550E+001, 3.443712440E-002, -1.199562140E-005, 1.885212080E-009, -1.103075380E-013, -4.277603380E+004, -1.296487510E+002] ) ), note = "7/19/ 0 m" ) species(name = "xc7h14ooh-y1o2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 8.826165620E-001, 1.108959930E-001, -8.691364160E-005, 3.628637710E-008, -6.290468240E-012, -3.525796600E+004, 3.121987020E+001] ), NASA( [ 1389.00, 5000.00], [ 3.225751270E+001, 3.381603780E-002, -1.178008490E-005, 1.851420660E-009, -1.083335800E-013, -4.594518190E+004, -1.362268430E+002] ) ), note = "7/19/ 0 m" ) species(name = "xc7h14ooh-y2o2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 8.826165620E-001, 1.108959930E-001, -8.691364160E-005, 3.628637710E-008, -6.290468240E-012, -3.525796600E+004, 3.121987020E+001] ), NASA( [ 1389.00, 5000.00], [ 3.225751270E+001, 3.381603780E-002, -1.178008490E-005, 1.851420660E-009, -1.083335800E-013, -4.594518190E+004, -1.362268430E+002] ) ), note = "7/19/ 0 m" ) species(name = "xc7h14ooh-zo2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1390.00], [ 2.622216490E-001, 1.124214300E-001, -8.821481530E-005, 3.668464630E-008, -6.313902930E-012, -3.446072560E+004, 3.602000980E+001] ), NASA( [ 1390.00, 5000.00], [ 3.223318340E+001, 3.379492750E-002, -1.176367660E-005, 1.847919140E-009, -1.080919940E-013, -4.531155470E+004, -1.345260430E+002] ) ), note = "7/19/ 0 tm" ) species(name = "yc7h14ooh-x1o2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 8.826165620E-001, 1.108959930E-001, -8.691364160E-005, 3.628637710E-008, -6.290468240E-012, -3.525796600E+004, 3.121987020E+001] ), NASA( [ 1389.00, 5000.00], [ 3.225751270E+001, 3.381603780E-002, -1.178008490E-005, 1.851420660E-009, -1.083335800E-013, -4.594518190E+004, -1.362268430E+002] ) ), note = "7/19/ 0 m" ) species(name = "yc7h14ooh-x2o2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1389.00], [ 8.826165620E-001, 1.108959930E-001, -8.691364160E-005, 3.628637710E-008, -6.290468240E-012, -3.525796600E+004, 3.121987020E+001] ), NASA( [ 1389.00, 5000.00], [ 3.225751270E+001, 3.381603780E-002, -1.178008490E-005, 1.851420660E-009, -1.083335800E-013, -4.594518190E+004, -1.362268430E+002] ) ), note = "7/19/ 0 m" ) species(name = "yc7h14ooh-y2o2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1390.00], [ 7.697278740E-001, 1.145586040E-001, -9.341260770E-005, 4.046999840E-008, -7.217917820E-012, -3.835713930E+004, 2.833731780E+001] ), NASA( [ 1390.00, 5000.00], [ 3.299004360E+001, 3.318721510E-002, -1.156153170E-005, 1.817121550E-009, -1.063285530E-013, -4.911549440E+004, -1.428436190E+002] ) ), note = "7/19/ 0 m" ) species(name = "yc7h14ooh-zo2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1390.00], [ 1.859078850E-001, 1.158957770E-001, -9.449235840E-005, 4.076325960E-008, -7.223358530E-012, -3.756419320E+004, 3.297624990E+001] ), NASA( [ 1390.00, 5000.00], [ 3.292540560E+001, 3.319813480E-002, -1.155562270E-005, 1.815196760E-009, -1.061761060E-013, -4.846519570E+004, -1.409083160E+002] ) ), note = "7/19/ 0 tm" ) species(name = "zc7h14ooh-xo2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1390.00], [ 2.622216490E-001, 1.124214300E-001, -8.821481530E-005, 3.668464630E-008, -6.313902930E-012, -3.446072560E+004, 3.602000980E+001] ), NASA( [ 1390.00, 5000.00], [ 3.223318340E+001, 3.379492750E-002, -1.176367660E-005, 1.847919140E-009, -1.080919940E-013, -4.531155470E+004, -1.345260430E+002] ) ), note = "7/19/ 0 tm" ) species(name = "zc7h14ooh-yo2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1390.00], [ 1.859078850E-001, 1.158957770E-001, -9.449235840E-005, 4.076325960E-008, -7.223358530E-012, -3.756419320E+004, 3.297624990E+001] ), NASA( [ 1390.00, 5000.00], [ 3.292540560E+001, 3.319813480E-002, -1.155562270E-005, 1.815196760E-009, -1.061761060E-013, -4.846519570E+004, -1.409083160E+002] ) ), note = "7/19/ 0 tm" ) species(name = "x-x1c7h14o", atoms = " C:7 H:14 O:1 ", thermo = ( NASA( [ 300.00, 1396.00], [-5.932333790E+000, 9.961473430E-002, -7.053017830E-005, 2.563390020E-008, -3.785921630E-012, -2.394668120E+004, 5.661817920E+001] ), NASA( [ 1396.00, 5000.00], [ 2.266654020E+001, 3.289470650E-002, -1.124315320E-005, 1.744933320E-009, -1.012201890E-013, -3.384782630E+004, -9.694016570E+001] ) ), note = "8/11/98 therm" ) species(name = "x-x2c7h14o", atoms = " C:7 H:14 O:1 ", thermo = ( NASA( [ 300.00, 1393.00], [-8.429091880E+000, 1.056478600E-001, -7.393675420E-005, 2.614240000E-008, -3.716543270E-012, -3.566582620E+004, 6.346951070E+001] ), NASA( [ 1393.00, 5000.00], [ 2.279069420E+001, 3.393930310E-002, -1.167187670E-005, 1.819127140E-009, -1.058393430E-013, -4.657454160E+004, -1.045413680E+002] ) ), note = "8/11/98 therm" ) species(name = "x-y1c7h14o", atoms = " C:7 H:14 O:1 ", thermo = ( NASA( [ 300.00, 1397.00], [-4.167875950E+000, 9.998031840E-002, -7.546655780E-005, 2.984079570E-008, -4.845560520E-012, -2.699975680E+004, 4.637361050E+001] ), NASA( [ 1397.00, 5000.00], [ 2.399399030E+001, 3.147923590E-002, -1.078260810E-005, 1.675734350E-009, -9.729354790E-014, -3.651730570E+004, -1.039247080E+002] ) ), note = "8/11/98 therm" ) species(name = "x-y2c7h14o", atoms = " C:7 H:14 O:1 ", thermo = ( NASA( [ 300.00, 1397.00], [-7.911939180E+000, 1.073667420E-001, -8.047486150E-005, 3.129518720E-008, -4.966838380E-012, -3.712655210E+004, 6.341858690E+001] ), NASA( [ 1397.00, 5000.00], [ 2.272553380E+001, 3.326785880E-002, -1.137156140E-005, 1.764945370E-009, -1.023841900E-013, -4.748019240E+004, -1.001705310E+002] ) ), note = "8/11/98 therm" ) species(name = "x-zc7h14o", atoms = " C:7 H:14 O:1 ", thermo = ( NASA( [ 300.00, 1399.00], [-6.178628350E+000, 1.028483560E-001, -7.599423540E-005, 2.916038510E-008, -4.576228620E-012, -2.617458970E+004, 5.626911780E+001] ), NASA( [ 1399.00, 5000.00], [ 2.305070520E+001, 3.275692430E-002, -1.123442170E-005, 1.747383090E-009, -1.015100080E-013, -3.612547130E+004, -1.000351980E+002] ) ), note = "8/11/98 therm" ) species(name = "y-yc7h14o", atoms = " C:7 H:14 O:1 ", thermo = ( NASA( [ 300.00, 1397.00], [-6.124719720E+000, 1.069369220E-001, -8.382627270E-005, 3.441957850E-008, -5.778382590E-012, -3.095821040E+004, 5.296847250E+001] ), NASA( [ 1397.00, 5000.00], [ 2.396741970E+001, 3.196290860E-002, -1.095753140E-005, 1.703882630E-009, -9.896677980E-014, -4.095218190E+004, -1.070041350E+002] ) ), note = "8/11/98 therm" ) species(name = "y-zc7h14o", atoms = " C:7 H:14 O:1 ", thermo = ( NASA( [ 300.00, 1399.00], [-4.910850520E+000, 1.052104330E-001, -8.356864010E-005, 3.483357720E-008, -5.932512900E-012, -2.914776880E+004, 4.836406090E+001] ), NASA( [ 1399.00, 5000.00], [ 2.452798410E+001, 3.116560130E-002, -1.070386060E-005, 1.666389510E-009, -9.686495090E-014, -3.886852430E+004, -1.079099110E+002] ) ), note = "8/11/98 therm" ) species(name = "c7ket24xx1", atoms = " C:7 H:14 O:3 ", thermo = ( NASA( [ 300.00, 1390.00], [-3.708424370E-001, 1.012070290E-001, -7.449290290E-005, 2.854541540E-008, -4.519552860E-012, -4.793589370E+004, 3.776870300E+001] ), NASA( [ 1390.00, 5000.00], [ 2.917732050E+001, 3.165747290E-002, -1.101316090E-005, 1.729428090E-009, -1.011394770E-013, -5.820619640E+004, -1.208414730E+002] ) ), note = "7/19/ 0 therm" ) species(name = "c7ket24xy1", atoms = " C:7 H:14 O:3 ", thermo = ( NASA( [ 300.00, 1391.00], [ 6.418827980E-003, 1.017595660E-001, -7.412859100E-005, 2.747918970E-008, -4.139847830E-012, -5.065600530E+004, 3.318727030E+001] ), NASA( [ 1391.00, 5000.00], [ 3.059860620E+001, 3.048309190E-002, -1.061692370E-005, 1.668631330E-009, -9.764620720E-014, -6.128568770E+004, -1.311579620E+002] ) ), note = "7/19/ 0 therm" ) species(name = "c7ket24xz", atoms = " C:7 H:14 O:3 ", thermo = ( NASA( [ 300.00, 1392.00], [-1.140603670E+000, 1.063562650E-001, -8.175957960E-005, 3.261053950E-008, -5.332018820E-012, -5.022898310E+004, 4.057575950E+001] ), NASA( [ 1392.00, 5000.00], [ 3.004997380E+001, 3.091092580E-002, -1.075492240E-005, 1.689082290E-009, -9.879000710E-014, -6.083713000E+004, -1.260801600E+002] ) ), note = "7/19/ 0 therm" ) species(name = "c7ket24xy2", atoms = " C:7 H:14 O:3 ", thermo = ( NASA( [ 300.00, 1391.00], [-6.227986000E-001, 1.055479470E-001, -8.203613190E-005, 3.339505590E-008, -5.597480120E-012, -5.101577190E+004, 3.620657270E+001] ), NASA( [ 1391.00, 5000.00], [ 2.992205070E+001, 3.103545400E-002, -1.080071320E-005, 1.696470160E-009, -9.922814090E-014, -6.138388800E+004, -1.268473990E+002] ) ), note = "7/19/ 0 therm" ) species(name = "c7ket24xx2", atoms = " C:7 H:14 O:3 ", thermo = ( NASA( [ 300.00, 1390.00], [-3.708424370E-001, 1.012070290E-001, -7.449290290E-005, 2.854541540E-008, -4.519552860E-012, -4.793589370E+004, 3.845818460E+001] ), NASA( [ 1390.00, 5000.00], [ 2.917732050E+001, 3.165747290E-002, -1.101316090E-005, 1.729428090E-009, -1.011394770E-013, -5.820619640E+004, -1.201519910E+002] ) ), note = "7/19/ 0 therm" ) species(name = "c7ket24zx", atoms = " C:7 H:14 O:3 ", thermo = ( NASA( [ 300.00, 1390.00], [-2.089435670E+000, 1.065079040E-001, -8.053003290E-005, 3.164951950E-008, -5.121497280E-012, -5.132072420E+004, 4.586487180E+001] ), NASA( [ 1390.00, 5000.00], [ 2.922987380E+001, 3.172115200E-002, -1.106003490E-005, 1.739414020E-009, -1.018312970E-013, -6.209241400E+004, -1.218616260E+002] ) ), note = "7/19/ 0 therm" ) species(name = "c7ket24zy", atoms = " C:7 H:14 O:3 ", thermo = ( NASA( [ 300.00, 1391.00], [-1.812469940E+000, 1.073973670E-001, -8.046195260E-005, 3.071205900E-008, -4.766477470E-012, -5.402353360E+004, 4.107702460E+001] ), NASA( [ 1391.00, 5000.00], [ 3.072019140E+001, 3.054145820E-002, -1.067396060E-005, 1.681468560E-009, -9.855572040E-014, -6.522332180E+004, -1.333207230E+002] ) ), note = "7/19/ 0 therm" ) species(name = "neoc7h16", atoms = " C:7 H:16 ", thermo = ( NASA( [ 300.00, 1397.00], [-3.457710370E+000, 9.720146460E-002, -6.832491640E-005, 2.482201020E-008, -3.677460040E-012, -2.797714080E+004, 4.108885150E+001] ), NASA( [ 1397.00, 5000.00], [ 2.393231720E+001, 3.317823620E-002, -1.126684940E-005, 1.740998070E-009, -1.006846650E-013, -3.744987890E+004, -1.059388320E+002] ) ), note = "4/11/ 1 therm" ) species(name = "nc7h15", atoms = " C:7 H:15 ", thermo = ( NASA( [ 300.00, 1397.00], [-2.687786420E+000, 9.264265840E-002, -6.583354700E-005, 2.417580970E-008, -3.618208340E-012, -3.364539080E+003, 4.076948850E+001] ), NASA( [ 1397.00, 5000.00], [ 2.351281710E+001, 3.103715400E-002, -1.053939550E-005, 1.628596560E-009, -9.418608270E-014, -1.238397460E+004, -9.973549600E+001] ) ), note = "4/11/ 1 therm" ) species(name = "oc7h15", atoms = " C:7 H:15 ", thermo = ( NASA( [ 300.00, 1390.00], [-2.196818320E+000, 8.731340790E-002, -5.636907030E-005, 1.776355520E-008, -2.128993520E-012, -4.679370820E+003, 3.861534670E+001] ), NASA( [ 1390.00, 5000.00], [ 2.336674060E+001, 3.073195550E-002, -1.035081070E-005, 1.591375190E-009, -9.173105630E-014, -1.376953770E+004, -9.962120120E+001] ) ), note = "4/11/ 1 therm" ) species(name = "pc7h15", atoms = " C:7 H:15 ", thermo = ( NASA( [ 300.00, 1390.00], [-2.196818320E+000, 8.731340790E-002, -5.636907030E-005, 1.776355520E-008, -2.128993520E-012, -4.679370820E+003, 3.861534670E+001] ), NASA( [ 1390.00, 5000.00], [ 2.336674060E+001, 3.073195550E-002, -1.035081070E-005, 1.591375190E-009, -9.173105630E-014, -1.376953770E+004, -9.962120120E+001] ) ), note = "4/11/ 1 therm" ) species(name = "qc7h15", atoms = " C:7 H:15 ", thermo = ( NASA( [ 300.00, 1397.00], [-2.687786420E+000, 9.264265840E-002, -6.583354700E-005, 2.417580970E-008, -3.618208340E-012, -3.364539080E+003, 3.967235710E+001] ), NASA( [ 1397.00, 5000.00], [ 2.351281710E+001, 3.103715400E-002, -1.053939550E-005, 1.628596560E-009, -9.418608270E-014, -1.238397460E+004, -1.008326270E+002] ) ), note = "4/11/ 1 therm" ) species(name = "oc7h14", atoms = " C:7 H:14 ", thermo = ( NASA( [ 300.00, 1395.00], [-3.315320000E+000, 9.055397140E-002, -6.483601160E-005, 2.392740570E-008, -3.589194180E-012, -1.355091730E+004, 4.084393380E+001] ), NASA( [ 1395.00, 5000.00], [ 2.248870150E+001, 2.967384000E-002, -1.004798790E-005, 1.549932150E-009, -8.953383180E-014, -2.239988220E+004, -9.743949790E+001] ) ), note = "4/11/ 1 therm" ) species(name = "pc7h14", atoms = " C:7 H:14 ", thermo = ( NASA( [ 300.00, 1398.00], [-3.818514140E+000, 9.393805340E-002, -6.993909360E-005, 2.698977450E-008, -4.239592240E-012, -1.254064770E+004, 4.332072770E+001] ), NASA( [ 1398.00, 5000.00], [ 2.281805670E+001, 2.947770780E-002, -9.996468340E-006, 1.543389940E-009, -8.920803810E-014, -2.151387510E+004, -9.885101080E+001] ) ), note = "4/11/ 1 therm" ) species(name = "pc7h13", atoms = " C:7 H:13 ", thermo = ( NASA( [ 300.00, 1395.00], [-3.831478590E+000, 9.094258880E-002, -6.759261480E-005, 2.587749930E-008, -4.035349260E-012, 4.437314660E+003, 4.227535780E+001] ), NASA( [ 1395.00, 5000.00], [ 2.261298940E+001, 2.774674370E-002, -9.538463740E-006, 1.486144900E-009, -8.644396850E-014, -4.575392070E+003, -9.919584520E+001] ) ), note = "4/11/ 1 therm" ) species(name = "nc7h15o2", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1392.00], [-7.287331370E-001, 9.913635940E-002, -7.236199120E-005, 2.808305490E-008, -4.553171780E-012, -2.185167840E+004, 3.474831790E+001] ), NASA( [ 1392.00, 5000.00], [ 2.687285400E+001, 3.364703480E-002, -1.160955000E-005, 1.812910390E-009, -1.056038100E-013, -3.143679800E+004, -1.132992390E+002] ) ), note = "4/11/ 1 therm" ) species(name = "oc7h15o2", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1394.00], [-1.733104150E+000, 1.053587150E-001, -8.131909240E-005, 3.324895570E-008, -5.617892460E-012, -2.410963710E+004, 3.754091190E+001] ), NASA( [ 1394.00, 5000.00], [ 2.772647440E+001, 3.293532640E-002, -1.136741210E-005, 1.775498920E-009, -1.034421000E-013, -3.406511640E+004, -1.195392510E+002] ) ), note = "4/11/ 1 therm" ) species(name = "pc7h15o2", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1394.00], [-1.733104150E+000, 1.053587150E-001, -8.131909240E-005, 3.324895570E-008, -5.617892460E-012, -2.410963710E+004, 3.754091190E+001] ), NASA( [ 1394.00, 5000.00], [ 2.772647440E+001, 3.293532640E-002, -1.136741210E-005, 1.775498920E-009, -1.034421000E-013, -3.406511640E+004, -1.195392510E+002] ) ), note = "4/11/ 1 therm" ) species(name = "qc7h15o2", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1392.00], [-7.287331370E-001, 9.913635940E-002, -7.236199120E-005, 2.808305490E-008, -4.553171780E-012, -2.185167840E+004, 3.365118660E+001] ), NASA( [ 1392.00, 5000.00], [ 2.687285400E+001, 3.364703480E-002, -1.160955000E-005, 1.812910390E-009, -1.056038100E-013, -3.143679800E+004, -1.143963700E+002] ) ), note = "4/11/ 1 therm" ) species(name = "nc7h15o2h", atoms = " C:7 H:16 O:2 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.757847670E+000, 1.082601490E-001, -8.094233790E-005, 3.160998980E-008, -5.086295530E-012, -3.869054370E+004, 3.882156410E+001] ), NASA( [ 1393.00, 5000.00], [ 2.935215070E+001, 3.378086750E-002, -1.168386910E-005, 1.827638530E-009, -1.065941180E-013, -4.935671840E+004, -1.276902460E+002] ) ), note = "4/11/ 1 therm" ) species(name = "oc7h15o2h", atoms = " C:7 H:16 O:2 ", thermo = ( NASA( [ 300.00, 1395.00], [-2.775033590E+000, 1.143275050E-001, -8.941807850E-005, 3.640993460E-008, -6.064610620E-012, -4.094136280E+004, 4.171505290E+001] ), NASA( [ 1395.00, 5000.00], [ 3.023870000E+001, 3.309824820E-002, -1.146443880E-005, 1.795095210E-009, -1.047695420E-013, -5.202412890E+004, -1.341803550E+002] ) ), note = "4/11/ 1 therm" ) species(name = "pc7h15o2h", atoms = " C:7 H:16 O:2 ", thermo = ( NASA( [ 300.00, 1395.00], [-2.775033590E+000, 1.143275050E-001, -8.941807850E-005, 3.640993460E-008, -6.064610620E-012, -4.094136280E+004, 4.171505290E+001] ), NASA( [ 1395.00, 5000.00], [ 3.023870000E+001, 3.309824820E-002, -1.146443880E-005, 1.795095210E-009, -1.047695420E-013, -5.202412890E+004, -1.341803550E+002] ) ), note = "4/11/ 1 therm" ) species(name = "qc7h15o2h", atoms = " C:7 H:16 O:2 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.757847670E+000, 1.082601490E-001, -8.094233790E-005, 3.160998980E-008, -5.086295530E-012, -3.869054370E+004, 3.772443270E+001] ), NASA( [ 1393.00, 5000.00], [ 2.935215070E+001, 3.378086750E-002, -1.168386910E-005, 1.827638530E-009, -1.065941180E-013, -4.935671840E+004, -1.287873770E+002] ) ), note = "4/11/ 1 therm" ) species(name = "nc7h15o", atoms = " C:7 H:15 O:1 ", thermo = ( NASA( [ 300.00, 1397.00], [-2.778321510E+000, 9.973928620E-002, -7.337445770E-005, 2.808078100E-008, -4.396202060E-012, -2.001543660E+004, 4.237554360E+001] ), NASA( [ 1397.00, 5000.00], [ 2.540931510E+001, 3.212846290E-002, -1.094855200E-005, 1.695765470E-009, -9.822757960E-014, -2.960135760E+004, -1.083386260E+002] ) ), note = "4/11/ 1 therm" ) species(name = "oc7h15o", atoms = " C:7 H:15 O:1 ", thermo = ( NASA( [ 300.00, 1401.00], [-3.302436720E+000, 1.041816700E-001, -8.037133030E-005, 3.228557740E-008, -5.280103350E-012, -2.220199250E+004, 4.290367120E+001] ), NASA( [ 1401.00, 5000.00], [ 2.602367750E+001, 3.153661680E-002, -1.072867910E-005, 1.659790660E-009, -9.606539920E-014, -3.192940660E+004, -1.130544600E+002] ) ), note = "4/11/ 1 therm" ) species(name = "pc7h15o", atoms = " C:7 H:15 O:1 ", thermo = ( NASA( [ 300.00, 1401.00], [-3.302436720E+000, 1.041816700E-001, -8.037133030E-005, 3.228557740E-008, -5.280103350E-012, -2.220199250E+004, 4.290367120E+001] ), NASA( [ 1401.00, 5000.00], [ 2.602367750E+001, 3.153661680E-002, -1.072867910E-005, 1.659790660E-009, -9.606539920E-014, -3.192940660E+004, -1.130544600E+002] ) ), note = "4/11/ 1 therm" ) species(name = "qc7h15o", atoms = " C:7 H:15 O:1 ", thermo = ( NASA( [ 300.00, 1397.00], [-2.778321510E+000, 9.973928620E-002, -7.337445770E-005, 2.808078100E-008, -4.396202060E-012, -2.001543660E+004, 4.127841220E+001] ), NASA( [ 1397.00, 5000.00], [ 2.540931510E+001, 3.212846290E-002, -1.094855200E-005, 1.695765470E-009, -9.822757960E-014, -2.960135760E+004, -1.094357580E+002] ) ), note = "4/11/ 1 therm" ) species(name = "nc7h14ooh-n2", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1393.00], [-9.497176090E-001, 1.035259710E-001, -7.819975300E-005, 3.082456650E-008, -4.999995420E-012, -1.408349550E+004, 3.723471730E+001] ), NASA( [ 1393.00, 5000.00], [ 2.891715010E+001, 3.167236990E-002, -1.097183120E-005, 1.718068710E-009, -1.002773280E-013, -2.428823540E+004, -1.224989520E+002] ) ), note = "4/11/ 1 trm" ) species(name = "nc7h14ooh-q", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1393.00], [-9.497176090E-001, 1.035259710E-001, -7.819975300E-005, 3.082456650E-008, -4.999995420E-012, -1.408349550E+004, 3.723471730E+001] ), NASA( [ 1393.00, 5000.00], [ 2.891715010E+001, 3.167236990E-002, -1.097183120E-005, 1.718068710E-009, -1.002773280E-013, -2.428823540E+004, -1.224989520E+002] ) ), note = "4/11/ 1 thrm" ) species(name = "qc7h14ooh-n", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1393.00], [-9.497176090E-001, 1.035259710E-001, -7.819975300E-005, 3.082456650E-008, -4.999995420E-012, -1.408349550E+004, 3.723471730E+001] ), NASA( [ 1393.00, 5000.00], [ 2.891715010E+001, 3.167236990E-002, -1.097183120E-005, 1.718068710E-009, -1.002773280E-013, -2.428823540E+004, -1.224989520E+002] ) ), note = "4/11/ 1 thrm" ) species(name = "nc7h14ooh-o", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1388.00], [-1.071470240E+000, 1.008270760E-001, -7.221775850E-005, 2.610259350E-008, -3.784494990E-012, -1.530499930E+004, 3.901986210E+001] ), NASA( [ 1388.00, 5000.00], [ 2.910059580E+001, 3.064031480E-002, -1.043644770E-005, 1.616936460E-009, -9.371256040E-014, -2.572617760E+004, -1.229861160E+002] ) ), note = "4/11/ 1 thrm" ) species(name = "nc7h14ooh-p", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1388.00], [-1.071470240E+000, 1.008270760E-001, -7.221775850E-005, 2.610259350E-008, -3.784494990E-012, -1.530499930E+004, 3.901986210E+001] ), NASA( [ 1388.00, 5000.00], [ 2.910059580E+001, 3.064031480E-002, -1.043644770E-005, 1.616936460E-009, -9.371256040E-014, -2.572617760E+004, -1.229861160E+002] ) ), note = "4/11/ 1 thrm" ) species(name = "qc7h14ooh-o", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1388.00], [-1.071470240E+000, 1.008270760E-001, -7.221775850E-005, 2.610259350E-008, -3.784494990E-012, -1.530499930E+004, 3.792273070E+001] ), NASA( [ 1388.00, 5000.00], [ 2.910059580E+001, 3.064031480E-002, -1.043644770E-005, 1.616936460E-009, -9.371256040E-014, -2.572617760E+004, -1.240832470E+002] ) ), note = "4/11/ 1 thrm" ) species(name = "qc7h14ooh-p", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1388.00], [-1.071470240E+000, 1.008270760E-001, -7.221775850E-005, 2.610259350E-008, -3.784494990E-012, -1.530499930E+004, 3.792273070E+001] ), NASA( [ 1388.00, 5000.00], [ 2.910059580E+001, 3.064031480E-002, -1.043644770E-005, 1.616936460E-009, -9.371256040E-014, -2.572617760E+004, -1.240832470E+002] ) ), note = "4/11/ 1 thrm" ) species(name = "oc7h14ooh-n", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1395.00], [-1.902082360E+000, 1.093933110E-001, -8.642809820E-005, 3.546665230E-008, -5.940248740E-012, -1.634664260E+004, 4.090093820E+001] ), NASA( [ 1395.00, 5000.00], [ 2.982076790E+001, 3.093715450E-002, -1.072596270E-005, 1.680545510E-009, -9.812861710E-014, -2.694972220E+004, -1.279638370E+002] ) ), note = "4/11/ 1 thrm" ) species(name = "oc7h14ooh-q", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1395.00], [-1.902082360E+000, 1.093933110E-001, -8.642809820E-005, 3.546665230E-008, -5.940248740E-012, -1.634664260E+004, 3.980380690E+001] ), NASA( [ 1395.00, 5000.00], [ 2.982076790E+001, 3.093715450E-002, -1.072596270E-005, 1.680545510E-009, -9.812861710E-014, -2.694972220E+004, -1.290609690E+002] ) ), note = "4/11/ 1 thrm" ) species(name = "pc7h14ooh-n", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1395.00], [-1.902082360E+000, 1.093933110E-001, -8.642809820E-005, 3.546665230E-008, -5.940248740E-012, -1.634664260E+004, 4.090093820E+001] ), NASA( [ 1395.00, 5000.00], [ 2.982076790E+001, 3.093715450E-002, -1.072596270E-005, 1.680545510E-009, -9.812861710E-014, -2.694972220E+004, -1.279638370E+002] ) ), note = "4/11/ 1 thrm" ) species(name = "pc7h14ooh-q", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1395.00], [-1.902082360E+000, 1.093933110E-001, -8.642809820E-005, 3.546665230E-008, -5.940248740E-012, -1.634664260E+004, 3.980380690E+001] ), NASA( [ 1395.00, 5000.00], [ 2.982076790E+001, 3.093715450E-002, -1.072596270E-005, 1.680545510E-009, -9.812861710E-014, -2.694972220E+004, -1.290609690E+002] ) ), note = "4/11/ 1 thrm" ) species(name = "oc7h14ooh-p", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1394.00], [-1.417999560E+000, 1.045682810E-001, -7.861402050E-005, 3.034047840E-008, -4.754443430E-012, -1.766964970E+004, 3.869828490E+001] ), NASA( [ 1394.00, 5000.00], [ 2.924507130E+001, 3.088807130E-002, -1.059427350E-005, 1.648373460E-009, -9.579576460E-014, -2.806192100E+004, -1.251694990E+002] ) ), note = "4/11/ 1 thrm" ) species(name = "pc7h14ooh-o", atoms = " C:7 H:15 O:2 ", thermo = ( NASA( [ 300.00, 1394.00], [-1.417999560E+000, 1.045682810E-001, -7.861402050E-005, 3.034047840E-008, -4.754443430E-012, -1.766964970E+004, 3.869828490E+001] ), NASA( [ 1394.00, 5000.00], [ 2.924507130E+001, 3.088807130E-002, -1.059427350E-005, 1.648373460E-009, -9.579576460E-014, -2.806192100E+004, -1.251694990E+002] ) ), note = "4/11/ 1 thrm" ) species(name = "nc7h14ooh-n2o2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1390.00], [ 2.712359320E-001, 1.130878850E-001, -8.871035080E-005, 3.667403340E-008, -6.258738730E-012, -3.245544620E+004, 3.465959570E+001] ), NASA( [ 1390.00, 5000.00], [ 3.274617080E+001, 3.338840140E-002, -1.163049640E-005, 1.827912820E-009, -1.069602550E-013, -4.346823400E+004, -1.385908310E+002] ) ), note = "4/11/ 1 m" ) species(name = "nc7h14ooh-qo2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1390.00], [ 2.712359320E-001, 1.130878850E-001, -8.871035080E-005, 3.667403340E-008, -6.258738730E-012, -3.245544620E+004, 3.465959570E+001] ), NASA( [ 1390.00, 5000.00], [ 3.274617080E+001, 3.338840140E-002, -1.163049640E-005, 1.827912820E-009, -1.069602550E-013, -4.346823400E+004, -1.385908310E+002] ) ), note = "4/11/ 1 tm" ) species(name = "qc7h14ooh-no2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1390.00], [ 2.712359320E-001, 1.130878850E-001, -8.871035080E-005, 3.667403340E-008, -6.258738730E-012, -3.245544620E+004, 3.465959570E+001] ), NASA( [ 1390.00, 5000.00], [ 3.274617080E+001, 3.338840140E-002, -1.163049640E-005, 1.827912820E-009, -1.069602550E-013, -4.346823400E+004, -1.385908310E+002] ) ), note = "4/11/ 1 tm" ) species(name = "nc7h14ooh-oo2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1392.00], [-4.633163420E-001, 1.181405750E-001, -9.613204670E-005, 4.095545660E-008, -7.134654360E-012, -3.475376980E+004, 3.729993600E+001] ), NASA( [ 1392.00, 5000.00], [ 3.348740080E+001, 3.272053180E-002, -1.139174700E-005, 1.789783640E-009, -1.047055490E-013, -4.602934160E+004, -1.430322760E+002] ) ), note = "4/11/ 1 tm" ) species(name = "nc7h14ooh-po2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1392.00], [-4.633163420E-001, 1.181405750E-001, -9.613204670E-005, 4.095545660E-008, -7.134654360E-012, -3.475376980E+004, 3.729993600E+001] ), NASA( [ 1392.00, 5000.00], [ 3.348740080E+001, 3.272053180E-002, -1.139174700E-005, 1.789783640E-009, -1.047055490E-013, -4.602934160E+004, -1.430322760E+002] ) ), note = "4/11/ 1 tm" ) species(name = "qc7h14ooh-oo2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1392.00], [-4.633163420E-001, 1.181405750E-001, -9.613204670E-005, 4.095545660E-008, -7.134654360E-012, -3.475376980E+004, 3.620280460E+001] ), NASA( [ 1392.00, 5000.00], [ 3.348740080E+001, 3.272053180E-002, -1.139174700E-005, 1.789783640E-009, -1.047055490E-013, -4.602934160E+004, -1.441294070E+002] ) ), note = "4/11/ 1 tm" ) species(name = "qc7h14ooh-po2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1392.00], [-4.633163420E-001, 1.181405750E-001, -9.613204670E-005, 4.095545660E-008, -7.134654360E-012, -3.475376980E+004, 3.620280460E+001] ), NASA( [ 1392.00, 5000.00], [ 3.348740080E+001, 3.272053180E-002, -1.139174700E-005, 1.789783640E-009, -1.047055490E-013, -4.602934160E+004, -1.441294070E+002] ) ), note = "4/11/ 1 tm" ) species(name = "oc7h14ooh-no2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1392.00], [-4.633163420E-001, 1.181405750E-001, -9.613204670E-005, 4.095545660E-008, -7.134654360E-012, -3.475376980E+004, 3.729993600E+001] ), NASA( [ 1392.00, 5000.00], [ 3.348740080E+001, 3.272053180E-002, -1.139174700E-005, 1.789783640E-009, -1.047055490E-013, -4.602934160E+004, -1.430322760E+002] ) ), note = "4/11/ 1 tm" ) species(name = "oc7h14ooh-qo2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1392.00], [-4.633163420E-001, 1.181405750E-001, -9.613204670E-005, 4.095545660E-008, -7.134654360E-012, -3.475376980E+004, 3.620280460E+001] ), NASA( [ 1392.00, 5000.00], [ 3.348740080E+001, 3.272053180E-002, -1.139174700E-005, 1.789783640E-009, -1.047055490E-013, -4.602934160E+004, -1.441294070E+002] ) ), note = "4/11/ 1 tm" ) species(name = "pc7h14ooh-no2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1392.00], [-4.633163420E-001, 1.181405750E-001, -9.613204670E-005, 4.095545660E-008, -7.134654360E-012, -3.475376980E+004, 3.729993600E+001] ), NASA( [ 1392.00, 5000.00], [ 3.348740080E+001, 3.272053180E-002, -1.139174700E-005, 1.789783640E-009, -1.047055490E-013, -4.602934160E+004, -1.430322760E+002] ) ), note = "4/11/ 1 tm" ) species(name = "pc7h14ooh-qo2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1392.00], [-4.633163420E-001, 1.181405750E-001, -9.613204670E-005, 4.095545660E-008, -7.134654360E-012, -3.475376980E+004, 3.620280460E+001] ), NASA( [ 1392.00, 5000.00], [ 3.348740080E+001, 3.272053180E-002, -1.139174700E-005, 1.789783640E-009, -1.047055490E-013, -4.602934160E+004, -1.441294070E+002] ) ), note = "4/11/ 1 tm" ) species(name = "oc7h14ooh-po2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1394.00], [-9.413225250E-001, 1.221713010E-001, -1.022389900E-004, 4.450908590E-008, -7.862603800E-012, -3.709340690E+004, 3.763384780E+001] ), NASA( [ 1394.00, 5000.00], [ 3.416588760E+001, 3.208991590E-002, -1.116218990E-005, 1.752699530E-009, -1.024956420E-013, -4.855259490E+004, -1.481770800E+002] ) ), note = "4/11/ 1 tm" ) species(name = "pc7h14ooh-oo2", atoms = " C:7 H:15 O:4 ", thermo = ( NASA( [ 300.00, 1394.00], [-9.413225250E-001, 1.221713010E-001, -1.022389900E-004, 4.450908590E-008, -7.862603800E-012, -3.709340690E+004, 3.763384780E+001] ), NASA( [ 1394.00, 5000.00], [ 3.416588760E+001, 3.208991590E-002, -1.116218990E-005, 1.752699530E-009, -1.024956420E-013, -4.855259490E+004, -1.481770800E+002] ) ), note = "4/11/ 1 tm" ) species(name = "n-nc7h14o", atoms = " C:7 H:14 O:1 ", thermo = ( NASA( [ 300.00, 1400.00], [-6.645569190E+000, 1.053737990E-001, -7.860002980E-005, 3.000198460E-008, -4.625262860E-012, -2.424400280E+004, 5.851155050E+001] ), NASA( [ 1400.00, 5000.00], [ 2.396006790E+001, 3.170810860E-002, -1.081642270E-005, 1.676670290E-009, -9.718353900E-014, -3.456591200E+004, -1.049391630E+002] ) ), note = "8/11/98 therm" ) species(name = "n-oc7h14o", atoms = " C:7 H:14 O:1 ", thermo = ( NASA( [ 300.00, 1403.00], [-6.885489490E+000, 1.085793320E-001, -8.403436760E-005, 3.352237970E-008, -5.416376330E-012, -2.647281350E+004, 5.882276190E+001] ), NASA( [ 1403.00, 5000.00], [ 2.431517040E+001, 3.161742210E-002, -1.082817690E-005, 1.682704480E-009, -9.769604060E-014, -3.683253480E+004, -1.071826830E+002] ) ), note = "8/11/98 therm" ) species(name = "n-pc7h14o", atoms = " C:7 H:14 O:1 ", thermo = ( NASA( [ 300.00, 1404.00], [-8.732579400E+000, 1.124217360E-001, -8.683009910E-005, 3.446186420E-008, -5.529562930E-012, -3.615051300E+004, 6.729566670E+001] ), NASA( [ 1404.00, 5000.00], [ 2.371904570E+001, 3.253592490E-002, -1.114284690E-005, 1.731644260E-009, -1.005399640E-013, -4.692891950E+004, -1.054014570E+002] ) ), note = "8/11/98 therm" ) species(name = "n-qc7h14o", atoms = " C:7 H:14 O:1 ", thermo = ( NASA( [ 300.00, 1397.00], [-9.125182920E+000, 1.113466440E-001, -8.194668280E-005, 3.049822440E-008, -4.557847930E-012, -3.596608440E+004, 6.528062200E+001] ), NASA( [ 1397.00, 5000.00], [ 2.405423670E+001, 3.280735310E-002, -1.126985680E-005, 1.755285590E-009, -1.020815640E-013, -4.728262530E+004, -1.123760380E+002] ) ), note = "8/11/98 therm" ) species(name = "o-pc7h14o", atoms = " C:7 H:14 O:1 ", thermo = ( NASA( [ 300.00, 1398.00], [-7.264933740E+000, 1.173287510E-001, -9.978360890E-005, 4.388675930E-008, -7.775826180E-012, -2.795239460E+004, 5.885325850E+001] ), NASA( [ 1398.00, 5000.00], [ 2.614577300E+001, 3.006563650E-002, -1.038655900E-005, 1.623450950E-009, -9.463519310E-014, -3.865061100E+004, -1.173424280E+002] ) ), note = "8/11/98 therm" ) species(name = "o-qc7h14o", atoms = " C:7 H:14 O:1 ", thermo = ( NASA( [ 300.00, 1403.00], [-6.885489490E+000, 1.085793320E-001, -8.403436760E-005, 3.352237970E-008, -5.416376330E-012, -2.647281350E+004, 5.772563060E+001] ), NASA( [ 1403.00, 5000.00], [ 2.431517040E+001, 3.161742210E-002, -1.082817690E-005, 1.682704480E-009, -9.769604060E-014, -3.683253480E+004, -1.082798140E+002] ) ), note = "8/11/98 therm" ) species(name = "p-qc7h14o", atoms = " C:7 H:14 O:1 ", thermo = ( NASA( [ 300.00, 1400.00], [-5.623283240E+000, 1.076836740E-001, -8.556838530E-005, 3.527794320E-008, -5.906420180E-012, -2.592332410E+004, 5.212804580E+001] ), NASA( [ 1400.00, 5000.00], [ 2.509078570E+001, 3.069053270E-002, -1.054204460E-005, 1.641458110E-009, -9.543006210E-014, -3.603993490E+004, -1.109217770E+002] ) ), note = "8/11/98 therm" ) species(name = "neoc7ketnn", atoms = " C:7 H:14 O:3 ", thermo = ( NASA( [ 300.00, 1392.00], [-6.528992630E-001, 1.048581180E-001, -7.926324210E-005, 3.086115610E-008, -4.911500220E-012, -4.794109480E+004, 3.770951340E+001] ), NASA( [ 1392.00, 5000.00], [ 3.043636740E+001, 3.057409630E-002, -1.063745770E-005, 1.670665380E-009, -9.771598170E-014, -5.858086720E+004, -1.286874590E+002] ) ), note = "4/11/ 1 therm" ) species(name = "neoc7ketno", atoms = " C:7 H:14 O:3 ", thermo = ( NASA( [ 300.00, 1394.00], [-1.502958130E+000, 1.102529510E-001, -8.679241120E-005, 3.508617940E-008, -5.763505390E-012, -5.021913760E+004, 4.022169970E+001] ), NASA( [ 1394.00, 5000.00], [ 3.131691380E+001, 2.987962390E-002, -1.041020370E-005, 1.636513100E-009, -9.578206980E-014, -6.123679320E+004, -1.347128260E+002] ) ), note = "4/11/ 1 therm" ) species(name = "neoc7ketnp", atoms = " C:7 H:14 O:3 ", thermo = ( NASA( [ 300.00, 1394.00], [-1.502958130E+000, 1.102529510E-001, -8.679241120E-005, 3.508617940E-008, -5.763505390E-012, -5.021913760E+004, 4.022169970E+001] ), NASA( [ 1394.00, 5000.00], [ 3.131691380E+001, 2.987962390E-002, -1.041020370E-005, 1.636513100E-009, -9.578206980E-014, -6.123679320E+004, -1.347128260E+002] ) ), note = "4/11/ 1 therm" ) species(name = "neoc7ketnq", atoms = " C:7 H:14 O:3 ", thermo = ( NASA( [ 300.00, 1392.00], [-6.528992630E-001, 1.048581180E-001, -7.926324210E-005, 3.086115610E-008, -4.911500220E-012, -4.794109480E+004, 3.702003180E+001] ), NASA( [ 1392.00, 5000.00], [ 3.043636740E+001, 3.057409630E-002, -1.063745770E-005, 1.670665380E-009, -9.771598170E-014, -5.858086720E+004, -1.293769400E+002] ) ), note = "4/11/ 1 therm" ) species(name = "neoc7keton", atoms = " C:7 H:14 O:3 ", thermo = ( NASA( [ 300.00, 1389.00], [-7.587912310E-001, 1.056569870E-001, -8.173939250E-005, 3.309835170E-008, -5.525391520E-012, -5.187293160E+004, 3.702373950E+001] ), NASA( [ 1389.00, 5000.00], [ 3.000663670E+001, 3.102903600E-002, -1.081375270E-005, 1.700155980E-009, -9.951148300E-014, -6.236403170E+004, -1.273681940E+002] ) ), note = "4/11/ 1 therm" ) species(name = "neoc7ketop", atoms = " C:7 H:14 O:3 ", thermo = ( NASA( [ 300.00, 1393.00], [-3.945190080E+000, 1.201445700E-001, -1.010412630E-004, 4.381556860E-008, -7.682806190E-012, -5.324333950E+004, 5.047910880E+001] ), NASA( [ 1393.00, 5000.00], [ 3.127859290E+001, 3.003003930E-002, -1.048822180E-005, 1.651416090E-009, -9.676015810E-014, -6.473573560E+004, -1.359911400E+002] ) ), note = "4/11/ 1 therm" ) species(name = "neoc7ketoq", atoms = " C:7 H:14 O:3 ", thermo = ( NASA( [ 300.00, 1389.00], [-7.587912310E-001, 1.056569870E-001, -8.173939250E-005, 3.309835170E-008, -5.525391520E-012, -5.187293160E+004, 3.592660820E+001] ), NASA( [ 1389.00, 5000.00], [ 3.000663670E+001, 3.102903600E-002, -1.081375270E-005, 1.700155980E-009, -9.951148300E-014, -6.236403170E+004, -1.284653260E+002] ) ), note = "4/11/ 1 therm" ) species(name = "neoc7ketpn", atoms = " C:7 H:14 O:3 ", thermo = ( NASA( [ 300.00, 1389.00], [ 1.760546920E-001, 1.018758350E-001, -7.671323950E-005, 3.023327750E-008, -4.929232630E-012, -5.247556490E+004, 3.243420960E+001] ), NASA( [ 1389.00, 5000.00], [ 2.982984810E+001, 3.112351000E-002, -1.083372210E-005, 1.701935020E-009, -9.956018350E-014, -6.270498830E+004, -1.264350850E+002] ) ), note = "4/11/ 1 therm" ) species(name = "neoc7ketpo", atoms = " C:7 H:14 O:3 ", thermo = ( NASA( [ 300.00, 1393.00], [-2.847038480E+000, 1.154723180E-001, -9.462426450E-005, 4.008481270E-008, -6.897063770E-012, -5.386572250E+004, 4.517026540E+001] ), NASA( [ 1393.00, 5000.00], [ 3.105815410E+001, 3.017303860E-002, -1.052744480E-005, 1.656460840E-009, -9.700949590E-014, -6.506816140E+004, -1.348242160E+002] ) ), note = "4/11/ 1 therm" ) species(name = "neoc7ketpq", atoms = " C:7 H:14 O:3 ", thermo = ( NASA( [ 300.00, 1386.00], [ 2.019669830E+000, 9.610299590E-002, -7.040734020E-005, 2.730918900E-008, -4.438017030E-012, -5.288424480E+004, 2.297807700E+001] ), NASA( [ 1386.00, 5000.00], [ 2.966229530E+001, 3.131098050E-002, -1.090775200E-005, 1.714413810E-009, -1.003224690E-013, -6.259475250E+004, -1.256274770E+002] ) ), note = "4/11/ 1 therm" ) species(name = "neoc7ketqn", atoms = " C:7 H:14 O:3 ", thermo = ( NASA( [ 300.00, 1390.00], [ 4.931207730E-001, 1.024164230E-001, -7.838261970E-005, 3.140414060E-008, -5.188347160E-012, -4.877180480E+004, 3.107441810E+001] ), NASA( [ 1390.00, 5000.00], [ 3.014434160E+001, 3.074301330E-002, -1.067700340E-005, 1.674790290E-009, -9.787018610E-014, -5.889518690E+004, -1.274309870E+002] ) ), note = "4/11/ 1 therm" ) species(name = "neoc7ketqo", atoms = " C:7 H:14 O:3 ", thermo = ( NASA( [ 300.00, 1392.00], [ 2.368019170E-001, 1.055827640E-001, -8.352358440E-005, 3.455170690E-008, -5.860709610E-012, -5.114687690E+004, 3.036350450E+001] ), NASA( [ 1392.00, 5000.00], [ 3.068268030E+001, 3.030409620E-002, -1.052913700E-005, 1.652036750E-009, -9.655726520E-014, -6.136698690E+004, -1.317814710E+002] ) ), note = "4/11/ 1 therm" ) species(name = "neoc7ketqp", atoms = " C:7 H:14 O:3 ", thermo = ( NASA( [ 300.00, 1394.00], [-2.154203880E+000, 1.142303200E-001, -9.364592690E-005, 3.964354910E-008, -6.806975530E-012, -5.021513880E+004, 4.209684440E+001] ), NASA( [ 1394.00, 5000.00], [ 3.130390660E+001, 2.986161700E-002, -1.039680830E-005, 1.633613450E-009, -9.557859010E-014, -6.123473570E+004, -1.354284900E+002] ) ), note = "4/11/ 1 therm" ) species(name = "ic8h18", atoms = " C:8 H:18 ", thermo = ( NASA( [ 300.00, 1396.00], [-4.208688930E+000, 1.114405810E-001, -7.913465820E-005, 2.924062420E-008, -4.437431910E-012, -2.994468750E+004, 4.495217010E+001] ), NASA( [ 1396.00, 5000.00], [ 2.713735900E+001, 3.790048900E-002, -1.294373580E-005, 2.007603720E-009, -1.164005800E-013, -4.079581770E+004, -1.232774950E+002] ) ), note = "7/20/ 0 therm" ) species(name = "ac8h17", atoms = " C:8 H:17 ", thermo = ( NASA( [ 300.00, 1396.00], [-3.419447410E+000, 1.068031890E-001, -7.654115630E-005, 2.853416820E-008, -4.364786490E-012, -5.335141960E+003, 4.454717270E+001] ), NASA( [ 1396.00, 5000.00], [ 2.670697820E+001, 3.576606010E-002, -1.221787040E-005, 1.895366300E-009, -1.099078430E-013, -1.572296920E+004, -1.170011130E+002] ) ), note = "7/20/ 0 therm" ) species(name = "bc8h17", atoms = " C:8 H:17 ", thermo = ( NASA( [ 300.00, 1393.00], [-3.091042620E+000, 1.023188960E-001, -6.848588730E-005, 2.301839400E-008, -3.070130800E-012, -6.628290690E+003, 4.311739320E+001] ), NASA( [ 1393.00, 5000.00], [ 2.645691790E+001, 3.554207520E-002, -1.205209840E-005, 1.860893570E-009, -1.075718940E-013, -1.703927910E+004, -1.162455110E+002] ) ), note = "7/20/ 0 therm" ) species(name = "cc8h17", atoms = " C:8 H:17 ", thermo = ( NASA( [ 300.00, 1390.00], [-9.731596970E-002, 8.926537240E-002, -5.128738140E-005, 1.376405280E-008, -1.277883960E-012, -8.811473020E+003, 2.897918980E+001] ), NASA( [ 1390.00, 5000.00], [ 2.514971580E+001, 3.710968450E-002, -1.268544830E-005, 1.968734290E-009, -1.141938940E-013, -1.827617900E+004, -1.090568340E+002] ) ), note = "7/20/ 0 therm" ) species(name = "dc8h17", atoms = " C:8 H:17 ", thermo = ( NASA( [ 300.00, 1396.00], [-3.419447410E+000, 1.068031890E-001, -7.654115630E-005, 2.853416820E-008, -4.364786490E-012, -5.737758970E+003, 4.345004140E+001] ), NASA( [ 1396.00, 5000.00], [ 2.670697820E+001, 3.576606010E-002, -1.221787040E-005, 1.895366300E-009, -1.099078430E-013, -1.612558620E+004, -1.180982450E+002] ) ), note = "7/20/ 0 therm" ) species(name = "ic8h16", atoms = " C:8 H:16 ", thermo = ( NASA( [ 300.00, 1394.00], [-2.796104470E+000, 1.008361720E-001, -7.122506510E-005, 2.606598240E-008, -3.900318140E-012, -1.640024960E+004, 3.888540680E+001] ), NASA( [ 1394.00, 5000.00], [ 2.567567460E+001, 3.418019980E-002, -1.160029520E-005, 1.791954780E-009, -1.036130020E-013, -2.624583240E+004, -1.139282730E+002] ) ), note = "7/20/ 0 therm" ) species(name = "jc8h16", atoms = " C:8 H:16 ", thermo = ( NASA( [ 300.00, 1397.00], [-3.318621220E+000, 1.043153050E-001, -7.647630130E-005, 2.921692190E-008, -4.569138620E-012, -1.654482500E+004, 4.145482530E+001] ), NASA( [ 1397.00, 5000.00], [ 2.601015270E+001, 3.397032430E-002, -1.154224510E-005, 1.784228140E-009, -1.032122000E-013, -2.651745350E+004, -1.153591950E+002] ) ), note = "7/20/ 0 therm" ) species(name = "ic8h14", atoms = " C:8 H:14 ", thermo = ( NASA( [ 300.00, 1393.00], [-7.259377930E-001, 8.750038790E-002, -6.091476030E-005, 2.251819210E-008, -3.480980170E-012, -1.526627980E+003, 3.315510780E+001] ), NASA( [ 1393.00, 5000.00], [ 2.311220570E+001, 3.200681670E-002, -1.091462250E-005, 1.691053440E-009, -9.796890820E-014, -9.886355880E+003, -9.504213300E+001] ) ), note = "7/27/95 therm" ) species(name = "ic8h15", atoms = " C:8 H:15 ", thermo = ( NASA( [ 300.00, 1397.00], [-3.749879460E+000, 1.054764760E-001, -8.127819610E-005, 3.262717030E-008, -5.337836060E-012, 1.922495180E+003, 4.314161850E+001] ), NASA( [ 1397.00, 5000.00], [ 2.609313370E+001, 3.176297400E-002, -1.078003580E-005, 1.665340770E-009, -9.629855040E-014, -8.003121550E+003, -1.156514750E+002] ) ), note = "7/20/ 0 therm" ) species(name = "ac8h17o2", atoms = " C:8 H:17 O:2 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.786140720E+000, 1.147549030E-001, -8.506047190E-005, 3.340409350E-008, -5.451732280E-012, -2.377420560E+004, 4.002755140E+001] ), NASA( [ 1393.00, 5000.00], [ 3.028159580E+001, 3.787290720E-002, -1.304683830E-005, 2.035242130E-009, -1.184712670E-013, -3.480324620E+004, -1.316470360E+002] ) ), note = "7/20/ 0 therm" ) species(name = "bc8h17o2", atoms = " C:8 H:17 O:2 ", thermo = ( NASA( [ 300.00, 1394.00], [-3.070023560E+000, 1.226404380E-001, -9.722027640E-005, 4.091276250E-008, -7.091025470E-012, -2.640143080E+004, 4.403456910E+001] ), NASA( [ 1394.00, 5000.00], [ 3.093516150E+001, 3.741025640E-002, -1.290709700E-005, 2.015448500E-009, -1.173989110E-013, -3.774577530E+004, -1.367308000E+002] ) ), note = "7/20/ 0 therm" ) species(name = "cc8h17o2", atoms = " C:8 H:17 O:2 ", thermo = ( NASA( [ 300.00, 1394.00], [-1.801437660E+000, 1.180305110E-001, -9.106309660E-005, 3.734803610E-008, -6.339993070E-012, -2.688920490E+004, 3.627164250E+001] ), NASA( [ 1394.00, 5000.00], [ 3.097216950E+001, 3.733660820E-002, -1.287241790E-005, 2.009074640E-009, -1.169890720E-013, -3.796488550E+004, -1.384564460E+002] ) ), note = "7/20/ 0 therm" ) species(name = "dc8h17o2", atoms = " C:8 H:17 O:2 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.786140720E+000, 1.147549030E-001, -8.506047190E-005, 3.340409350E-008, -5.451732280E-012, -2.377420560E+004, 3.893042000E+001] ), NASA( [ 1393.00, 5000.00], [ 3.028159580E+001, 3.787290720E-002, -1.304683830E-005, 2.035242130E-009, -1.184712670E-013, -3.480324620E+004, -1.327441670E+002] ) ), note = "7/20/ 0 therm" ) species(name = "ac8h17o2h", atoms = " C:8 H:18 O:2 ", thermo = ( NASA( [ 300.00, 1394.00], [-2.605901670E+000, 1.229752460E-001, -9.237924220E-005, 3.623520360E-008, -5.849141820E-012, -4.064516920E+004, 4.312715430E+001] ), NASA( [ 1394.00, 5000.00], [ 3.268774710E+001, 3.815433480E-002, -1.319040180E-005, 2.062641640E-009, -1.202732960E-013, -5.270611570E+004, -1.456493720E+002] ) ), note = "7/20/ 0 therm" ) species(name = "bc8h17o2h", atoms = " C:8 H:18 O:2 ", thermo = ( NASA( [ 300.00, 1395.00], [-3.941366390E+000, 1.310087510E-001, -1.046754640E-004, 4.377133590E-008, -7.483956360E-012, -4.326244320E+004, 4.738975910E+001] ), NASA( [ 1395.00, 5000.00], [ 3.337958390E+001, 3.760751900E-002, -1.301065070E-005, 2.035495690E-009, -1.187291870E-013, -5.566062290E+004, -1.509406820E+002] ) ), note = "7/20/ 0 therm" ) species(name = "cc8h17o2h", atoms = " C:8 H:18 O:2 ", thermo = ( NASA( [ 300.00, 1394.00], [-2.845053940E+000, 1.272000280E-001, -9.970248410E-005, 4.091140720E-008, -6.881498510E-012, -4.372532520E+004, 4.041619930E+001] ), NASA( [ 1394.00, 5000.00], [ 3.344926630E+001, 3.747608590E-002, -1.294952890E-005, 2.024327180E-009, -1.180135200E-013, -5.588594370E+004, -1.528394410E+002] ) ), note = "7/20/ 0 therm" ) species(name = "dc8h17o2h", atoms = " C:8 H:18 O:2 ", thermo = ( NASA( [ 300.00, 1394.00], [-2.605901670E+000, 1.229752460E-001, -9.237924220E-005, 3.623520360E-008, -5.849141820E-012, -4.064516920E+004, 4.203002300E+001] ), NASA( [ 1394.00, 5000.00], [ 3.268774710E+001, 3.815433480E-002, -1.319040180E-005, 2.062641640E-009, -1.202732960E-013, -5.270611570E+004, -1.467465040E+002] ) ), note = "7/20/ 0 therm" ) species(name = "ac8h17o", atoms = " C:8 H:17 O:1 ", thermo = ( NASA( [ 300.00, 1398.00], [-3.804913120E+000, 1.151846090E-001, -8.576141850E-005, 3.318779270E-008, -5.244753930E-012, -2.194180530E+004, 4.751879200E+001] ), NASA( [ 1398.00, 5000.00], [ 2.883439330E+001, 3.634031460E-002, -1.238140950E-005, 1.917481020E-009, -1.110632190E-013, -3.297771320E+004, -1.267866530E+002] ) ), note = "7/20/ 0 therm" ) species(name = "bc8h17o", atoms = " C:8 H:17 O:1 ", thermo = ( NASA( [ 300.00, 1400.00], [-3.966853530E+000, 1.181501020E-001, -9.090876270E-005, 3.655949000E-008, -6.007798780E-012, -2.418545160E+004, 4.634361170E+001] ), NASA( [ 1400.00, 5000.00], [ 2.919965550E+001, 3.624350160E-002, -1.239169840E-005, 1.923360950E-009, -1.115699600E-013, -3.524476580E+004, -1.301818340E+002] ) ), note = "7/20/ 0 therm" ) species(name = "cc8h17o", atoms = " C:8 H:17 O:1 ", thermo = ( NASA( [ 300.00, 1398.00], [-3.831876370E+000, 1.185815540E-001, -9.208897480E-005, 3.743152330E-008, -6.217234190E-012, -2.545901820E+004, 4.426311320E+001] ), NASA( [ 1398.00, 5000.00], [ 2.944594290E+001, 3.594164310E-002, -1.226873640E-005, 1.902335930E-009, -1.102756750E-013, -3.651647170E+004, -1.327047000E+002] ) ), note = "7/20/ 0 therm" ) species(name = "dc8h17o", atoms = " C:8 H:17 O:1 ", thermo = ( NASA( [ 300.00, 1398.00], [-3.804913120E+000, 1.151846090E-001, -8.576141850E-005, 3.318779270E-008, -5.244753930E-012, -2.194180530E+004, 4.711114230E+001] ), NASA( [ 1398.00, 5000.00], [ 2.883439330E+001, 3.634031460E-002, -1.238140950E-005, 1.917481020E-009, -1.110632190E-013, -3.297771320E+004, -1.271943020E+002] ) ), note = "7/20/ 0 therm" ) species(name = "ac8h16ooh-a", atoms = " C:8 H:17 O:2 ", thermo = ( NASA( [ 300.00, 1394.00], [-1.849007270E+000, 1.184703760E-001, -8.996091270E-005, 3.562836740E-008, -5.797431510E-012, -1.643312590E+004, 4.177172950E+001] ), NASA( [ 1394.00, 5000.00], [ 3.227336660E+001, 3.600359140E-002, -1.245846430E-005, 1.949422560E-009, -1.137224190E-013, -2.804433910E+004, -1.405710520E+002] ) ), note = "7/20/ 0 thrm" ) species(name = "ac8h16ooh-b", atoms = " C:8 H:17 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [-2.069127300E+000, 1.161421390E-001, -8.440267270E-005, 3.106893990E-008, -4.598803030E-012, -1.763834550E+004, 4.402928480E+001] ), NASA( [ 1390.00, 5000.00], [ 3.255109430E+001, 3.479867320E-002, -1.184445900E-005, 1.834158780E-009, -1.062632550E-013, -2.951198900E+004, -1.415682600E+002] ) ), note = "7/20/ 0 thrm" ) species(name = "ac8h16ooh-c", atoms = " C:8 H:17 O:2 ", thermo = ( NASA( [ 300.00, 1389.00], [ 1.378225610E+000, 1.013635460E-001, -6.535029930E-005, 2.124868150E-008, -2.794526490E-012, -1.914046170E+004, 2.773837600E+001] ), NASA( [ 1389.00, 5000.00], [ 3.072627810E+001, 3.732786520E-002, -1.291710840E-005, 2.021169220E-009, -1.179051430E-013, -2.984472030E+004, -1.315840730E+002] ) ), note = "7/20/ 0 thrm" ) species(name = "ac8h16ooh-d", atoms = " C:8 H:17 O:2 ", thermo = ( NASA( [ 300.00, 1394.00], [-1.849007270E+000, 1.184703760E-001, -8.996091270E-005, 3.562836740E-008, -5.797431510E-012, -1.643312590E+004, 4.177172950E+001] ), NASA( [ 1394.00, 5000.00], [ 3.227336660E+001, 3.600359140E-002, -1.245846430E-005, 1.949422560E-009, -1.137224190E-013, -2.804433910E+004, -1.405710520E+002] ) ), note = "7/20/ 0 thrm" ) species(name = "bc8h16ooh-c", atoms = " C:8 H:17 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [ 4.502029860E-001, 1.071393720E-001, -7.317978890E-005, 2.552275510E-008, -3.636012010E-012, -2.140964220E+004, 3.018641970E+001] ), NASA( [ 1390.00, 5000.00], [ 3.176415220E+001, 3.649925270E-002, -1.264384430E-005, 1.979892450E-009, -1.155596720E-013, -3.256831150E+004, -1.389352140E+002] ) ), note = "7/20/ 0 thrm" ) species(name = "bc8h16ooh-a", atoms = " C:8 H:17 O:2 ", thermo = ( NASA( [ 300.00, 1395.00], [-3.222078710E+000, 1.266356350E-001, -1.024267090E-004, 4.325577140E-008, -7.449900970E-012, -1.864110040E+004, 4.731824930E+001] ), NASA( [ 1395.00, 5000.00], [ 3.296497950E+001, 3.545215260E-002, -1.227606970E-005, 1.921756020E-009, -1.121436690E-013, -3.059662480E+004, -1.447601310E+002] ) ), note = "7/20/ 0 thrm" ) species(name = "bc8h16ooh-d", atoms = " C:8 H:17 O:2 ", thermo = ( NASA( [ 300.00, 1395.00], [-3.222078710E+000, 1.266356350E-001, -1.024267090E-004, 4.325577140E-008, -7.449900970E-012, -1.864110040E+004, 4.622111790E+001] ), NASA( [ 1395.00, 5000.00], [ 3.296497950E+001, 3.545215260E-002, -1.227606970E-005, 1.921756020E-009, -1.121436690E-013, -3.059662480E+004, -1.458572630E+002] ) ), note = "7/20/ 0 thrm" ) species(name = "cc8h16ooh-d", atoms = " C:8 H:17 O:2 ", thermo = ( NASA( [ 300.00, 1394.00], [-2.057512700E+000, 1.225658020E-001, -9.710439240E-005, 4.020462140E-008, -6.810029510E-012, -1.911545290E+004, 3.892261520E+001] ), NASA( [ 1394.00, 5000.00], [ 3.302527620E+001, 3.534418530E-002, -1.222637150E-005, 1.912709470E-009, -1.115650170E-013, -3.081892540E+004, -1.477041690E+002] ) ), note = "7/20/ 0 thrm" ) species(name = "cc8h16ooh-b", atoms = " C:8 H:17 O:2 ", thermo = ( NASA( [ 300.00, 1391.00], [-2.106153580E+000, 1.194863530E-001, -9.049735440E-005, 3.511275590E-008, -5.519470720E-012, -2.034666720E+004, 4.037999940E+001] ), NASA( [ 1391.00, 5000.00], [ 3.316080870E+001, 3.444004310E-002, -1.175243420E-005, 1.822824320E-009, -1.057176580E-013, -3.225206160E+004, -1.479572900E+002] ) ), note = "7/20/ 0 thrm" ) species(name = "cc8h16ooh-a", atoms = " C:8 H:17 O:2 ", thermo = ( NASA( [ 300.00, 1394.00], [-2.057512700E+000, 1.225658020E-001, -9.710439240E-005, 4.020462140E-008, -6.810029510E-012, -1.911545290E+004, 4.001974650E+001] ), NASA( [ 1394.00, 5000.00], [ 3.302527620E+001, 3.534418530E-002, -1.222637150E-005, 1.912709470E-009, -1.115650170E-013, -3.081892540E+004, -1.466070380E+002] ) ), note = "7/20/ 0 thrm" ) species(name = "dc8h16ooh-c", atoms = " C:8 H:17 O:2 ", thermo = ( NASA( [ 300.00, 1389.00], [ 1.378225610E+000, 1.013635460E-001, -6.535029930E-005, 2.124868150E-008, -2.794526490E-012, -1.873784470E+004, 2.733575890E+001] ), NASA( [ 1389.00, 5000.00], [ 3.072627810E+001, 3.732786520E-002, -1.291710840E-005, 2.021169220E-009, -1.179051430E-013, -2.944210330E+004, -1.319866900E+002] ) ), note = "7/20/ 0 thrm" ) species(name = "dc8h16ooh-d", atoms = " C:8 H:17 O:2 ", thermo = ( NASA( [ 300.00, 1394.00], [-1.849007270E+000, 1.184703760E-001, -8.996091270E-005, 3.562836740E-008, -5.797431510E-012, -1.603050890E+004, 4.067459810E+001] ), NASA( [ 1394.00, 5000.00], [ 3.227336660E+001, 3.600359140E-002, -1.245846430E-005, 1.949422560E-009, -1.137224190E-013, -2.764172210E+004, -1.416681840E+002] ) ), note = "7/20/ 0 thrm" ) species(name = "dc8h16ooh-b", atoms = " C:8 H:17 O:2 ", thermo = ( NASA( [ 300.00, 1390.00], [-2.069127300E+000, 1.161421390E-001, -8.440267270E-005, 3.106893990E-008, -4.598803030E-012, -1.723572850E+004, 4.293215340E+001] ), NASA( [ 1390.00, 5000.00], [ 3.255109430E+001, 3.479867320E-002, -1.184445900E-005, 1.834158780E-009, -1.062632550E-013, -2.910937200E+004, -1.426653920E+002] ) ), note = "7/20/ 0 thrm" ) species(name = "dc8h16ooh-a", atoms = " C:8 H:17 O:2 ", thermo = ( NASA( [ 300.00, 1394.00], [-1.849007270E+000, 1.184703760E-001, -8.996091270E-005, 3.562836740E-008, -5.797431510E-012, -1.603050890E+004, 4.177172950E+001] ), NASA( [ 1394.00, 5000.00], [ 3.227336660E+001, 3.600359140E-002, -1.245846430E-005, 1.949422560E-009, -1.137224190E-013, -2.764172210E+004, -1.405710520E+002] ) ), note = "7/20/ 0 thrm" ) species(name = "ic8eteraa", atoms = " C:8 H:16 O:1 ", thermo = ( NASA( [ 300.00, 1402.00], [-5.829962790E+000, 1.177087200E-001, -8.974283560E-005, 3.534456080E-008, -5.640337580E-012, -2.611967920E+004, 5.530228940E+001] ), NASA( [ 1402.00, 5000.00], [ 2.766096200E+001, 3.543749210E-002, -1.202704630E-005, 1.857810530E-009, -1.074160320E-013, -3.725601560E+004, -1.229799490E+002] ) ), note = "8/11/98 therm" ) species(name = "ic8eterab", atoms = " C:8 H:16 O:1 ", thermo = ( NASA( [ 300.00, 1403.00], [-7.800490410E+000, 1.235808770E-001, -9.586215290E-005, 3.835452620E-008, -6.217614280E-012, -2.881976490E+004, 6.344000530E+001] ), NASA( [ 1403.00, 5000.00], [ 2.767980140E+001, 3.593230060E-002, -1.230726570E-005, 1.912692080E-009, -1.110542540E-013, -4.059121340E+004, -1.252956950E+002] ) ), note = "8/11/98 therm" ) species(name = "ic8eterac", atoms = " C:8 H:16 O:1 ", thermo = ( NASA( [ 300.00, 1401.00], [-9.591872840E+000, 1.282364770E-001, -1.003264840E-004, 4.038849560E-008, -6.573337250E-012, -4.056570720E+004, 6.949553430E+001] ), NASA( [ 1401.00, 5000.00], [ 2.742475960E+001, 3.639221710E-002, -1.242915230E-005, 1.928152830E-009, -1.118184550E-013, -5.279138420E+004, -1.272460440E+002] ) ), note = "8/11/98 therm" ) species(name = "ic8eterad", atoms = " C:8 H:16 O:1 ", thermo = ( NASA( [ 300.00, 1397.00], [-1.008985510E+001, 1.265321070E-001, -9.397746150E-005, 3.539874720E-008, -5.363095520E-012, -3.946226460E+004, 7.082394470E+001] ), NASA( [ 1397.00, 5000.00], [ 2.746979250E+001, 3.702470380E-002, -1.270404720E-005, 1.977151130E-009, -1.149236060E-013, -5.221368670E+004, -1.300749960E+002] ) ), note = "8/11/98 therm" ) species(name = "ic8eterbc", atoms = " C:8 H:16 O:1 ", thermo = ( NASA( [ 300.00, 1401.00], [-6.528432920E+000, 1.258637080E-001, -1.033095360E-004, 4.395896230E-008, -7.561383220E-012, -3.179169010E+004, 5.442696450E+001] ), NASA( [ 1401.00, 5000.00], [ 2.913147510E+001, 3.437740140E-002, -1.179230550E-005, 1.834433680E-009, -1.065800970E-013, -4.332908830E+004, -1.341372700E+002] ) ), note = "8/11/98 therm" ) species(name = "ic8eterbd", atoms = " C:8 H:16 O:1 ", thermo = ( NASA( [ 300.00, 1403.00], [-7.800490410E+000, 1.235808770E-001, -9.586215290E-005, 3.835452620E-008, -6.217614280E-012, -2.881976490E+004, 6.234287390E+001] ), NASA( [ 1403.00, 5000.00], [ 2.767980140E+001, 3.593230060E-002, -1.230726570E-005, 1.912692080E-009, -1.110542540E-013, -4.059121340E+004, -1.263928260E+002] ) ), note = "8/11/98 therm" ) species(name = "ic8etercd", atoms = " C:8 H:16 O:1 ", thermo = ( NASA( [ 300.00, 1400.00], [-5.786844650E+000, 1.206805360E-001, -9.528277890E-005, 3.898166430E-008, -6.470078800E-012, -2.924210130E+004, 5.243865220E+001] ), NASA( [ 1400.00, 5000.00], [ 2.864139610E+001, 3.459201540E-002, -1.182407090E-005, 1.835173550E-009, -1.064581930E-013, -4.058131260E+004, -1.303679260E+002] ) ), note = "8/11/98 therm" ) species(name = "ic8eterdd", atoms = " C:8 H:16 O:1 ", thermo = ( NASA( [ 300.00, 1400.00], [-7.586985920E+000, 1.204734100E-001, -9.052715860E-005, 3.485758220E-008, -5.424240350E-012, -2.618398980E+004, 6.215713450E+001] ), NASA( [ 1400.00, 5000.00], [ 2.735561380E+001, 3.596381950E-002, -1.226821610E-005, 1.901711080E-009, -1.102269100E-013, -3.793026630E+004, -1.243152870E+002] ) ), note = "8/11/98 therm" ) species(name = "ac8h16ooh-ao2", atoms = " C:8 H:17 O:4 ", thermo = ( NASA( [ 300.00, 1391.00], [-5.135690520E-001, 1.274974360E-001, -9.967839580E-005, 4.099767570E-008, -6.952798470E-012, -3.441892770E+004, 3.867760620E+001] ), NASA( [ 1391.00, 5000.00], [ 3.607946090E+001, 3.774941660E-002, -1.312954330E-005, 2.061415390E-009, -1.205386370E-013, -4.681424190E+004, -1.565293220E+002] ) ), note = "7/20/ 0 tm" ) species(name = "ac8h16ooh-bo2", atoms = " C:8 H:17 O:4 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.293165490E+000, 1.327625150E-001, -1.074036280E-004, 4.546448880E-008, -7.869768800E-012, -3.671092670E+004, 4.152320020E+001] ), NASA( [ 1393.00, 5000.00], [ 3.683724360E+001, 3.707419240E-002, -1.288980320E-005, 2.023297500E-009, -1.182914560E-013, -4.938456880E+004, -1.610723920E+002] ) ), note = "7/20/ 0 tm" ) species(name = "ac8h16ooh-co2", atoms = " C:8 H:17 O:4 ", thermo = ( NASA( [ 300.00, 1392.00], [-6.845830360E-001, 1.314279130E-001, -1.065883870E-004, 4.544718790E-008, -7.941307910E-012, -3.750954200E+004, 3.675188620E+001] ), NASA( [ 1392.00, 5000.00], [ 3.681286110E+001, 3.713028330E-002, -1.291662920E-005, 2.028234750E-009, -1.186083450E-013, -4.998768290E+004, -1.624688610E+002] ) ), note = "7/20/ 0 tm" ) species(name = "ac8h16ooh-do2", atoms = " C:8 H:17 O:4 ", thermo = ( NASA( [ 300.00, 1391.00], [-5.135690520E-001, 1.274974360E-001, -9.967839580E-005, 4.099767570E-008, -6.952798470E-012, -3.441892770E+004, 3.867760620E+001] ), NASA( [ 1391.00, 5000.00], [ 3.607946090E+001, 3.774941660E-002, -1.312954330E-005, 2.061415390E-009, -1.205386370E-013, -4.681424190E+004, -1.565293220E+002] ) ), note = "7/20/ 0 tm" ) species(name = "bc8h16ooh-co2", atoms = " C:8 H:17 O:4 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.493815120E+000, 1.367615380E-001, -1.143486210E-004, 4.990985350E-008, -8.853733520E-012, -3.979543650E+004, 3.864531450E+001] ), NASA( [ 1393.00, 5000.00], [ 3.757858000E+001, 3.645137150E-002, -1.267632160E-005, 1.990104040E-009, -1.163635560E-013, -5.256533290E+004, -1.681694240E+002] ) ), note = "7/20/ 0 tm" ) species(name = "bc8h16ooh-ao2", atoms = " C:8 H:17 O:4 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.293165490E+000, 1.327625150E-001, -1.074036280E-004, 4.546448880E-008, -7.869768800E-012, -3.671092670E+004, 4.152320020E+001] ), NASA( [ 1393.00, 5000.00], [ 3.683724360E+001, 3.707419240E-002, -1.288980320E-005, 2.023297500E-009, -1.182914560E-013, -4.938456880E+004, -1.610723920E+002] ) ), note = "7/20/ 0 tm" ) species(name = "bc8h16ooh-do2", atoms = " C:8 H:17 O:4 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.293165490E+000, 1.327625150E-001, -1.074036280E-004, 4.546448880E-008, -7.869768800E-012, -3.671092670E+004, 4.042606890E+001] ), NASA( [ 1393.00, 5000.00], [ 3.683724360E+001, 3.707419240E-002, -1.288980320E-005, 2.023297500E-009, -1.182914560E-013, -4.938456880E+004, -1.621695240E+002] ) ), note = "7/20/ 0 tm" ) species(name = "cc8h16ooh-do2", atoms = " C:8 H:17 O:4 ", thermo = ( NASA( [ 300.00, 1392.00], [-6.845830360E-001, 1.314279130E-001, -1.065883870E-004, 4.544718790E-008, -7.941307910E-012, -3.750954200E+004, 3.634423640E+001] ), NASA( [ 1392.00, 5000.00], [ 3.681286110E+001, 3.713028330E-002, -1.291662920E-005, 2.028234750E-009, -1.186083450E-013, -4.998768290E+004, -1.628765110E+002] ) ), note = "7/20/ 0 tm" ) species(name = "cc8h16ooh-bo2", atoms = " C:8 H:17 O:4 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.493815120E+000, 1.367615380E-001, -1.143486210E-004, 4.990985350E-008, -8.853733520E-012, -3.979543650E+004, 3.864531450E+001] ), NASA( [ 1393.00, 5000.00], [ 3.757858000E+001, 3.645137150E-002, -1.267632160E-005, 1.990104040E-009, -1.163635560E-013, -5.256533290E+004, -1.681694240E+002] ) ), note = "7/20/ 0 tm" ) species(name = "cc8h16ooh-ao2", atoms = " C:8 H:17 O:4 ", thermo = ( NASA( [ 300.00, 1392.00], [-6.845830360E-001, 1.314279130E-001, -1.065883870E-004, 4.544718790E-008, -7.941307910E-012, -3.750954200E+004, 3.675188620E+001] ), NASA( [ 1392.00, 5000.00], [ 3.681286110E+001, 3.713028330E-002, -1.291662920E-005, 2.028234750E-009, -1.186083450E-013, -4.998768290E+004, -1.624688610E+002] ) ), note = "7/20/ 0 tm" ) species(name = "dc8h16ooh-co2", atoms = " C:8 H:17 O:4 ", thermo = ( NASA( [ 300.00, 1392.00], [-6.845830360E-001, 1.314279130E-001, -1.065883870E-004, 4.544718790E-008, -7.941307910E-012, -3.750954200E+004, 3.634423640E+001] ), NASA( [ 1392.00, 5000.00], [ 3.681286110E+001, 3.713028330E-002, -1.291662920E-005, 2.028234750E-009, -1.186083450E-013, -4.998768290E+004, -1.628765110E+002] ) ), note = "7/20/ 0 tm" ) species(name = "dc8h16ooh-do2", atoms = " C:8 H:17 O:4 ", thermo = ( NASA( [ 300.00, 1391.00], [-5.135690520E-001, 1.274974360E-001, -9.967839580E-005, 4.099767570E-008, -6.952798470E-012, -3.441892770E+004, 3.826995650E+001] ), NASA( [ 1391.00, 5000.00], [ 3.607946090E+001, 3.774941660E-002, -1.312954330E-005, 2.061415390E-009, -1.205386370E-013, -4.681424190E+004, -1.569369710E+002] ) ), note = "7/20/ 0 tm" ) species(name = "dc8h16ooh-bo2", atoms = " C:8 H:17 O:4 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.293165490E+000, 1.327625150E-001, -1.074036280E-004, 4.546448880E-008, -7.869768800E-012, -3.671092670E+004, 4.042606890E+001] ), NASA( [ 1393.00, 5000.00], [ 3.683724360E+001, 3.707419240E-002, -1.288980320E-005, 2.023297500E-009, -1.182914560E-013, -4.938456880E+004, -1.621695240E+002] ) ), note = "7/20/ 0 tm" ) species(name = "dc8h16ooh-ao2", atoms = " C:8 H:17 O:4 ", thermo = ( NASA( [ 300.00, 1391.00], [-5.135690520E-001, 1.274974360E-001, -9.967839580E-005, 4.099767570E-008, -6.952798470E-012, -3.441892770E+004, 3.867760620E+001] ), NASA( [ 1391.00, 5000.00], [ 3.607946090E+001, 3.774941660E-002, -1.312954330E-005, 2.061415390E-009, -1.205386370E-013, -4.681424190E+004, -1.565293220E+002] ) ), note = "7/20/ 0 tm" ) species(name = "ic8ketaa", atoms = " C:8 H:16 O:3 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.645827650E+000, 1.202170540E-001, -9.168184430E-005, 3.608462400E-008, -5.802758850E-012, -5.103111490E+004, 4.268718030E+001] ), NASA( [ 1393.00, 5000.00], [ 3.378535670E+001, 3.489569910E-002, -1.211734650E-005, 1.900614510E-009, -1.110651930E-013, -6.308680470E+004, -1.467070410E+002] ) ), note = "7/20/ 0 therm" ) species(name = "ic8ketab", atoms = " C:8 H:16 O:3 ", thermo = ( NASA( [ 300.00, 1394.00], [-2.377867540E+000, 1.249992740E-001, -9.810483380E-005, 3.955732830E-008, -6.480974530E-012, -5.332548470E+004, 4.466672970E+001] ), NASA( [ 1394.00, 5000.00], [ 3.471340000E+001, 3.419452250E-002, -1.189527190E-005, 1.868054960E-009, -1.092558780E-013, -6.577458210E+004, -1.530358600E+002] ) ), note = "7/20/ 0 therm" ) species(name = "ic8ketac", atoms = " C:8 H:16 O:3 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.795702230E+000, 1.240853040E-001, -9.852988750E-005, 4.052702690E-008, -6.796400960E-012, -5.412579700E+004, 3.996740750E+001] ), NASA( [ 1393.00, 5000.00], [ 3.450667190E+001, 3.432062530E-002, -1.192693360E-005, 1.871692760E-009, -1.094126470E-013, -6.626086000E+004, -1.532810520E+002] ) ), note = "7/20/ 0 therm" ) species(name = "ic8ketad", atoms = " C:8 H:16 O:3 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.645827650E+000, 1.202170540E-001, -9.168184430E-005, 3.608462400E-008, -5.802758850E-012, -5.103111490E+004, 4.268718030E+001] ), NASA( [ 1393.00, 5000.00], [ 3.378535670E+001, 3.489569910E-002, -1.211734650E-005, 1.900614510E-009, -1.110651930E-013, -6.308680470E+004, -1.467070410E+002] ) ), note = "7/20/ 0 therm" ) species(name = "ic8ketba", atoms = " C:8 H:16 O:3 ", thermo = ( NASA( [ 300.00, 1393.00], [-3.657225670E+000, 1.271596770E-001, -1.007326220E-004, 4.133679430E-008, -6.923865750E-012, -5.322146680E+004, 5.138865940E+001] ), NASA( [ 1393.00, 5000.00], [ 3.368802610E+001, 3.515308150E-002, -1.224496320E-005, 1.924592290E-009, -1.126259300E-013, -6.575011900E+004, -1.475500240E+002] ) ), note = "7/20/ 0 therm" ) species(name = "ic8ketbc", atoms = " C:8 H:16 O:3 ", thermo = ( NASA( [ 300.00, 1394.00], [-3.144405710E+000, 1.269977950E-001, -9.928389210E-005, 3.960189100E-008, -6.397941930E-012, -5.595856990E+004, 4.510312800E+001] ), NASA( [ 1394.00, 5000.00], [ 3.506964250E+001, 3.400966450E-002, -1.185879990E-005, 1.865304520E-009, -1.092179490E-013, -6.881694290E+004, -1.587446460E+002] ) ), note = "7/20/ 0 therm" ) species(name = "ic8ketbd", atoms = " C:8 H:16 O:3 ", thermo = ( NASA( [ 300.00, 1393.00], [-3.657225670E+000, 1.271596770E-001, -1.007326220E-004, 4.133679430E-008, -6.923865750E-012, -5.322146680E+004, 5.098100970E+001] ), NASA( [ 1393.00, 5000.00], [ 3.368802610E+001, 3.515308150E-002, -1.224496320E-005, 1.924592290E-009, -1.126259300E-013, -6.575011900E+004, -1.479576740E+002] ) ), note = "7/20/ 0 therm" ) species(name = "ic8ketda", atoms = " C:8 H:16 O:3 ", thermo = ( NASA( [ 300.00, 1394.00], [-1.902025970E+000, 1.215720250E-001, -9.390287150E-005, 3.750628600E-008, -6.117972340E-012, -5.135028150E+004, 4.382465820E+001] ), NASA( [ 1394.00, 5000.00], [ 3.375677810E+001, 3.489478790E-002, -1.211104910E-005, 1.898975710E-009, -1.109422030E-013, -6.340538100E+004, -1.465040340E+002] ) ), note = "7/20/ 0 therm" ) species(name = "ic8ketdb", atoms = " C:8 H:16 O:3 ", thermo = ( NASA( [ 300.00, 1395.00], [-2.646165720E+000, 1.263540810E-001, -1.001570810E-004, 4.078403740E-008, -6.738187890E-012, -5.364216980E+004, 4.545965280E+001] ), NASA( [ 1395.00, 5000.00], [ 3.475422160E+001, 3.411357130E-002, -1.185696130E-005, 1.860981740E-009, -1.087994370E-013, -6.612138820E+004, -1.536399190E+002] ) ), note = "7/20/ 0 therm" ) species(name = "ic8ketdc", atoms = " C:8 H:16 O:3 ", thermo = ( NASA( [ 300.00, 1395.00], [-1.588265320E+000, 1.224082800E-001, -9.395243430E-005, 3.670037010E-008, -5.797055450E-012, -5.406090090E+004, 3.843951660E+001] ), NASA( [ 1395.00, 5000.00], [ 3.517927720E+001, 3.373816180E-002, -1.172507400E-005, 1.840209860E-009, -1.075844820E-013, -6.648955120E+004, -1.579363240E+002] ) ), note = "7/20/ 0 therm" ) species(name = "ic8ketdd", atoms = " C:8 H:16 O:3 ", thermo = ( NASA( [ 300.00, 1394.00], [-1.902025970E+000, 1.215720250E-001, -9.390287150E-005, 3.750628600E-008, -6.117972340E-012, -5.135028150E+004, 4.272752690E+001] ), NASA( [ 1394.00, 5000.00], [ 3.375677810E+001, 3.489478790E-002, -1.211104910E-005, 1.898975710E-009, -1.109422030E-013, -6.340538100E+004, -1.476011650E+002] ) ), note = "7/20/ 0 therm" ) species(name = "ic6h13cho-b", atoms = " C:7 H:14 O:1 ", thermo = ( NASA( [ 300.00, 1395.00], [-2.061865560E+000, 9.265322250E-002, -6.543443580E-005, 2.371017410E-008, -3.496990250E-012, -3.727346500E+004, 3.901813660E+001] ), NASA( [ 1395.00, 5000.00], [ 2.468017910E+001, 3.055950440E-002, -1.048583210E-005, 1.631628110E-009, -9.481780900E-014, -4.657545350E+004, -1.046986880E+002] ) ), note = "3/4/96 therm" ) species(name = "ic6h13co-b", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1395.00], [-1.363486330E+000, 8.816367220E-002, -6.269531630E-005, 2.277069710E-008, -3.353250600E-012, -1.873384190E+004, 3.682754760E+001] ), NASA( [ 1395.00, 5000.00], [ 2.432495090E+001, 2.838816210E-002, -9.753340560E-006, 1.519004760E-009, -8.832923030E-014, -2.764370260E+004, -1.011601790E+002] ) ), note = "3/4/96 therm" ) species(name = "ac6h12cho-b", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1395.00], [-1.275604910E+000, 8.801975980E-002, -6.282669390E-005, 2.299738640E-008, -3.424591260E-012, -1.266331850E+004, 3.753124370E+001] ), NASA( [ 1395.00, 5000.00], [ 2.425144720E+001, 2.844383130E-002, -9.770776600E-006, 1.521520730E-009, -8.846672320E-014, -2.150834320E+004, -9.954179050E+001] ) ), note = "3/4/96 therm" ) species(name = "cc6h12cho-b", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1382.00], [-1.118327970E+000, 8.385091180E-002, -5.405139650E-005, 1.627685390E-008, -1.733726220E-012, -1.392363370E+004, 3.805742110E+001] ), NASA( [ 1382.00, 5000.00], [ 2.487439290E+001, 2.691853840E-002, -9.050817470E-006, 1.390973400E-009, -8.019162080E-014, -2.316252390E+004, -1.026074830E+002] ) ), note = "3/4/96 therm" ) species(name = "dc6h12cho-b", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1382.00], [-1.118327970E+000, 8.385091180E-002, -5.405139650E-005, 1.627685390E-008, -1.733726220E-012, -1.392363370E+004, 3.805742110E+001] ), NASA( [ 1382.00, 5000.00], [ 2.487439290E+001, 2.691853840E-002, -9.050817470E-006, 1.390973400E-009, -8.019162080E-014, -2.316252390E+004, -1.026074830E+002] ) ), note = "3/4/96 therm" ) species(name = "ec6h12cho-b", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1395.00], [-1.275604910E+000, 8.801975980E-002, -6.282669390E-005, 2.299738640E-008, -3.424591260E-012, -1.266331850E+004, 3.753124370E+001] ), NASA( [ 1395.00, 5000.00], [ 2.425144720E+001, 2.844383130E-002, -9.770776600E-006, 1.521520730E-009, -8.846672320E-014, -2.150834320E+004, -9.954179050E+001] ) ), note = "3/4/96 therm" ) species(name = "ic6h13cho-d", atoms = " C:7 H:14 O:1 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.461059900E+000, 8.758775470E-002, -5.849608530E-005, 2.005220340E-008, -2.811580030E-012, -3.731707440E+004, 3.828731960E+001] ), NASA( [ 1393.00, 5000.00], [ 2.338413230E+001, 3.174773980E-002, -1.091283320E-005, 1.699886370E-009, -9.885172440E-014, -4.619233690E+004, -9.597153590E+001] ) ), note = "3/4/96 therm" ) species(name = "ic6h13co-d", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1393.00], [-6.868691820E-001, 8.278208740E-002, -5.543037590E-005, 1.897613880E-008, -2.647541310E-012, -1.878862910E+004, 3.574568840E+001] ), NASA( [ 1393.00, 5000.00], [ 2.296865500E+001, 2.961467210E-002, -1.019067190E-005, 1.588574600E-009, -9.242727800E-014, -2.723094830E+004, -9.207095720E+001] ) ), note = "3/4/96 therm" ) species(name = "ac6h12cho-d", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1393.00], [-6.206866340E-001, 8.274337840E-002, -5.561970910E-005, 1.919777600E-008, -2.712242090E-012, -1.271579340E+004, 3.654425690E+001] ), NASA( [ 1393.00, 5000.00], [ 2.294227640E+001, 2.964970300E-002, -1.020529180E-005, 1.591100210E-009, -9.258354230E-014, -2.111958960E+004, -9.073788440E+001] ) ), note = "3/4/96 therm" ) species(name = "bc6h12cho-d", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1384.00], [ 2.547342370E+000, 6.587880270E-002, -3.131926410E-005, 4.983672700E-009, 2.585130700E-013, -1.551447100E+004, 2.278334910E+001] ), NASA( [ 1384.00, 5000.00], [ 2.141756060E+001, 3.094955700E-002, -1.065440770E-005, 1.661252090E-009, -9.666929690E-014, -2.303074000E+004, -8.188744810E+001] ) ), note = "3/4/96 therm" ) species(name = "cc6h12cho-d", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1377.00], [-5.821087370E-001, 7.905430120E-002, -4.755201420E-005, 1.282813190E-008, -1.077359770E-012, -1.395645820E+004, 3.763215130E+001] ), NASA( [ 1377.00, 5000.00], [ 2.364965700E+001, 2.786464360E-002, -9.356415930E-006, 1.436513620E-009, -8.275574010E-014, -2.278073640E+004, -9.421019170E+001] ) ), note = "3/4/96 therm" ) species(name = "dc6h12cho-d", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1389.00], [ 7.181291740E-001, 7.978140210E-002, -5.308785350E-005, 1.831059640E-008, -2.616739620E-012, -1.869093660E+004, 2.711267250E+001] ), NASA( [ 1389.00, 5000.00], [ 2.324129910E+001, 2.940139460E-002, -1.012108710E-005, 1.578122010E-009, -9.183499760E-014, -2.679732040E+004, -9.474602880E+001] ) ), note = "3/4/96 therm" ) species(name = "ec6h12cho-d", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1393.00], [-6.206866340E-001, 8.274337840E-002, -5.561970910E-005, 1.919777600E-008, -2.712242090E-012, -1.271579340E+004, 3.654425690E+001] ), NASA( [ 1393.00, 5000.00], [ 2.294227640E+001, 2.964970300E-002, -1.020529180E-005, 1.591100210E-009, -9.258354230E-014, -2.111958960E+004, -9.073788440E+001] ) ), note = "3/4/96 therm" ) species(name = "ic3h7coc3h7-i", atoms = " C:7 H:14 O:1 ", thermo = ( NASA( [ 300.00, 1392.00], [-3.775851000E+000, 9.599897170E-002, -6.978291510E-005, 2.677599500E-008, -4.278694230E-012, -4.062275750E+004, 4.767210210E+001] ), NASA( [ 1392.00, 5000.00], [ 2.332766460E+001, 3.208637680E-002, -1.109378100E-005, 1.734796150E-009, -1.011536320E-013, -5.005835950E+004, -9.781743370E+001] ) ), note = "3/4/96 trm" ) species(name = "ic3h7coc3h6-i", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1392.00], [-3.083473400E+000, 9.175726010E-002, -6.772867610E-005, 2.637903090E-008, -4.270432610E-012, -1.599773560E+004, 4.731473590E+001] ), NASA( [ 1392.00, 5000.00], [ 2.291971250E+001, 2.992598720E-002, -1.035761740E-005, 1.620826000E-009, -9.455539220E-014, -2.499696910E+004, -9.208314440E+001] ) ), note = "3/4/96 trm" ) species(name = "ic3h7coc3h6-t", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [-6.604792350E-001, 8.384301700E-002, -5.793489440E-005, 2.102374140E-008, -3.189602310E-012, -2.213180780E+004, 3.220773560E+001] ), NASA( [ 1390.00, 5000.00], [ 2.302316910E+001, 2.977935360E-002, -1.029367330E-005, 1.609423850E-009, -9.383305800E-014, -3.056685540E+004, -9.557685000E+001] ) ), note = "3/4/96 trm" ) species(name = "tc4h9coc2h5", atoms = " C:7 H:14 O:1 ", thermo = ( NASA( [ 300.00, 1392.00], [-2.349858940E+000, 9.420692810E-002, -6.881403800E-005, 2.641121050E-008, -4.198780700E-012, -4.117745160E+004, 3.987056150E+001] ), NASA( [ 1392.00, 5000.00], [ 2.431391450E+001, 3.099861900E-002, -1.066450660E-005, 1.662261650E-009, -9.670970970E-014, -5.039355370E+004, -1.030854000E+002] ) ), note = "3/4/96 therm" ) species(name = "tc4h8coc2h5", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1392.00], [-1.565813790E+000, 8.960200580E-002, -6.629088450E-005, 2.577337250E-008, -4.146722730E-012, -1.656730430E+004, 3.838588730E+001] ), NASA( [ 1392.00, 5000.00], [ 2.387162830E+001, 2.889975280E-002, -9.956379750E-006, 1.553350280E-009, -9.043278800E-014, -2.532106940E+004, -9.785582630E+001] ) ), note = "3/4/96 therm" ) species(name = "tc4h9coc2h4s", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1394.00], [-2.865004410E+000, 9.455874020E-002, -7.183825140E-005, 2.840959090E-008, -4.608839880E-012, -2.098633860E+004, 4.162557860E+001] ), NASA( [ 1394.00, 5000.00], [ 2.443117750E+001, 2.856047590E-002, -9.869910670E-006, 1.543075570E-009, -8.996617710E-014, -3.026120300E+004, -1.042116090E+002] ) ), note = "3/4/96 thrm" ) species(name = "tc4h9coc2h4p", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1392.00], [-1.565813790E+000, 8.960200580E-002, -6.629088450E-005, 2.577337250E-008, -4.146722730E-012, -1.656730430E+004, 3.838588730E+001] ), NASA( [ 1392.00, 5000.00], [ 2.387162830E+001, 2.889975280E-002, -9.956379750E-006, 1.553350280E-009, -9.043278800E-014, -2.532106940E+004, -9.785582630E+001] ) ), note = "3/4/96 thrm" ) species(name = "neoc5h11coch3", atoms = " C:7 H:14 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [-1.463909090E+000, 9.056859500E-002, -6.378655510E-005, 2.335014590E-008, -3.521352420E-012, -4.171112470E+004, 3.551855220E+001] ), NASA( [ 1390.00, 5000.00], [ 2.434865960E+001, 3.069179090E-002, -1.050042240E-005, 1.630825240E-009, -9.465110620E-014, -5.073523100E+004, -1.032915470E+002] ) ), note = "3/4/96 trm" ) species(name = "neoc5h10coch3", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [-6.894600210E-001, 8.600158040E-002, -6.128629960E-005, 2.270883390E-008, -3.465737830E-012, -1.709959370E+004, 3.407829180E+001] ), NASA( [ 1390.00, 5000.00], [ 2.392563290E+001, 2.857225520E-002, -9.784288520E-006, 1.520578940E-009, -8.829321280E-014, -2.567093970E+004, -9.817349310E+001] ) ), note = "3/4/96 trm" ) species(name = "tc4h9chcoch3", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1394.00], [-1.859250460E+000, 9.038476760E-002, -6.616322350E-005, 2.509572440E-008, -3.904498710E-012, -2.153715790E+004, 3.672407370E+001] ), NASA( [ 1394.00, 5000.00], [ 2.426666430E+001, 2.859911180E-002, -9.860992730E-006, 1.539376080E-009, -8.965768960E-014, -3.054119540E+004, -1.033318430E+002] ) ), note = "3/4/96 thrm" ) species(name = "neoc5h11coch2", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [-6.894600210E-001, 8.600158040E-002, -6.128629960E-005, 2.270883390E-008, -3.465737830E-012, -1.709959370E+004, 3.407829180E+001] ), NASA( [ 1390.00, 5000.00], [ 2.392563290E+001, 2.857225520E-002, -9.784288520E-006, 1.520578940E-009, -8.829321280E-014, -2.567093970E+004, -9.817349310E+001] ) ), note = "3/4/96 trm" ) species(name = "neoc6h13cho", atoms = " C:7 H:14 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [-1.076620330E+000, 9.063154370E-002, -6.447112180E-005, 2.369730930E-008, -3.559172270E-012, -3.807464190E+004, 3.386413620E+001] ), NASA( [ 1390.00, 5000.00], [ 2.489696000E+001, 2.987330760E-002, -1.014504490E-005, 1.568129870E-009, -9.072001420E-014, -4.706283800E+004, -1.055627160E+002] ) ), note = "3/4/96 therm" ) species(name = "neoc6h13co", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [-2.877096300E-001, 8.576498660E-002, -6.128541590E-005, 2.254861490E-008, -3.381219780E-012, -1.954880230E+004, 3.125207150E+001] ), NASA( [ 1390.00, 5000.00], [ 2.449427430E+001, 2.775585770E-002, -9.434020900E-006, 1.459146850E-009, -8.445478420E-014, -2.811324370E+004, -1.017522490E+002] ) ), note = "3/4/96 therm" ) species(name = "fc6h12cho", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [-2.962370000E-001, 8.604418470E-002, -6.196194870E-005, 2.304825940E-008, -3.500363870E-012, -1.346404100E+004, 3.240082890E+001] ), NASA( [ 1390.00, 5000.00], [ 2.447902700E+001, 2.772340120E-002, -9.413189560E-006, 1.454922240E-009, -8.417034140E-014, -2.199605560E+004, -1.004557380E+002] ) ), note = "3/4/96 therm" ) species(name = "gc6h12cho", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1379.00], [ 2.260266240E-001, 8.039489160E-002, -5.126545030E-005, 1.554706990E-008, -1.726140400E-012, -1.478284610E+004, 3.121019510E+001] ), NASA( [ 1379.00, 5000.00], [ 2.470158330E+001, 2.712614930E-002, -9.134222840E-006, 1.405089850E-009, -8.105392740E-014, -2.356896440E+004, -1.014534850E+002] ) ), note = "3/4/96 therm" ) species(name = "hc6h12cho", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1395.00], [-1.491535990E+000, 9.061665570E-002, -6.725334070E-005, 2.582350900E-008, -4.050089520E-012, -1.789946620E+004, 3.514569060E+001] ), NASA( [ 1395.00, 5000.00], [ 2.463677540E+001, 2.810157030E-002, -9.649431010E-006, 1.502240000E-009, -8.733039560E-014, -2.680708920E+004, -1.046244390E+002] ) ), note = "3/4/96 therm" ) species(name = "ic4h7coch3", atoms = " C:6 H:10 O:1 ", thermo = ( NASA( [ 300.00, 1388.00], [ 3.451618450E-002, 6.502447700E-002, -4.295383660E-005, 1.481944890E-008, -2.143332030E-012, -2.211639120E+004, 3.079966750E+001] ), NASA( [ 1388.00, 5000.00], [ 1.834343950E+001, 2.441093120E-002, -8.440665630E-006, 1.319970920E-009, -7.696769340E-014, -2.877349220E+004, -6.843533490E+001] ) ), note = "2/22/96 therm" ) species(name = "ic4h7coch2", atoms = " C:6 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [-3.539630220E-001, 6.789287190E-002, -5.131069070E-005, 2.052426840E-008, -3.412032560E-012, -7.765255640E+002, 3.111249730E+001] ), NASA( [ 1390.00, 5000.00], [ 1.894793280E+001, 2.144953450E-002, -7.441678790E-006, 1.166416300E-009, -6.812399780E-014, -7.415857210E+003, -7.219132180E+001] ) ), note = "2/22/96 therm" ) species(name = "ic3h5chcoch3", atoms = " C:6 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1390.00], [-5.580030730E-001, 6.545505160E-002, -4.568489500E-005, 1.640196010E-008, -2.420481980E-012, -1.907540880E+003, 3.296242790E+001] ), NASA( [ 1390.00, 5000.00], [ 1.858454100E+001, 2.177129790E-002, -7.556241750E-006, 1.184724590E-009, -6.920897970E-014, -8.686570980E+003, -7.025882760E+001] ) ), note = "2/22/96 trm" ) species(name = "ac3h4ch2coch3", atoms = " C:6 H:9 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [-9.115403580E-001, 6.965281870E-002, -5.297083900E-005, 2.133583600E-008, -3.566195870E-012, -3.795653580E+003, 3.431971590E+001] ), NASA( [ 1391.00, 5000.00], [ 1.878193210E+001, 2.195772310E-002, -7.604088130E-006, 1.190411340E-009, -6.946587650E-014, -1.053439190E+004, -7.096249460E+001] ) ), note = "2/22/96 tm" ) species(name = "xc7h13ooh-x1", atoms = " C:7 H:14 O:2 ", thermo = ( NASA( [ 300.00, 1394.00], [ 7.764122730E-001, 9.327337650E-002, -6.903028560E-005, 2.711314120E-008, -4.426242080E-012, -2.457371590E+004, 2.969835290E+001] ), NASA( [ 1394.00, 5000.00], [ 2.663620460E+001, 3.114101330E-002, -1.070939680E-005, 1.668642450E-009, -9.705005460E-014, -3.345168700E+004, -1.086895600E+002] ) ), note = "4/1/96 trm" ) species(name = "xc7h13o-x1", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1393.00], [-7.753002490E-001, 8.496464000E-002, -5.946621440E-005, 2.169182780E-008, -3.260055510E-012, -4.651540690E+003, 3.514141190E+001] ), NASA( [ 1393.00, 5000.00], [ 2.307272610E+001, 2.953688520E-002, -1.007455640E-005, 1.561331370E-009, -9.047759960E-014, -1.297251990E+004, -9.305546620E+001] ) ), note = "4/ 1/96 therm" ) species(name = "yc7h13ooh-x1", atoms = " C:7 H:14 O:2 ", thermo = ( NASA( [ 300.00, 1393.00], [ 1.022494560E+000, 9.097675710E-002, -6.509914610E-005, 2.460358860E-008, -3.873897040E-012, -2.592884020E+004, 2.840965050E+001] ), NASA( [ 1393.00, 5000.00], [ 2.641868360E+001, 3.137803970E-002, -1.080300730E-005, 1.684510790E-009, -9.802556050E-014, -3.478967740E+004, -1.080011780E+002] ) ), note = "4/1/96 trm" ) species(name = "yc7h13o-x1", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [-1.813170910E-001, 8.138082550E-002, -5.436004320E-005, 1.876525950E-008, -2.659590400E-012, -6.062759770E+003, 3.220565070E+001] ), NASA( [ 1391.00, 5000.00], [ 2.259001510E+001, 2.992953970E-002, -1.020605130E-005, 1.581435560E-009, -9.163084060E-014, -1.416545130E+004, -9.074298840E+001] ) ), note = "4/ 1/96 therm" ) species(name = "oc7h13ooh-n", atoms = " C:7 H:14 O:2 ", thermo = ( NASA( [ 300.00, 1397.00], [-3.054845000E-001, 9.619494010E-002, -7.035325810E-005, 2.656930660E-008, -4.097054970E-012, -2.531957790E+004, 3.321248330E+001] ), NASA( [ 1397.00, 5000.00], [ 2.741502090E+001, 3.044975040E-002, -1.046709310E-005, 1.630637830E-009, -9.483667830E-014, -3.482776360E+004, -1.152795050E+002] ) ), note = "3/27/97 thrm" ) species(name = "oc7h13o-n", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1396.00], [-2.662285120E+000, 9.332588850E-002, -7.030687670E-005, 2.750678370E-008, -4.390600530E-012, -5.694319560E+003, 4.222704190E+001] ), NASA( [ 1396.00, 5000.00], [ 2.393901760E+001, 2.872255040E-002, -9.778923510E-006, 1.513858790E-009, -8.766621340E-014, -1.465261710E+004, -9.970924880E+001] ) ), note = "3/28/97 therm" ) species(name = "xc7h13ooh-z", atoms = " C:7 H:14 O:2 ", thermo = ( NASA( [ 300.00, 1392.00], [-1.485030900E+000, 1.040306210E-001, -8.363438270E-005, 3.561068760E-008, -6.237622470E-012, -2.576928510E+004, 3.880099110E+001] ), NASA( [ 1392.00, 5000.00], [ 2.773448090E+001, 3.062089300E-002, -1.062272390E-005, 1.664885460E-009, -9.723023360E-014, -3.551978970E+004, -1.164977730E+002] ) ), note = "4/1/96 thrm" ) species(name = "xc7h13o-z", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1393.00], [-2.297556150E+000, 9.420667800E-002, -7.328819790E-005, 2.966230110E-008, -4.880389650E-012, -6.856639410E+003, 4.105262750E+001] ), NASA( [ 1393.00, 5000.00], [ 2.449476430E+001, 2.763316070E-002, -9.278843060E-006, 1.423784560E-009, -8.196349360E-014, -1.571222840E+004, -1.013428720E+002] ) ), note = "4/ 1/96 therm" ) species(name = "pc7h13ooh-o", atoms = " C:7 H:14 O:2 ", thermo = ( NASA( [ 300.00, 1406.00], [-3.027220620E+000, 1.110192930E-001, -9.178291200E-005, 3.883077060E-008, -6.581570210E-012, -2.354626320E+004, 4.345299480E+001] ), NASA( [ 1406.00, 5000.00], [ 2.887472800E+001, 2.876586840E-002, -9.790837540E-006, 1.515365770E-009, -8.773863110E-014, -3.374342950E+004, -1.249549470E+002] ) ), note = "3/27/97 thrm" ) species(name = "pc7h13o-o", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1398.00], [-4.660192130E+000, 1.045582070E-001, -8.370768560E-005, 3.357358020E-008, -5.340538450E-012, -6.200643310E+003, 4.957228130E+001] ), NASA( [ 1398.00, 5000.00], [ 2.706650200E+001, 2.544096110E-002, -8.532485470E-006, 1.309190240E-009, -7.539504970E-014, -1.652008560E+004, -1.187161430E+002] ) ), note = "4/ 7/97 therm" ) species(name = "oc7h13ooh-q", atoms = " C:7 H:14 O:2 ", thermo = ( NASA( [ 300.00, 1398.00], [-7.907341050E-001, 1.000026340E-001, -7.700027500E-005, 3.097838010E-008, -5.102925200E-012, -2.498665770E+004, 3.533698650E+001] ), NASA( [ 1398.00, 5000.00], [ 2.756604990E+001, 3.033916480E-002, -1.043168270E-005, 1.625301940E-009, -9.453078840E-014, -3.450060380E+004, -1.157561540E+002] ) ), note = "3/27/97 thrm" ) species(name = "oc7h13o-q", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1392.00], [-2.403081630E+000, 9.165584230E-002, -6.660663140E-005, 2.441847170E-008, -3.570597880E-012, -5.049964820E+003, 4.001219810E+001] ), NASA( [ 1392.00, 5000.00], [ 2.481145510E+001, 2.733574750E-002, -9.175943140E-006, 1.408147020E-009, -8.108407290E-014, -1.430095130E+004, -1.056746050E+002] ) ), note = "4/ 7/97 therm" ) species(name = "yc7h13ooh-x2", atoms = " C:7 H:14 O:2 ", thermo = ( NASA( [ 300.00, 1392.00], [ 1.577636190E+000, 8.696139370E-002, -5.880143680E-005, 2.074623810E-008, -3.043067050E-012, -2.627129000E+004, 2.774645750E+001] ), NASA( [ 1392.00, 5000.00], [ 2.596339400E+001, 3.177615040E-002, -1.094298610E-005, 1.706646410E-009, -9.932632480E-014, -3.498517610E+004, -1.039637710E+002] ) ), note = "4/1/96 trm" ) species(name = "yc7h13o-x2", atoms = " C:7 H:13 O:1 ", thermo = ( NASA( [ 300.00, 1393.00], [-3.896172020E-001, 8.252576810E-002, -5.673501630E-005, 2.061580210E-008, -3.131257840E-012, -6.708379280E+003, 3.492785190E+001] ), NASA( [ 1393.00, 5000.00], [ 2.225687300E+001, 3.037472750E-002, -1.039249850E-005, 1.613727040E-009, -9.363273580E-014, -1.471124710E+004, -8.706947310E+001] ) ), note = "4/ 1/96 therm" ) species(name = "ac3h5ooh", atoms = " C:3 H:6 O:2 ", thermo = ( NASA( [ 300.00, 1394.00], [ 2.439346470E+000, 4.020706380E-002, -2.953226790E-005, 1.147156000E-008, -1.851705110E-012, -9.436799060E+003, 1.705499690E+001] ), NASA( [ 1394.00, 5000.00], [ 1.368376930E+001, 1.339680490E-002, -4.615336310E-006, 7.199889580E-010, -4.191099880E-014, -1.331652480E+004, -4.319041930E+001] ) ), note = "7/20/98 therm" ) species(name = "neoc6h11-h", atoms = " C:6 H:11 ", thermo = ( NASA( [ 300.00, 1399.00], [-2.653119260E+000, 7.817424570E-002, -6.142794530E-005, 2.498857340E-008, -4.115128150E-012, 2.047400520E+004, 3.697862980E+001] ), NASA( [ 1399.00, 5000.00], [ 1.958601240E+001, 2.251538410E-002, -7.608344360E-006, 1.172041890E-009, -6.764333120E-014, 1.317763770E+004, -8.105051980E+001] ) ), note = "4/ 7/97 therm" ) species(name = "cc6h11o-b", atoms = " C:6 H:11 O:1 ", thermo = ( NASA( [ 300.00, 1393.00], [-1.179673240E+000, 7.819098830E-002, -5.997950200E-005, 2.379329610E-008, -3.818532290E-012, -5.638423570E+003, 3.401985430E+001] ), NASA( [ 1393.00, 5000.00], [ 2.119556870E+001, 2.297019800E-002, -7.622277890E-006, 1.160655760E-009, -6.647159300E-014, -1.303631770E+004, -8.497462910E+001] ) ), note = "4/ 1/96 therm" ) species(name = "xc7h14oh-y", atoms = " C:7 H:15 O:1 ", thermo = ( NASA( [ 300.00, 1386.00], [ 1.889439750E+000, 7.433810400E-002, -3.880943790E-005, 8.740625450E-009, -4.921708540E-013, -2.414048580E+004, 2.681716890E+001] ), NASA( [ 1386.00, 5000.00], [ 2.227832630E+001, 3.433273620E-002, -1.169971350E-005, 1.811859210E-009, -1.049342390E-013, -3.203822990E+004, -8.547901180E+001] ) ), note = "2/26/98 therm" ) species(name = "yc7h14oh-x", atoms = " C:7 H:15 O:1 ", thermo = ( NASA( [ 300.00, 1395.00], [-1.460811990E+000, 9.521638900E-002, -7.030101520E-005, 2.770080440E-008, -4.539996160E-012, -2.493411180E+004, 3.777040280E+001] ), NASA( [ 1395.00, 5000.00], [ 2.441989480E+001, 3.261417490E-002, -1.112776490E-005, 1.724652260E-009, -9.993703810E-014, -3.376918590E+004, -1.005667310E+002] ) ), note = "2/26/98 therm" ) species(name = "zc7h14oh-y", atoms = " C:7 H:15 O:1 ", thermo = ( NASA( [ 300.00, 1389.00], [ 1.366603490E+000, 7.904234990E-002, -4.654780270E-005, 1.383978590E-008, -1.670386370E-012, -2.633413940E+004, 2.630922610E+001] ), NASA( [ 1389.00, 5000.00], [ 2.272933710E+001, 3.436458760E-002, -1.179898570E-005, 1.836273810E-009, -1.067081010E-013, -3.439518850E+004, -9.047483010E+001] ) ), note = "2/26/98 therm" ) species(name = "yc7h14oh-z", atoms = " C:7 H:15 O:1 ", thermo = ( NASA( [ 300.00, 1386.00], [-1.170910870E+000, 9.045353680E-002, -6.071335350E-005, 2.041266870E-008, -2.705490960E-012, -2.621369060E+004, 3.769170000E+001] ), NASA( [ 1386.00, 5000.00], [ 2.514210590E+001, 3.076898350E-002, -1.025030220E-005, 1.564984840E-009, -8.979428450E-014, -3.543022800E+004, -1.040940000E+002] ) ), note = "2/26/98 therm" ) species(name = "ic4h7oh-i1", atoms = " C:4 H:8 O:1 ", thermo = ( NASA( [ 300.00, 1394.00], [ 1.187825020E+000, 4.528091090E-002, -3.326054230E-005, 1.316268720E-008, -2.158751420E-012, -2.470986030E+004, 1.156105870E+001] ), NASA( [ 1394.00, 5000.00], [ 1.323655910E+001, 1.599237520E-002, -5.443972300E-006, 9.010988990E-010, -5.604176680E-014, -2.880396720E+004, -5.278318310E+001] ) ), note = "2/26/98 therm" ) species(name = "oc7h14oh-p", atoms = " C:7 H:15 O:1 ", thermo = ( NASA( [ 300.00, 1397.00], [-2.219390810E+000, 9.685572970E-002, -6.984447940E-005, 2.578973330E-008, -3.839130040E-012, -2.520917350E+004, 4.147309910E+001] ), NASA( [ 1397.00, 5000.00], [ 2.553489150E+001, 3.095832950E-002, -1.041380450E-005, 1.599421500E-009, -9.212074260E-014, -3.464306370E+004, -1.070434950E+002] ) ), note = "2/26/98 therm" ) species(name = "pc7h14oh-o", atoms = " C:7 H:15 O:1 ", thermo = ( NASA( [ 300.00, 1397.00], [-2.219390810E+000, 9.685572970E-002, -6.984447940E-005, 2.578973330E-008, -3.839130040E-012, -2.520917350E+004, 4.147309910E+001] ), NASA( [ 1397.00, 5000.00], [ 2.553489150E+001, 3.095832950E-002, -1.041380450E-005, 1.599421500E-009, -9.212074260E-014, -3.464306370E+004, -1.070434950E+002] ) ), note = "2/26/98 therm" ) species(name = "qc7h14oh-p", atoms = " C:7 H:15 O:1 ", thermo = ( NASA( [ 300.00, 1388.00], [-1.737098670E+000, 9.233539390E-002, -6.176851610E-005, 2.023227410E-008, -2.534967600E-012, -2.301374250E+004, 4.007253040E+001] ), NASA( [ 1388.00, 5000.00], [ 2.575453730E+001, 3.024844670E-002, -1.007287390E-005, 1.537681920E-009, -8.822564120E-014, -3.261868370E+004, -1.080736920E+002] ) ), note = "2/26/98 therm" ) species(name = "pc7h14oh-q", atoms = " C:7 H:15 O:1 ", thermo = ( NASA( [ 300.00, 1401.00], [-2.614519640E+000, 1.017763100E-001, -7.872146250E-005, 3.185408320E-008, -5.254997400E-012, -2.390928980E+004, 4.208271730E+001] ), NASA( [ 1401.00, 5000.00], [ 2.568191880E+001, 3.126835330E-002, -1.060620290E-005, 1.637527460E-009, -9.464089860E-014, -3.326001060E+004, -1.082628650E+002] ) ), note = "2/26/98 therm" ) species(name = "xc7h14oh-yo2", atoms = " C:7 H:15 O:3 ", thermo = ( NASA( [ 300.00, 1397.00], [ 1.199758430E+000, 9.920075000E-002, -7.452812470E-005, 3.022385750E-008, -5.105839560E-012, -4.192617910E+004, 2.984899880E+001] ), NASA( [ 1397.00, 5000.00], [ 2.738639880E+001, 3.456623990E-002, -1.175511630E-005, 1.817640800E-009, -1.051471790E-013, -5.075969160E+004, -1.097026640E+002] ) ), note = "2/26/98 trm" ) species(name = "xc7h14o-yo2h", atoms = " C:7 H:15 O:3 ", thermo = ( NASA( [ 300.00, 1398.00], [ 2.829920620E-001, 1.060222270E-001, -8.203076340E-005, 3.338573430E-008, -5.571437340E-012, -3.391389980E+004, 3.249949860E+001] ), NASA( [ 1398.00, 5000.00], [ 2.979545940E+001, 3.281888710E-002, -1.122144430E-005, 1.741770790E-009, -1.010377840E-013, -4.375236890E+004, -1.245140810E+002] ) ), note = "2/26/98 trm" ) species(name = "yc7h14oh-xo2", atoms = " C:7 H:15 O:3 ", thermo = ( NASA( [ 300.00, 1395.00], [ 1.524744590E+000, 9.740769860E-002, -7.090708860E-005, 2.775230330E-008, -4.551090420E-012, -4.297729000E+004, 2.909633270E+001] ), NASA( [ 1395.00, 5000.00], [ 2.771504400E+001, 3.458655300E-002, -1.182864950E-005, 1.836070410E-009, -1.065023100E-013, -5.200694190E+004, -1.111433000E+002] ) ), note = "2/26/98 trm" ) species(name = "yc7h14o-xo2h", atoms = " C:7 H:15 O:3 ", thermo = ( NASA( [ 300.00, 1395.00], [ 6.071412360E-001, 1.042318250E-001, -7.841102170E-005, 3.091285520E-008, -5.015995500E-012, -3.496486520E+004, 3.175087930E+001] ), NASA( [ 1395.00, 5000.00], [ 3.012642520E+001, 3.283508080E-002, -1.129312510E-005, 1.759869740E-009, -1.023720850E-013, -4.500037000E+004, -1.259674160E+002] ) ), note = "2/26/98 trm" ) species(name = "zc7h14oh-yo2", atoms = " C:7 H:15 O:3 ", thermo = ( NASA( [ 300.00, 1399.00], [ 4.755400240E-001, 1.042244330E-001, -8.169749910E-005, 3.432152070E-008, -5.945205620E-012, -4.407719650E+004, 3.176009480E+001] ), NASA( [ 1399.00, 5000.00], [ 2.821135740E+001, 3.396280720E-002, -1.156820010E-005, 1.790655540E-009, -1.036639380E-013, -5.323668000E+004, -1.153802330E+002] ) ), note = "2/26/98 trm" ) species(name = "zc7h14o-yo2h", atoms = " C:7 H:15 O:3 ", thermo = ( NASA( [ 300.00, 1400.00], [-4.087211150E-001, 1.107218820E-001, -8.839142770E-005, 3.686949110E-008, -6.262254430E-012, -3.606620850E+004, 3.429118720E+001] ), NASA( [ 1400.00, 5000.00], [ 3.070926750E+001, 3.218588530E-002, -1.103468790E-005, 1.715905910E-009, -9.966462770E-014, -4.628902120E+004, -1.307585510E+002] ) ), note = "2/26/98 trm" ) species(name = "yc7h14oh-zo2", atoms = " C:7 H:15 O:3 ", thermo = ( NASA( [ 300.00, 1397.00], [ 6.540073860E-001, 1.025035660E-001, -7.874915940E-005, 3.249444350E-008, -5.558730050E-012, -4.468046500E+004, 3.143760000E+001] ), NASA( [ 1397.00, 5000.00], [ 2.807388480E+001, 3.417549080E-002, -1.166323870E-005, 1.807783490E-009, -1.047551600E-013, -5.386312900E+004, -1.144530630E+002] ) ), note = "2/26/98 trm" ) species(name = "yc7h14o-zo2h", atoms = " C:7 H:15 O:3 ", thermo = ( NASA( [ 300.00, 1398.00], [-2.635160900E-001, 1.093280440E-001, -8.625518020E-005, 3.565747540E-008, -6.024402030E-012, -3.666806580E+004, 3.409165890E+001] ), NASA( [ 1398.00, 5000.00], [ 3.048401180E+001, 3.242623500E-002, -1.112870990E-005, 1.731760480E-009, -1.006361230E-013, -4.685614340E+004, -1.292703030E+002] ) ), note = "2/26/98 trm" ) species(name = "oc7h14oh-po2", atoms = " C:7 H:15 O:3 ", thermo = ( NASA( [ 300.00, 1401.00], [-6.528790100E-001, 1.093029400E-001, -8.653936730E-005, 3.598247740E-008, -6.104652620E-012, -4.362494900E+004, 3.652880350E+001] ), NASA( [ 1401.00, 5000.00], [ 2.959804000E+001, 3.290319910E-002, -1.123142040E-005, 1.741285660E-009, -1.009252580E-013, -5.355881530E+004, -1.239045900E+002] ) ), note = "2/26/98 trm" ) species(name = "oc7h14o-po2h", atoms = " C:7 H:15 O:3 ", thermo = ( NASA( [ 300.00, 1401.00], [-1.498600900E+000, 1.156093450E-001, -9.291669880E-005, 3.832857370E-008, -6.377341630E-012, -3.561937930E+004, 3.888489900E+001] ), NASA( [ 1401.00, 5000.00], [ 3.210308660E+001, 3.113084860E-002, -1.070183420E-005, 1.667393400E-009, -9.698576210E-014, -4.661806730E+004, -1.393329380E+002] ) ), note = "2/26/98 trm" ) species(name = "pc7h14oh-oo2", atoms = " C:7 H:15 O:3 ", thermo = ( NASA( [ 300.00, 1401.00], [-6.528790100E-001, 1.093029400E-001, -8.653936730E-005, 3.598247740E-008, -6.104652620E-012, -4.362494900E+004, 3.652880350E+001] ), NASA( [ 1401.00, 5000.00], [ 2.959804000E+001, 3.290319910E-002, -1.123142040E-005, 1.741285660E-009, -1.009252580E-013, -5.355881530E+004, -1.239045900E+002] ) ), note = "2/26/98 trm" ) species(name = "pc7h14o-oo2h", atoms = " C:7 H:15 O:3 ", thermo = ( NASA( [ 300.00, 1401.00], [-1.498600900E+000, 1.156093450E-001, -9.291669880E-005, 3.832857370E-008, -6.377341630E-012, -3.561937930E+004, 3.888489900E+001] ), NASA( [ 1401.00, 5000.00], [ 3.210308660E+001, 3.113084860E-002, -1.070183420E-005, 1.667393400E-009, -9.698576210E-014, -4.661806730E+004, -1.393329380E+002] ) ), note = "2/26/98 trm" ) species(name = "qc7h14oh-po2", atoms = " C:7 H:15 O:3 ", thermo = ( NASA( [ 300.00, 1400.00], [ 4.685585720E-002, 1.045697680E-001, -8.016348400E-005, 3.249766540E-008, -5.413962840E-012, -4.147367470E+004, 3.401125500E+001] ), NASA( [ 1400.00, 5000.00], [ 2.867060090E+001, 3.353273240E-002, -1.141377000E-005, 1.766137250E-009, -1.022265160E-013, -5.101269330E+004, -1.182608230E+002] ) ), note = "2/26/98 trm" ) species(name = "qc7h14o-po2h", atoms = " C:7 H:15 O:3 ", thermo = ( NASA( [ 300.00, 1400.00], [-8.688294540E-001, 1.113867870E-001, -8.766034180E-005, 3.565673160E-008, -5.879096280E-012, -3.346156530E+004, 3.665669140E+001] ), NASA( [ 1400.00, 5000.00], [ 3.107906400E+001, 3.178658420E-002, -1.088066110E-005, 1.690369990E-009, -9.812368840E-014, -4.400522970E+004, -1.330690680E+002] ) ), note = "2/26/98 trm" ) species(name = "pc7h14oh-qo2", atoms = " C:7 H:15 O:3 ", thermo = ( NASA( [ 300.00, 1399.00], [ 2.210613210E-001, 1.042125020E-001, -7.871544500E-005, 3.125660420E-008, -5.101419990E-012, -4.192284000E+004, 3.347885720E+001] ), NASA( [ 1399.00, 5000.00], [ 2.923729960E+001, 3.332178010E-002, -1.140060920E-005, 1.770276190E-009, -1.027176950E-013, -5.170147780E+004, -1.212734960E+002] ) ), note = "2/26/98 trm" ) species(name = "pc7h14o-qo2h", atoms = " C:7 H:15 O:3 ", thermo = ( NASA( [ 300.00, 1399.00], [-6.454866160E-001, 1.106093890E-001, -8.522990800E-005, 3.368493570E-008, -5.391376640E-012, -3.391402550E+004, 3.593203640E+001] ), NASA( [ 1399.00, 5000.00], [ 3.174205520E+001, 3.154361580E-002, -1.086771780E-005, 1.695735810E-009, -9.873520790E-014, -4.475933450E+004, -1.366971470E+002] ) ), note = "2/26/98 trm" ) species(name = "cc8h16oh-b", atoms = " C:8 H:17 O:1 ", thermo = ( NASA( [ 300.00, 1391.00], [-2.876898270E+000, 1.114828960E-001, -8.080816070E-005, 2.962683890E-008, -4.332970230E-012, -3.040515990E+004, 4.347163180E+001] ), NASA( [ 1391.00, 5000.00], [ 2.996693940E+001, 3.368337540E-002, -1.121655220E-005, 1.712259380E-009, -9.824188840E-014, -4.154206610E+004, -1.322715640E+002] ) ), note = "3/ 3/98 therm" ) species(name = "bc8h16oh-c", atoms = " C:8 H:17 O:1 ", thermo = ( NASA( [ 300.00, 1396.00], [-2.953901330E-003, 9.845579660E-002, -6.439049210E-005, 2.159142950E-008, -2.945251090E-012, -3.057126660E+004, 3.126073890E+001] ), NASA( [ 1396.00, 5000.00], [ 2.730712210E+001, 3.730622640E-002, -1.273067620E-005, 1.973311760E-009, -1.143558720E-013, -4.033411810E+004, -1.163716440E+002] ) ), note = "3/ 3/98 therm" ) species(name = "cc8h16oh-d", atoms = " C:8 H:17 O:1 ", thermo = ( NASA( [ 300.00, 1399.00], [-3.144767090E+000, 1.161829320E-001, -9.046113160E-005, 3.702738200E-008, -6.200958290E-012, -2.912898740E+004, 4.345054040E+001] ), NASA( [ 1399.00, 5000.00], [ 2.908857550E+001, 3.570510120E-002, -1.216097120E-005, 1.882737090E-009, -1.090204530E-013, -3.980580380E+004, -1.278253830E+002] ) ), note = "3/ 3/98 therm" ) species(name = "dc8h16oh-c", atoms = " C:8 H:17 O:1 ", thermo = ( NASA( [ 300.00, 1392.00], [ 2.145191940E-001, 9.528574540E-002, -5.894350110E-005, 1.805556370E-008, -2.151858760E-012, -2.833742270E+004, 3.245040930E+001] ), NASA( [ 1392.00, 5000.00], [ 2.695657690E+001, 3.742266540E-002, -1.273427040E-005, 1.970340010E-009, -1.140484590E-013, -3.808026790E+004, -1.127963860E+002] ) ), note = "3/ 3/98 therm" ) species(name = "cc8h16oh-bo2", atoms = " C:8 H:17 O:3 ", thermo = ( NASA( [ 300.00, 1400.00], [-1.014898870E+000, 1.234370730E-001, -9.888616790E-005, 4.182629800E-008, -7.224703680E-012, -4.887857130E+004, 3.703574880E+001] ), NASA( [ 1400.00, 5000.00], [ 3.273319480E+001, 3.729439660E-002, -1.271016290E-005, 1.968405300E-009, -1.140014560E-013, -5.989749140E+004, -1.416682910E+002] ) ), note = "3/ 3/98 trm" ) species(name = "cc8h16o-bo2h", atoms = " C:8 H:17 O:3 ", thermo = ( NASA( [ 300.00, 1400.00], [-1.931589290E+000, 1.302584170E-001, -1.063891000E-004, 4.498874570E-008, -7.690501880E-012, -4.086630720E+004, 3.968586370E+001] ), NASA( [ 1400.00, 5000.00], [ 3.514190390E+001, 3.554769650E-002, -1.217678880E-005, 1.892588940E-009, -1.098954600E-013, -5.289006710E+004, -1.564778080E+002] ) ), note = "3/ 3/98 trm" ) species(name = "bc8h16oh-co2", atoms = " C:8 H:17 O:3 ", thermo = ( NASA( [ 300.00, 1401.00], [-1.151750270E+000, 1.251223160E-001, -1.024725820E-004, 4.441906350E-008, -7.841389600E-012, -4.828189420E+004, 3.715380440E+001] ), NASA( [ 1401.00, 5000.00], [ 3.257140330E+001, 3.739969250E-002, -1.273768340E-005, 1.971650200E-009, -1.141436610E-013, -5.914896070E+004, -1.408689350E+002] ) ), note = "3/ 3/98 trm" ) species(name = "bc8h16o-co2h", atoms = " C:8 H:17 O:3 ", thermo = ( NASA( [ 300.00, 1401.00], [-1.973098940E+000, 1.315018670E-001, -1.093424160E-004, 4.721360870E-008, -8.231076670E-012, -4.028332220E+004, 3.936738190E+001] ), NASA( [ 1401.00, 5000.00], [ 3.495650160E+001, 3.568491350E-002, -1.221787390E-005, 1.898211450E-009, -1.101864580E-013, -5.213504280E+004, -1.555481830E+002] ) ), note = "3/ 3/98 trm" ) species(name = "cc8h16oh-do2", atoms = " C:8 H:17 O:3 ", thermo = ( NASA( [ 300.00, 1398.00], [-1.467053300E-001, 1.183542660E-001, -9.106798910E-005, 3.710214600E-008, -6.221580620E-012, -4.717504070E+004, 3.471102490E+001] ), NASA( [ 1398.00, 5000.00], [ 3.236959850E+001, 3.771317630E-002, -1.287893340E-005, 1.997280400E-009, -1.157851610E-013, -5.803949750E+004, -1.383269840E+002] ) ), note = "3/ 3/98 trm" ) species(name = "cc8h16o-do2h", atoms = " C:8 H:17 O:3 ", thermo = ( NASA( [ 300.00, 1398.00], [-1.063803310E+000, 1.251770780E-001, -9.857229760E-005, 4.026478810E-008, -6.687294770E-012, -3.916270860E+004, 3.736308370E+001] ), NASA( [ 1398.00, 5000.00], [ 3.477891290E+001, 3.596534950E-002, -1.234504440E-005, 1.921371250E-009, -1.116732820E-013, -5.103224950E+004, -1.531397780E+002] ) ), note = "3/ 3/98 trm" ) species(name = "dc8h16oh-co2", atoms = " C:8 H:17 O:3 ", thermo = ( NASA( [ 300.00, 1400.00], [-4.593931790E-001, 1.200884430E-001, -9.459106980E-005, 3.950628010E-008, -6.760373900E-012, -4.612571950E+004, 3.540738390E+001] ), NASA( [ 1400.00, 5000.00], [ 3.205235060E+001, 3.767506970E-002, -1.279777390E-005, 1.977528750E-009, -1.143484410E-013, -5.679682770E+004, -1.369503370E+002] ) ), note = "3/ 3/98 trm" ) species(name = "dc8h16o-co2h", atoms = " C:8 H:17 O:3 ", thermo = ( NASA( [ 300.00, 1401.00], [-1.374642410E+000, 1.269035690E-001, -1.020852210E-004, 4.266379780E-008, -7.225195080E-012, -3.811367700E+004, 3.805079290E+001] ), NASA( [ 1401.00, 5000.00], [ 3.446080140E+001, 3.592901400E-002, -1.226471760E-005, 1.901772050E-009, -1.102463280E-013, -4.978938650E+004, -1.517585630E+002] ) ), note = "3/ 3/98 trm" ) #------------------------------------------------------------------------------- # Reaction data #------------------------------------------------------------------------------- # Reaction 1 falloff_reaction( "ch3 + h (+ M) <=> ch4 (+ M)", kf = [2.13800E+015, -0.4, 0], kf0 = [3.31000E+030, -4, 2108], falloff = Troe(A = 0, T3 = 1e-015, T1 = 1e-015, T2 = 40), efficiencies = " co:2 co2:3 h2:2 h2o:5 ") # [CK Reaction (+2)] # Reaction 2 # rev / 1.054E+21 -1.40 1.079E+05 / reaction( "ch4 + h => ch3 + h2", [1.72700E+004, 3, 8224]) # [CK Reaction (-2)] # Reaction 3 # rev / 1.054E+21 -1.40 1.079E+05 / reaction( "ch3 + h2 => ch4 + h", [6.61000E+002, 3, 7744]) # [CK Reaction (+3)] # Reaction 4 reaction( "ch4 + oh => ch3 + h2o", [1.93000E+005, 2.4, 2106]) # [CK Reaction (-3)] # Reaction 5 reaction( "ch3 + h2o => ch4 + oh", [4.82000E+002, 2.9, 14860]) # [CK Reaction (+4)] # Reaction 6 reaction( "ch4 + o => ch3 + oh", [2.13000E+006, 2.21, 6480]) # [CK Reaction (-4)] # Reaction 7 reaction( "ch3 + oh => ch4 + o", [3.55700E+004, 2.21, 3920]) # [CK Reaction (+5)] # Reaction 8 reaction( "c2h6 + ch3 => c2h5 + ch4", [1.51000E-007, 6, 6047]) # [CK Reaction (-5)] # Reaction 9 reaction( "c2h5 + ch4 => c2h6 + ch3", [9.64900E-010, 6.56, 10220]) # [CK Reaction (+6)] # Reaction 10 reaction( "hco + oh => co + h2o", [1.02000E+014, 0, 0]) # [CK Reaction (-6)] # Reaction 11 reaction( "co + h2o => hco + oh", [2.89600E+015, 0, 105200]) # [CK Reaction (+7)] # Reaction 12 reaction( "co + oh => co2 + h", [1.40000E+005, 1.95, -1347]) # [CK Reaction (-7)] # Reaction 13 reaction( "co2 + h => co + oh", [1.56800E+007, 1.95, 20990]) # [CK Reaction (+8)] # Reaction 14 reaction( "h + o2 => o + oh", [1.97000E+014, 0, 16540]) # [CK Reaction (-8)] # Reaction 15 reaction( "o + oh => h + o2", [1.55500E+013, 0, 425]) # [CK Reaction (+9)] # Reaction 16 reaction( "o + h2 => h + oh", [5.08000E+004, 2.67, 6292]) # [CK Reaction (-9)] # Reaction 17 reaction( "h + oh => o + h2", [2.23100E+004, 2.67, 4197]) # [CK Reaction (+10)] # Reaction 18 reaction( "o + h2o => oh + oh", [2.97000E+006, 2.02, 13400]) # [CK Reaction (-10)] # Reaction 19 reaction( "oh + oh => o + h2o", [3.01300E+005, 2.02, -3850]) # [CK Reaction (+11)] # Reaction 20 reaction( "oh + h2 => h + h2o", [2.16000E+008, 1.51, 3430]) # [CK Reaction (-11)] # Reaction 21 reaction( "h + h2o => oh + h2", [9.35200E+008, 1.51, 18580]) # [CK Reaction (+12)] # Reaction 22 three_body_reaction( "hco + M => h + co + M", [1.86000E+017, -1, 17000]) # [CK Reaction (-12)] # Reaction 23 three_body_reaction( "h + co + M => hco + M", [6.46700E+013, 0, -442]) # [CK Reaction (+13)] # Reaction 24 reaction( "h2o2 + oh => h2o + ho2", [1.00000E+012, 0, 0], options = 'duplicate') # [CK Reaction (-13)] # Reaction 25 reaction( "h2o + ho2 => h2o2 + oh", [1.68500E+011, 0.33, 31460], options = 'duplicate') # [CK Reaction (+14)] # Reaction 26 reaction( "c2h4 + o => ch3 + hco", [1.02000E+007, 1.88, 179]) # [CK Reaction (-14)] # Reaction 27 reaction( "ch3 + hco => c2h4 + o", [2.85100E+008, 1.05, 31770]) # [CK Reaction (15)] # Reaction 28 falloff_reaction( "h + c2h4 (+ M) <=> c2h5 (+ M)", kf = [1.08100E+012, 0.45, 1822], kf0 = [1.11200E+034, -5, 4448], falloff = Troe(A = 1, T3 = 1e-015, T1 = 95, T2 = 200), efficiencies = " co:2 co2:3 h2:2 h2o:5 ") # [CK Reaction (16)] # Reaction 29 # rev / 3.587E+14 -0.34 3.957E+04 / falloff_reaction( "ch3oh (+ M) <=> ch3 + oh (+ M)", kf = [1.90000E+016, 0, 91730], kf0 = [2.95000E+044, -7.35, 95460], falloff = Troe(A = 0.414, T3 = 279, T1 = 5459, T2 = 1e+010), efficiencies = " co:2 co2:3 h2:2 h2o:16 ") # [CK Reaction (+17)] # Reaction 30 # rev / 9.181E+10 1.00 7.450E+02 / reaction( "c2h6 + h => c2h5 + h2", [5.54000E+002, 3.5, 5167]) # [CK Reaction (-17)] # Reaction 31 # rev / 9.181E+10 1.00 7.450E+02 / reaction( "c2h5 + h2 => c2h6 + h", [1.35500E-001, 4.06, 8857]) # [CK Reaction (+18)] # Reaction 32 reaction( "ch3oh + ho2 => ch2oh + h2o2", [3.98000E+013, 0, 19400]) # [CK Reaction (-18)] # Reaction 33 reaction( "ch2oh + h2o2 => ch3oh + ho2", [3.13000E+015, -0.9, 10750]) # [CK Reaction (+19)] # Reaction 34 reaction( "c2h5 + o2 => c2h4 + ho2", [1.22000E+030, -5.76, 10100]) # [CK Reaction (-19)] # Reaction 35 reaction( "c2h4 + ho2 => c2h5 + o2", [1.25900E+030, -5.63, 22310]) # [CK Reaction (+20)] # Reaction 36 reaction( "c2h6 + oh => c2h5 + h2o", [5.12500E+006, 2.06, 855]) # [CK Reaction (-20)] # Reaction 37 reaction( "c2h5 + h2o => c2h6 + oh", [1.01000E+007, 2.06, 22980]) # [CK Reaction (+21)] # Reaction 38 reaction( "c2h6 + o => c2h5 + oh", [1.13000E+014, 0, 7850]) # [CK Reaction (-21)] # Reaction 39 reaction( "c2h5 + oh => c2h6 + o", [2.08000E+013, 0, 12720]) # [CK Reaction (+22)] # Reaction 40 reaction( "ch3 + ho2 => ch3o + oh", [1.10000E+013, 0, 0]) # [CK Reaction (-22)] # Reaction 41 reaction( "ch3o + oh => ch3 + ho2", [4.78000E+014, -0.35, 24550]) # [CK Reaction (+23)] # Reaction 42 reaction( "co + ho2 => co2 + oh", [3.01000E+013, 0, 23000]) # [CK Reaction (-23)] # Reaction 43 reaction( "co2 + oh => co + ho2", [6.43500E+015, -0.33, 84610]) # [CK Reaction (24)] # Reaction 44 falloff_reaction( "ch3 + ch3 (+ M) <=> c2h6 (+ M)", kf = [9.21400E+016, -1.17, 635.8], kf0 = [1.13500E+036, -5.246, 1705], falloff = Troe(A = 0.405, T3 = 1120, T1 = 69.6, T2 = 1e+015), efficiencies = " co:2 co2:3 h2:2 h2o:5 ") # [CK Reaction (+25)] # Reaction 45 # rev / 4.709E+21 -1.70 8.741E+04 / three_body_reaction( "h2o + M => h + oh + M", [1.83700E+027, -3, 122600], efficiencies = " co:1.9 co2:3.8 h2:2.5 h2o:12 ") # [CK Reaction (-25)] # Reaction 46 # rev / 4.709E+21 -1.70 8.741E+04 / three_body_reaction( "h + oh + M => h2o + M", [2.25000E+022, -2, 0], efficiencies = " co:1.9 co2:3.8 h2:2.5 h2o:12 ") # [CK Reaction (26)] # Reaction 47 falloff_reaction( "h + o2 (+ M) <=> ho2 (+ M)", kf = [1.47500E+012, 0.6, 0], kf0 = [3.50000E+016, -0.41, -1116], falloff = Troe(A = 0.5, T3 = 1e-030, T1 = 1e+030, T2 = 1e+010), efficiencies = " co:1.9 co2:3.8 h2:2.5 h2o:12 ") # [CK Reaction (27)] # Reaction 48 # rev/ 5.053E+14 -0.07 4.996E+04 / falloff_reaction( "co + o (+ M) <=> co2 (+ M)", kf = [1.80000E+010, 0, 2384], kf0 = [1.35000E+024, -2.788, 4191], efficiencies = " co:1.9 co2:3.8 h2:2.5 h2o:12 ") # [CK Reaction (+28)] # Reaction 49 # rev/ 1.670E+16 -1.00 1.301E+05 / reaction( "co + o2 => co2 + o", [1.06800E-015, 7.13, 13320]) # [CK Reaction (-28)] # Reaction 50 # rev/ 1.670E+16 -1.00 1.301E+05 / reaction( "co2 + o => co + o2", [9.44400E-015, 7.13, 19540]) # [CK Reaction (+29)] # Reaction 51 reaction( "hco + h => co + h2", [7.34000E+013, 0, 0]) # [CK Reaction (-29)] # Reaction 52 reaction( "co + h2 => hco + h", [4.81300E+014, 0, 90000]) # [CK Reaction (+30)] # Reaction 53 reaction( "hco + o => co + oh", [3.02000E+013, 0, 0]) # [CK Reaction (-30)] # Reaction 54 reaction( "co + oh => hco + o", [8.69700E+013, 0, 87900]) # [CK Reaction (+31)] # Reaction 55 three_body_reaction( "ch2o + M => hco + h + M", [6.28300E+029, -3.57, 93200]) # [CK Reaction (-31)] # Reaction 56 three_body_reaction( "hco + h + M => ch2o + M", [2.66000E+024, -2.57, 427]) # [CK Reaction (+32)] # Reaction 57 reaction( "ch2o + oh => hco + h2o", [3.43000E+009, 1.18, -447]) # [CK Reaction (-32)] # Reaction 58 reaction( "hco + h2o => ch2o + oh", [1.18600E+009, 1.18, 29380]) # [CK Reaction (+33)] # Reaction 59 reaction( "ch2o + h => hco + h2", [9.33400E+008, 1.5, 2976]) # [CK Reaction (-33)] # Reaction 60 reaction( "hco + h2 => ch2o + h", [7.45300E+007, 1.5, 17650]) # [CK Reaction (+34)] # Reaction 61 reaction( "ch2o + o => hco + oh", [4.16000E+011, 0.57, 2762]) # [CK Reaction (-34)] # Reaction 62 reaction( "hco + oh => ch2o + o", [1.45900E+010, 0.57, 15340]) # [CK Reaction (+35)] # Reaction 63 reaction( "ch3 + oh => ch2o + h2", [2.25000E+013, 0, 4300]) # [CK Reaction (-35)] # Reaction 64 reaction( "ch2o + h2 => ch3 + oh", [6.75600E+014, 0, 76030]) # [CK Reaction (+36)] # Reaction 65 reaction( "ch3 + o => ch2o + h", [8.00000E+013, 0, 0]) # [CK Reaction (-36)] # Reaction 66 reaction( "ch2o + h => ch3 + o", [1.05500E+015, 0, 69630]) # [CK Reaction (+37)] # Reaction 67 reaction( "ch3 + o2 => ch3o + o", [1.99500E+018, -1.57, 29210]) # [CK Reaction (-37)] # Reaction 68 reaction( "ch3o + o => ch3 + o2", [3.58500E+018, -1.59, -1631]) # [CK Reaction (+38)] # Reaction 69 reaction( "ch2o + ch3 => hco + ch4", [3.63600E-006, 5.42, 998]) # [CK Reaction (-38)] # Reaction 70 reaction( "hco + ch4 => ch2o + ch3", [7.58400E-006, 5.42, 16150]) # [CK Reaction (+39)] # Reaction 71 reaction( "hco + ch3 => ch4 + co", [1.21000E+014, 0, 0]) # [CK Reaction (-39)] # Reaction 72 reaction( "ch4 + co => hco + ch3", [2.07300E+016, 0, 90480]) # [CK Reaction (40)] # Reaction 73 falloff_reaction( "ch3o (+ M) <=> ch2o + h (+ M)", kf = [5.45000E+013, 0, 13500], kf0 = [2.34400E+025, -2.7, 30600]) # [CK Reaction (41)] # Reaction 74 # rev / 3.812E+09 1.02 -7.489E+03 / falloff_reaction( "c2h4 (+ M) <=> c2h2 + h2 (+ M)", kf = [1.80000E+013, 0, 76000], kf0 = [1.50000E+015, 0, 55443]) # [CK Reaction (+42)] # Reaction 75 # rev / 1.877E+11 0.17 3.478E+04 / reaction( "ho2 + o => oh + o2", [3.25000E+013, 0, 0]) # [CK Reaction (-42)] # Reaction 76 # rev / 1.877E+11 0.17 3.478E+04 / reaction( "oh + o2 => ho2 + o", [7.85700E+014, -0.33, 55390]) # [CK Reaction (+43)] # Reaction 77 reaction( "hco + ho2 => ch2o + o2", [2.97400E+010, 0.33, -3861]) # [CK Reaction (-43)] # Reaction 78 reaction( "ch2o + o2 => hco + ho2", [2.05000E+013, 0, 38950]) # [CK Reaction (+44)] # Reaction 79 reaction( "ch3o + o2 => ch2o + ho2", [5.50000E+010, 0, 2424]) # [CK Reaction (-44)] # Reaction 80 reaction( "ch2o + ho2 => ch3o + o2", [1.31800E+009, 0.35, 31390]) # [CK Reaction (+45)] # Reaction 81 reaction( "ch3 + ho2 => ch4 + o2", [3.60000E+012, 0, 0]) # [CK Reaction (-45)] # Reaction 82 reaction( "ch4 + o2 => ch3 + ho2", [5.17700E+015, -0.33, 57960]) # [CK Reaction (+46)] # Reaction 83 reaction( "hco + o2 => co + ho2", [7.58000E+012, 0, 410]) # [CK Reaction (-46)] # Reaction 84 reaction( "co + ho2 => hco + o2", [9.02900E+011, 0.33, 32930]) # [CK Reaction (+47)] # Reaction 85 reaction( "ho2 + h => oh + oh", [7.08000E+013, 0, 300]) # [CK Reaction (-47)] # Reaction 86 reaction( "oh + oh => ho2 + h", [1.35200E+014, -0.33, 39570]) # [CK Reaction (+48)] # Reaction 87 reaction( "ho2 + h => h2 + o2", [1.66000E+013, 0, 820]) # [CK Reaction (-48)] # Reaction 88 reaction( "h2 + o2 => ho2 + h", [9.13800E+014, -0.33, 58300]) # [CK Reaction (+49)] # Reaction 89 reaction( "ho2 + oh => h2o + o2", [2.89000E+013, 0, -500]) # [CK Reaction (-49)] # Reaction 90 reaction( "h2o + o2 => ho2 + oh", [6.88800E+015, -0.33, 72140]) # [CK Reaction (+50)] # Reaction 91 reaction( "h2o2 + o2 => ho2 + ho2", [5.94200E+017, -0.66, 53150], options = 'duplicate') # [CK Reaction (-50)] # Reaction 92 reaction( "ho2 + ho2 => h2o2 + o2", [4.20000E+014, 0, 11980], options = 'duplicate') # [CK Reaction (51)] # Reaction 93 falloff_reaction( "oh + oh (+ M) <=> h2o2 (+ M)", kf = [1.23600E+014, -0.37, 0], kf0 = [3.04100E+030, -4.63, 2049], falloff = Troe(A = 0.47, T3 = 100, T1 = 2000, T2 = 1e+015), efficiencies = " co:1.9 co2:3.8 h2:2.5 h2o:12 ") # [CK Reaction (+52)] # Reaction 94 # rev / 3.138E+19 -1.37 5.186E+04 / reaction( "h2o2 + h => h2o + oh", [2.41000E+013, 0, 3970]) # [CK Reaction (-52)] # Reaction 95 # rev / 3.138E+19 -1.37 5.186E+04 / reaction( "h2o + oh => h2o2 + h", [7.75000E+012, 0, 74710]) # [CK Reaction (+53)] # Reaction 96 reaction( "ch4 + ho2 => ch3 + h2o2", [3.42000E+011, 0, 19290]) # [CK Reaction (-53)] # Reaction 97 reaction( "ch3 + h2o2 => ch4 + ho2", [3.36500E+011, -0.33, 2502]) # [CK Reaction (+54)] # Reaction 98 reaction( "ch2o + ho2 => hco + h2o2", [5.82000E-003, 4.53, 6557]) # [CK Reaction (-54)] # Reaction 99 reaction( "hco + h2o2 => ch2o + ho2", [1.19400E-002, 4.2, 4921]) # [CK Reaction (+55)] # Reaction 100 three_body_reaction( "oh + M => o + h + M", [3.90900E+022, -2, 105300], efficiencies = " co:1.9 co2:3.8 h2:2.5 h2o:12 ") # [CK Reaction (-55)] # Reaction 101 three_body_reaction( "o + h + M => oh + M", [4.72000E+018, -1, 0], efficiencies = " co:1.9 co2:3.8 h2:2.5 h2o:12 ") # [CK Reaction (+56)] # Reaction 102 three_body_reaction( "o2 + M => o + o + M", [6.47300E+020, -1.5, 121500], efficiencies = " co:1.9 co2:3.8 h2:2.5 h2o:12 ") # [CK Reaction (-56)] # Reaction 103 three_body_reaction( "o + o + M => o2 + M", [6.17000E+015, -0.5, 0], efficiencies = " co:1.9 co2:3.8 h2:2.5 h2o:12 ") # [CK Reaction (+57)] # Reaction 104 three_body_reaction( "h2 + M => h + h + M", [4.57000E+019, -1.4, 104400], efficiencies = " co:1.9 co2:3.8 h2:2.5 h2o:12 ") # [CK Reaction (-57)] # Reaction 105 three_body_reaction( "h + h + M => h2 + M", [2.42300E+015, -0.4, -3040], efficiencies = " co:1.9 co2:3.8 h2:2.5 h2o:12 ") # [CK Reaction (58)] # Reaction 106 falloff_reaction( "c2h3 + h (+ M) <=> c2h4 (+ M)", kf = [6.10000E+012, 0.27, 280], kf0 = [9.80000E+029, -3.86, 3320], falloff = Troe(A = 0.782, T3 = 208, T1 = 2663, T2 = 6095)) # [CK Reaction (+59)] # Reaction 107 # rev/ 1.692E+15 0.10 1.071E+05 / reaction( "c2h5 + c2h3 => c2h4 + c2h4", [3.00000E+012, 0, 0]) # [CK Reaction (-59)] # Reaction 108 # rev/ 1.692E+15 0.10 1.071E+05 / reaction( "c2h4 + c2h4 => c2h5 + c2h3", [4.82000E+014, 0, 71530]) # [CK Reaction (60)] # Reaction 109 falloff_reaction( "c2h2 + h (+ M) <=> c2h3 (+ M)", kf = [3.11000E+011, 0.58, 2589], kf0 = [2.25400E+040, -7.269, 6577], falloff = Troe(A = 1, T3 = 1e-015, T1 = 675, T2 = 1e+015), efficiencies = " co:2 co2:3 h2:2 h2o:5 ") # [CK Reaction (+61)] # Reaction 110 # rev/ 2.028E+15 -0.42 4.446E+04 / reaction( "c2h4 + h => c2h3 + h2", [8.42000E-003, 4.62, 2583]) # [CK Reaction (-61)] # Reaction 111 # rev/ 2.028E+15 -0.42 4.446E+04 / reaction( "c2h3 + h2 => c2h4 + h", [5.72300E-001, 3.79, 3233]) # [CK Reaction (+62)] # Reaction 112 reaction( "c2h4 + oh => c2h3 + h2o", [2.02000E+013, 0, 5955]) # [CK Reaction (-62)] # Reaction 113 reaction( "c2h3 + h2o => c2h4 + oh", [1.01500E+013, 0, 20220]) # [CK Reaction (+63)] # Reaction 114 reaction( "c2h3 + o2 => c2h2 + ho2", [5.19000E-015, -1.26, 3310], options = 'duplicate') # [CK Reaction (-63)] # Reaction 115 reaction( "c2h2 + ho2 => c2h3 + o2", [2.72700E-016, -0.93, 11400], options = 'duplicate') # [CK Reaction (+64)] # Reaction 116 three_body_reaction( "c2h2 + M => c2h + h + M", [4.20000E+016, 0, 107000]) # [CK Reaction (-64)] # Reaction 117 three_body_reaction( "c2h + h + M => c2h2 + M", [7.13000E+007, 2.08, -28910]) # [CK Reaction (+65)] # Reaction 118 reaction( "c2h2 + o2 => hcco + oh", [2.00000E+008, 1.5, 30100]) # [CK Reaction (-65)] # Reaction 119 reaction( "hcco + oh => c2h2 + o2", [2.23200E+005, 1.5, 25400]) # [CK Reaction (+66)] # Reaction 120 reaction( "ch2 + o2 => co + h2o", [7.28000E+019, -2.54, 1809]) # [CK Reaction (-66)] # Reaction 121 reaction( "co + h2o => ch2 + o2", [8.50800E+020, -2.54, 179800]) # [CK Reaction (+67)] # Reaction 122 reaction( "c2h2 + oh => c2h + h2o", [3.37000E+007, 2, 14000]) # [CK Reaction (-67)] # Reaction 123 reaction( "c2h + h2o => c2h2 + oh", [4.67100E+003, 3.08, 685]) # [CK Reaction (+68)] # Reaction 124 reaction( "o + c2h2 => c2h + oh", [3.16000E+015, -0.6, 15000]) # [CK Reaction (-68)] # Reaction 125 reaction( "c2h + oh => o + c2h2", [4.44300E+010, 0.48, -15570]) # [CK Reaction (+69)] # Reaction 126 reaction( "c2h2 + o => ch2 + co", [6.12000E+006, 2, 1900]) # [CK Reaction (-69)] # Reaction 127 reaction( "ch2 + co => c2h2 + o", [1.15200E+006, 2, 52570]) # [CK Reaction (+70)] # Reaction 128 reaction( "c2h + o2 => hco + co", [2.41000E+012, 0, 0]) # [CK Reaction (-70)] # Reaction 129 reaction( "hco + co => c2h + o2", [1.32800E+016, -1.08, 154100]) # [CK Reaction (+71)] # Reaction 130 reaction( "c2h + o => co + ch", [1.81000E+013, 0, 0]) # [CK Reaction (-71)] # Reaction 131 reaction( "co + ch => c2h + o", [7.47800E+016, -1.08, 82130]) # [CK Reaction (+72)] # Reaction 132 reaction( "ch2 + o2 => hco + oh", [1.29000E+020, -3.3, 284]) # [CK Reaction (-72)] # Reaction 133 reaction( "hco + oh => ch2 + o2", [5.31000E+019, -3.3, 73170]) # [CK Reaction (73)] # Reaction 134 reaction( "ch2 + o <=> co + h + h", [5.00000E+013, 0, 0]) # [CK Reaction (+74)] # Reaction 135 reaction( "ch2 + h => ch + h2", [1.00000E+018, -1.56, 0]) # [CK Reaction (-74)] # Reaction 136 reaction( "ch + h2 => ch2 + h", [7.02600E+017, -1.56, 2990]) # [CK Reaction (+75)] # Reaction 137 reaction( "ch2 + oh => ch + h2o", [1.13000E+007, 2, 3000]) # [CK Reaction (-75)] # Reaction 138 reaction( "ch + h2o => ch2 + oh", [3.43700E+007, 2, 21150]) # [CK Reaction (76)] # Reaction 139 reaction( "ch2 + o2 <=> co2 + h + h", [3.29000E+021, -3.3, 2868]) # [CK Reaction (+77)] # Reaction 140 reaction( "ch + o2 => hco + o", [3.30000E+013, 0, 0]) # [CK Reaction (-77)] # Reaction 141 reaction( "hco + o => ch + o2", [4.40200E+013, 0, 71990]) # [CK Reaction (+78)] # Reaction 142 reaction( "ch3oh + oh => ch2oh + h2o", [7.10000E+006, 1.8, -596]) # [CK Reaction (-78)] # Reaction 143 reaction( "ch2oh + h2o => ch3oh + oh", [3.29300E+001, 3.46, 22720]) # [CK Reaction (+79)] # Reaction 144 reaction( "ch3oh + h => ch3o + h2", [3.60000E+012, 0, 6095]) # [CK Reaction (-79)] # Reaction 145 reaction( "ch3o + h2 => ch3oh + h", [7.46700E+012, -0.02, 7825]) # [CK Reaction (+80)] # Reaction 146 reaction( "ch3oh + h => ch2oh + h2", [1.44000E+013, 0, 6095]) # [CK Reaction (-80)] # Reaction 147 reaction( "ch2oh + h2 => ch3oh + h", [1.54300E+007, 1.66, 14250]) # [CK Reaction (+81)] # Reaction 148 reaction( "ch3oh + ch3 => ch2oh + ch4", [3.19000E+001, 3.17, 7172]) # [CK Reaction (-81)] # Reaction 149 reaction( "ch2oh + ch4 => ch3oh + ch3", [8.92700E-004, 4.83, 15810]) # [CK Reaction (+82)] # Reaction 150 reaction( "ch3oh + o => ch2oh + oh", [3.88000E+005, 2.5, 3080]) # [CK Reaction (-82)] # Reaction 151 reaction( "ch2oh + oh => ch3oh + o", [4.96000E+003, 2.5, 8781]) # [CK Reaction (+83)] # Reaction 152 reaction( "ch2oh + o2 => ch2o + ho2", [3.81000E+006, 2, 1641]) # [CK Reaction (-83)] # Reaction 153 reaction( "ch2o + ho2 => ch2oh + o2", [1.76800E+011, 0.67, 24180]) # [CK Reaction (84)] # Reaction 154 falloff_reaction( "ch2oh (+ M) <=> ch2o + h (+ M)", kf = [2.80000E+014, -0.73, 32820], kf0 = [6.01000E+033, -5.39, 36200], falloff = Troe(A = 0.96, T3 = 67.6, T1 = 1855, T2 = 7543)) # [CK Reaction (+85)] # Reaction 155 # rev / 3.792E+16 -1.39 5.402E+03 / reaction( "c2h3 + o2 => c2h2 + ho2", [2.12000E-006, 6, 9484], options = 'duplicate') # [CK Reaction (-85)] # Reaction 156 # rev / 3.792E+16 -1.39 5.402E+03 / reaction( "c2h2 + ho2 => c2h3 + o2", [1.11400E-007, 6.33, 17570], options = 'duplicate') # [CK Reaction (+86)] # Reaction 157 reaction( "h2o2 + o => oh + ho2", [9.55000E+006, 2, 3970]) # [CK Reaction (-86)] # Reaction 158 reaction( "oh + ho2 => h2o2 + o", [2.54100E+007, 1.68, 19850]) # [CK Reaction (+87)] # Reaction 159 reaction( "c2h2 + o => hcco + h", [1.43000E+007, 2, 1900]) # [CK Reaction (-87)] # Reaction 160 reaction( "hcco + h => c2h2 + o", [2.02100E+005, 2, 13310]) # [CK Reaction (+88)] # Reaction 161 reaction( "c2h2 + oh => ch2co + h", [2.19000E-004, 4.5, -1000]) # [CK Reaction (-88)] # Reaction 162 reaction( "ch2co + h => c2h2 + oh", [2.16100E-003, 4.5, 19670]) # [CK Reaction (+89)] # Reaction 163 reaction( "ch2co + h => ch3 + co", [1.10000E+013, 0, 3400]) # [CK Reaction (-89)] # Reaction 164 reaction( "ch3 + co => ch2co + h", [2.40000E+012, 0, 40200]) # [CK Reaction (+90)] # Reaction 165 reaction( "ch2co + o => ch2 + co2", [1.75000E+012, 0, 1350]) # [CK Reaction (-90)] # Reaction 166 reaction( "ch2 + co2 => ch2co + o", [3.73900E+012, 0, 53690]) # [CK Reaction (+91)] # Reaction 167 reaction( "ch2 + o2 => ch2o + o", [3.29000E+021, -3.3, 2868]) # [CK Reaction (-91)] # Reaction 168 reaction( "ch2o + o => ch2 + o2", [3.86200E+022, -3.3, 63180]) # [CK Reaction (92)] # Reaction 169 falloff_reaction( "ch2co (+ M) <=> ch2 + co (+ M)", kf = [3.00000E+014, 0, 70980], kf0 = [3.60000E+015, 0, 59270]) # [CK Reaction (+93)] # Reaction 170 # rev / 6.909E+08 1.00 -4.360E+03 / reaction( "ch2co + o => hcco + oh", [1.00000E+013, 0, 8000]) # [CK Reaction (-93)] # Reaction 171 # rev / 6.909E+08 1.00 -4.360E+03 / reaction( "hcco + oh => ch2co + o", [1.43200E+010, 0, -1255]) # [CK Reaction (+94)] # Reaction 172 reaction( "ch2co + oh => hcco + h2o", [1.00000E+013, 0, 2000]) # [CK Reaction (-94)] # Reaction 173 reaction( "hcco + h2o => ch2co + oh", [1.41200E+011, 0, 9995]) # [CK Reaction (+95)] # Reaction 174 reaction( "ch2co + h => hcco + h2", [2.00000E+014, 0, 8000]) # [CK Reaction (-95)] # Reaction 175 reaction( "hcco + h2 => ch2co + h", [6.52200E+011, 0, 840]) # [CK Reaction (+96)] # Reaction 176 reaction( "hcco + oh => hco + hco", [1.00000E+013, 0, 0]) # [CK Reaction (-96)] # Reaction 177 reaction( "hco + hco => hcco + oh", [4.82000E+013, 0, 40360]) # [CK Reaction (+97)] # Reaction 178 reaction( "hcco + h => ch2(s) + co", [1.10000E+014, 0, 0]) # [CK Reaction (-97)] # Reaction 179 reaction( "ch2(s) + co => hcco + h", [6.66000E+013, 0, 39260]) # [CK Reaction (98)] # Reaction 180 reaction( "hcco + o <=> h + co + co", [8.00000E+013, 0, 0]) # [CK Reaction (+99)] # Reaction 181 reaction( "c2h6 + o2 => c2h5 + ho2", [4.00000E+013, 0, 50900]) # [CK Reaction (-99)] # Reaction 182 reaction( "c2h5 + ho2 => c2h6 + o2", [3.00000E+011, 0, 0]) # [CK Reaction (+100)] # Reaction 183 reaction( "c2h6 + ho2 => c2h5 + h2o2", [1.70000E+013, 0, 20460]) # [CK Reaction (-100)] # Reaction 184 reaction( "c2h5 + h2o2 => c2h6 + ho2", [1.06900E+011, 0.24, 7842]) # [CK Reaction (+101)] # Reaction 185 reaction( "ch2 + o2 => co2 + h2", [1.01000E+021, -3.3, 1508]) # [CK Reaction (-101)] # Reaction 186 reaction( "co2 + h2 => ch2 + o2", [3.05400E+023, -3.3, 186700]) # [CK Reaction (+102)] # Reaction 187 reaction( "ch3 + c2h3 => ch4 + c2h2", [3.92000E+011, 0, 0]) # [CK Reaction (-102)] # Reaction 188 reaction( "ch4 + c2h2 => ch3 + c2h3", [2.96200E+013, 0, 66050]) # [CK Reaction (+103)] # Reaction 189 reaction( "ch3 + c2h5 => ch4 + c2h4", [1.95000E+013, -0.5, 0]) # [CK Reaction (-103)] # Reaction 190 reaction( "ch4 + c2h4 => ch3 + c2h5", [2.89500E+016, -0.7, 70170]) # [CK Reaction (+104)] # Reaction 191 reaction( "ch3oh + ch2o => ch3o + ch3o", [3.83500E+013, 0.05, 84720]) # [CK Reaction (-104)] # Reaction 192 reaction( "ch3o + ch3o => ch3oh + ch2o", [6.03000E+013, 0, 0]) # [CK Reaction (+105)] # Reaction 193 reaction( "ch2o + ch3o => ch3oh + hco", [1.15000E+011, 0, 1280]) # [CK Reaction (-105)] # Reaction 194 reaction( "ch3oh + hco => ch2o + ch3o", [3.02000E+011, 0, 18160]) # [CK Reaction (+106)] # Reaction 195 reaction( "ch4 + ch3o => ch3 + ch3oh", [1.57000E+011, 0, 8842]) # [CK Reaction (-106)] # Reaction 196 reaction( "ch3 + ch3oh => ch4 + ch3o", [1.04600E+009, 0, 50000]) # [CK Reaction (+107)] # Reaction 197 reaction( "c2h6 + ch3o => c2h5 + ch3oh", [3.00000E+011, 0, 7000]) # [CK Reaction (-107)] # Reaction 198 reaction( "c2h5 + ch3oh => c2h6 + ch3o", [1.71400E+010, 0, 50000]) # [CK Reaction (+108)] # Reaction 199 reaction( "c2h3 + h => c2h2 + h2", [2.00000E+013, 0, 2500]) # [CK Reaction (-108)] # Reaction 200 reaction( "c2h2 + h2 => c2h3 + h", [1.33100E+013, 0, 68080]) # [CK Reaction (+109)] # Reaction 201 reaction( "ch3o + ch3oh => ch2oh + ch3oh", [3.00000E+011, 0, 4074]) # [CK Reaction (-109)] # Reaction 202 reaction( "ch2oh + ch3oh => ch3o + ch3oh", [1.54900E+005, 1.68, 10500]) # [CK Reaction (+110)] # Reaction 203 reaction( "ch3oh + oh => ch3o + h2o", [1.00000E+006, 2.1, 496.7]) # [CK Reaction (-110)] # Reaction 204 reaction( "ch3o + h2o => ch3oh + oh", [8.98100E+006, 2.08, 17380]) # [CK Reaction (+111)] # Reaction 205 reaction( "c2h5 + h => ch3 + ch3", [3.61000E+013, 0, 0]) # [CK Reaction (-111)] # Reaction 206 reaction( "ch3 + ch3 => c2h5 + h", [5.44600E+016, -1.03, 16980]) # [CK Reaction (+112)] # Reaction 207 reaction( "c2h3 + o2 => ch2o + hco", [1.70000E+029, -5.31, 6500]) # [CK Reaction (-112)] # Reaction 208 reaction( "ch2o + hco => c2h3 + o2", [1.65700E+029, -5.31, 93050]) # [CK Reaction (+113)] # Reaction 209 reaction( "c2h6 => c2h5 + h", [2.78300E+021, -1.56, 103800]) # [CK Reaction (-113)] # Reaction 210 reaction( "c2h5 + h => c2h6", [3.61000E+013, 0, 0]) # [CK Reaction (114)] # Reaction 211 falloff_reaction( "c2h5oh (+ M) <=> ch2oh + ch3 (+ M)", kf = [5.71000E+023, -1.68, 94410], kf0 = [3.11000E+085, -18.84, 113100], falloff = Troe(A = 0.5, T3 = 550, T1 = 825, T2 = 6100), efficiencies = " co:2 co2:3 h2:2 h2o:5 ") # [CK Reaction (115)] # Reaction 212 # rev / 1.307E+17 -0.49 9.163E+03 / falloff_reaction( "c2h5oh (+ M) <=> c2h5 + oh (+ M)", kf = [2.40000E+023, -1.62, 99540], kf0 = [5.11000E+085, -18.8, 118770], falloff = Troe(A = 0.5, T3 = 650, T1 = 800, T2 = 1e+015), efficiencies = " co:2 co2:3 h2:2 h2o:5 ") # [CK Reaction (116)] # Reaction 213 # rev / 3.097E+18 -1.06 5.610E+03 / falloff_reaction( "c2h5oh (+ M) <=> c2h4 + h2o (+ M)", kf = [2.79000E+013, 0.09, 66140], kf0 = [2.57000E+083, -18.85, 86453], falloff = Troe(A = 0.7, T3 = 350, T1 = 800, T2 = 3800), efficiencies = " h2o:5 ") # [CK Reaction (117)] # Reaction 214 # rev / 8.858E+10 0.45 5.706E+04 / falloff_reaction( "c2h5oh (+ M) <=> ch3cho + h2 (+ M)", kf = [7.24000E+011, 0.1, 91010], kf0 = [4.46000E+087, -19.42, 115590], falloff = Troe(A = 0.9, T3 = 900, T1 = 1100, T2 = 3500), efficiencies = " h2o:5 ") # [CK Reaction (+118)] # Reaction 215 # rev / 2.342E+08 0.77 7.357E+04 / reaction( "c2h5oh + o2 => pc2h4oh + ho2", [2.00000E+013, 0, 52800]) # [CK Reaction (-118)] # Reaction 216 # rev / 2.342E+08 0.77 7.357E+04 / reaction( "pc2h4oh + ho2 => c2h5oh + o2", [3.47000E+008, 0.32, -1105]) # [CK Reaction (+119)] # Reaction 217 reaction( "c2h5oh + o2 => sc2h4oh + ho2", [1.50000E+013, 0, 50150]) # [CK Reaction (-119)] # Reaction 218 reaction( "sc2h4oh + ho2 => c2h5oh + o2", [1.87000E+011, 0.09, 3856]) # [CK Reaction (+120)] # Reaction 219 reaction( "c2h5oh + oh => pc2h4oh + h2o", [1.74000E+011, 0.27, 600]) # [CK Reaction (-120)] # Reaction 220 reaction( "pc2h4oh + h2o => c2h5oh + oh", [7.19600E+008, 0.26, 19330]) # [CK Reaction (+121)] # Reaction 221 reaction( "c2h5oh + oh => sc2h4oh + h2o", [4.64000E+011, 0.15, 0]) # [CK Reaction (-121)] # Reaction 222 reaction( "sc2h4oh + h2o => c2h5oh + oh", [1.37800E+012, -0.08, 26350]) # [CK Reaction (+122)] # Reaction 223 reaction( "c2h5oh + h => pc2h4oh + h2", [1.23000E+007, 1.8, 5098]) # [CK Reaction (-122)] # Reaction 224 reaction( "pc2h4oh + h2 => c2h5oh + h", [1.17500E+004, 1.79, 8677]) # [CK Reaction (+123)] # Reaction 225 reaction( "c2h5oh + h => sc2h4oh + h2", [2.58000E+007, 1.65, 2827]) # [CK Reaction (-123)] # Reaction 226 reaction( "sc2h4oh + h2 => c2h5oh + h", [1.77000E+007, 1.42, 14020]) # [CK Reaction (+124)] # Reaction 227 reaction( "c2h5oh + ho2 => pc2h4oh + h2o2", [1.23000E+004, 2.55, 15750]) # [CK Reaction (-124)] # Reaction 228 reaction( "pc2h4oh + h2o2 => c2h5oh + ho2", [3.01900E+002, 2.21, 3021]) # [CK Reaction (+125)] # Reaction 229 reaction( "c2h5oh + ho2 => sc2h4oh + h2o2", [8.20000E+003, 2.55, 10750]) # [CK Reaction (-125)] # Reaction 230 reaction( "sc2h4oh + h2o2 => c2h5oh + ho2", [1.44600E+005, 1.99, 5632]) # [CK Reaction (+126)] # Reaction 231 reaction( "c2h5oh + ho2 => c2h5o + h2o2", [2.50000E+012, 0, 24000]) # [CK Reaction (-126)] # Reaction 232 reaction( "c2h5o + h2o2 => c2h5oh + ho2", [1.51400E+014, -1.8, 38000]) # [CK Reaction (+127)] # Reaction 233 reaction( "c2h5oh + o => pc2h4oh + oh", [9.41000E+007, 1.7, 5459]) # [CK Reaction (-127)] # Reaction 234 reaction( "pc2h4oh + oh => c2h5oh + o", [3.94700E+004, 1.69, 6943]) # [CK Reaction (+128)] # Reaction 235 reaction( "c2h5oh + o => sc2h4oh + oh", [1.88000E+007, 1.85, 1824]) # [CK Reaction (-128)] # Reaction 236 reaction( "sc2h4oh + oh => c2h5oh + o", [5.66500E+006, 1.62, 10920]) # [CK Reaction (+129)] # Reaction 237 reaction( "c2h5oh + ch3 => pc2h4oh + ch4", [1.33000E+002, 3.18, 9362]) # [CK Reaction (-129)] # Reaction 238 reaction( "pc2h4oh + ch4 => c2h5oh + ch3", [3.31900E+000, 3.17, 13420]) # [CK Reaction (+130)] # Reaction 239 reaction( "c2h5oh + ch3 => sc2h4oh + ch4", [4.44000E+002, 2.9, 7690]) # [CK Reaction (-130)] # Reaction 240 reaction( "sc2h4oh + ch4 => c2h5oh + ch3", [7.95800E+003, 2.67, 19360]) # [CK Reaction (+131)] # Reaction 241 reaction( "c2h5oh + c2h5 => pc2h4oh + c2h6", [5.00000E+010, 0, 13400]) # [CK Reaction (-131)] # Reaction 242 reaction( "pc2h4oh + c2h6 => c2h5oh + c2h5", [6.99500E+010, 0, 26990]) # [CK Reaction (+132)] # Reaction 243 reaction( "c2h5oh + c2h5 => sc2h4oh + c2h6", [5.00000E+010, 0, 10400]) # [CK Reaction (-132)] # Reaction 244 reaction( "sc2h4oh + c2h6 => c2h5oh + c2h5", [6.99500E+010, 0, 2.399]) # [CK Reaction (+133)] # Reaction 245 reaction( "pc2h4oh => c2h4 + oh", [1.29300E+012, -0.37, 26850]) # [CK Reaction (-133)] # Reaction 246 reaction( "c2h4 + oh => pc2h4oh", [9.93000E+011, 0, -960]) # [CK Reaction (+134)] # Reaction 247 three_body_reaction( "sc2h4oh + M => ch3cho + h + M", [1.00000E+014, 0, 25000]) # [CK Reaction (-134)] # Reaction 248 three_body_reaction( "ch3cho + h + M => sc2h4oh + M", [4.71400E+010, 0.91, -3630]) # [CK Reaction (+135)] # Reaction 249 reaction( "c2h4 + ch3 => c2h3 + ch4", [6.62000E+000, 3.7, 9500]) # [CK Reaction (-135)] # Reaction 250 reaction( "c2h3 + ch4 => c2h4 + ch3", [1.44000E+000, 4.02, 5472]) # [CK Reaction (136)] # Reaction 251 falloff_reaction( "ch3co (+ M) <=> ch3 + co (+ M)", kf = [3.00000E+012, 0, 16720], kf0 = [1.20000E+015, 0, 12518]) # [CK Reaction (+137)] # Reaction 252 # rev / 9.623E+11 -0.13 9.778E+03 / reaction( "ch3cho => ch3 + hco", [2.61400E+015, 0.15, 80550]) # [CK Reaction (-137)] # Reaction 253 # rev / 9.623E+11 -0.13 9.778E+03 / reaction( "ch3 + hco => ch3cho", [2.00000E+013, 0, 0]) # [CK Reaction (+138)] # Reaction 254 reaction( "ch3cho + o2 => ch3co + ho2", [3.01000E+013, 0, 39150]) # [CK Reaction (-138)] # Reaction 255 reaction( "ch3co + ho2 => ch3cho + o2", [8.55200E+010, 0.32, -1940]) # [CK Reaction (+139)] # Reaction 256 reaction( "ch3cho + oh => ch3co + h2o", [2.00000E+006, 1.8, 1300]) # [CK Reaction (-139)] # Reaction 257 reaction( "ch3co + h2o => ch3cho + oh", [1.35400E+006, 1.79, 32850]) # [CK Reaction (+140)] # Reaction 258 reaction( "ch3cho + h => ch3co + h2", [1.34000E+013, 0, 3300]) # [CK Reaction (-140)] # Reaction 259 reaction( "ch3co + h2 => ch3cho + h", [2.09600E+012, -0.01, 19690]) # [CK Reaction (+141)] # Reaction 260 reaction( "ch3cho + o => ch3co + oh", [5.94000E+012, 0, 1868]) # [CK Reaction (-141)] # Reaction 261 reaction( "ch3co + oh => ch3cho + o", [4.08000E+011, -0.01, 16170]) # [CK Reaction (+142)] # Reaction 262 reaction( "ch3cho + ho2 => ch3co + h2o2", [3.01000E+012, 0, 11930]) # [CK Reaction (-142)] # Reaction 263 reaction( "ch3co + h2o2 => ch3cho + ho2", [1.21000E+013, -0.34, 12010]) # [CK Reaction (+143)] # Reaction 264 reaction( "ch3cho + ch3 => ch3co + ch4", [2.60800E+006, 1.78, 5911]) # [CK Reaction (-143)] # Reaction 265 reaction( "ch3co + ch4 => ch3cho + ch3", [1.06600E+007, 1.77, 22790]) # [CK Reaction (+144)] # Reaction 266 reaction( "c3h5-s => c2h2 + ch3", [9.59800E+039, -8.17, 42030]) # [CK Reaction (-144)] # Reaction 267 reaction( "c2h2 + ch3 => c3h5-s", [1.61000E+040, -8.58, 20330]) # [CK Reaction (+145)] # Reaction 268 reaction( "c2h2 + ch3 => c3h4-p + h", [1.21100E+017, -1.2, 16680]) # [CK Reaction (-145)] # Reaction 269 reaction( "c3h4-p + h => c2h2 + ch3", [1.00000E+014, 0, 4000]) # [CK Reaction (+146)] # Reaction 270 reaction( "c3h5-a => c2h2 + ch3", [2.39700E+048, -9.9, 82080]) # [CK Reaction (-146)] # Reaction 271 reaction( "c2h2 + ch3 => c3h5-a", [2.61000E+046, -9.82, 36950]) # [CK Reaction (+147)] # Reaction 272 reaction( "c3h6 => c2h3 + ch3", [2.73000E+062, -13.28, 123200]) # [CK Reaction (-147)] # Reaction 273 reaction( "c2h3 + ch3 => c3h6", [4.71200E+059, -13.19, 29540]) # [CK Reaction (+148)] # Reaction 274 reaction( "c2h2 + ch3 => c3h4-a + h", [6.74000E+019, -2.08, 31590]) # [CK Reaction (-148)] # Reaction 275 reaction( "c3h4-a + h => c2h2 + ch3", [1.14900E+016, -0.7, 15790]) # [CK Reaction (+149)] # Reaction 276 reaction( "ic4h8 + c3h5-t => ic4h7 + c3h6", [7.94000E+011, 0, 20500]) # [CK Reaction (-149)] # Reaction 277 reaction( "ic4h7 + c3h6 => ic4h8 + c3h5-t", [5.59200E+020, -1.27, 80170]) # [CK Reaction (+150)] # Reaction 278 reaction( "ic4h8 + c3h5-s => ic4h7 + c3h6", [7.94000E+011, 0, 20500]) # [CK Reaction (-150)] # Reaction 279 reaction( "ic4h7 + c3h6 => ic4h8 + c3h5-s", [5.59200E+020, -1.27, 82170]) # [CK Reaction (+151)] # Reaction 280 reaction( "c3h6 => c3h5-a + h", [2.01000E+061, -13.26, 118500]) # [CK Reaction (-151)] # Reaction 281 reaction( "c3h5-a + h => c3h6", [4.88700E+056, -12.25, 28080]) # [CK Reaction (+152)] # Reaction 282 reaction( "c3h6 + o => ch2co + ch3 + h", [2.50000E+007, 1.76, 76]) # [CK Reaction (-152)] # Reaction 283 reaction( "ch2co + ch3 + h => c3h6 + o", [1.00000E+000, 0, 0]) # [CK Reaction (+153)] # Reaction 284 reaction( "c3h6 + o => c2h5 + hco", [1.58000E+007, 1.76, -1216]) # [CK Reaction (-153)] # Reaction 285 reaction( "c2h5 + hco => c3h6 + o", [1.40200E+005, 1.88, 26510]) # [CK Reaction (154)] # Reaction 286 reaction( "c3h6 + o <=> ch3chco + h + h", [2.50000E+007, 1.76, 76]) # [CK Reaction (+155)] # Reaction 287 reaction( "c3h6 => c3h5-s + h", [7.71000E+069, -16.09, 140000]) # [CK Reaction (-155)] # Reaction 288 reaction( "c3h5-s + h => c3h6", [1.21700E+063, -14.6, 26160]) # [CK Reaction (+156)] # Reaction 289 reaction( "c3h6 + ho2 => c3h5-a + h2o2", [1.50000E+011, 0, 14190]) # [CK Reaction (-156)] # Reaction 290 reaction( "c3h5-a + h2o2 => c3h6 + ho2", [5.86700E+005, 1.33, 9759]) # [CK Reaction (+157)] # Reaction 291 reaction( "c3h6 + ho2 => c3h5-s + h2o2", [7.50000E+009, 0, 12570]) # [CK Reaction (-157)] # Reaction 292 reaction( "c3h5-s + h2o2 => c3h6 + ho2", [2.30800E+004, 1.27, -13420]) # [CK Reaction (+158)] # Reaction 293 reaction( "c3h6 + ho2 => c3h5-t + h2o2", [3.00000E+009, 0, 9930]) # [CK Reaction (-158)] # Reaction 294 reaction( "c3h5-t + h2o2 => c3h6 + ho2", [9.23400E+003, 1.27, -14060]) # [CK Reaction (+159)] # Reaction 295 reaction( "c3h6 + oh => c3h5-a + h2o", [3.12000E+006, 2, -298]) # [CK Reaction (-159)] # Reaction 296 reaction( "c3h5-a + h2o => c3h6 + oh", [6.19400E+006, 2.01, 31880]) # [CK Reaction (+160)] # Reaction 297 reaction( "c3h6 + oh => c3h5-s + h2o", [2.11000E+006, 2, 2778]) # [CK Reaction (-160)] # Reaction 298 reaction( "c3h5-s + h2o => c3h6 + oh", [2.71900E+004, 2.49, 11530]) # [CK Reaction (+161)] # Reaction 299 reaction( "c4h6 => c2h3 + c2h3", [4.02700E+019, -1, 98150]) # [CK Reaction (-161)] # Reaction 300 reaction( "c2h3 + c2h3 => c4h6", [1.26000E+013, 0, 0]) # [CK Reaction (+162)] # Reaction 301 reaction( "c4h6 + oh => c2h5 + ch2co", [1.00000E+012, 0, 0]) # [CK Reaction (-162)] # Reaction 302 reaction( "c2h5 + ch2co => c4h6 + oh", [3.73000E+012, 0, 30020]) # [CK Reaction (+163)] # Reaction 303 reaction( "c4h6 + oh => ch2o + c3h5-a", [1.00000E+012, 0, 0]) # [CK Reaction (-163)] # Reaction 304 reaction( "ch2o + c3h5-a => c4h6 + oh", [3.50100E+006, 0, 71060]) # [CK Reaction (+164)] # Reaction 305 reaction( "c4h6 + oh => c2h3 + ch3cho", [1.00000E+012, 0, 0]) # [CK Reaction (-164)] # Reaction 306 reaction( "c2h3 + ch3cho => c4h6 + oh", [5.43700E+011, 0, 18550]) # [CK Reaction (+165)] # Reaction 307 reaction( "c4h6 + o => c2h4 + ch2co", [1.00000E+012, 0, 0]) # [CK Reaction (-165)] # Reaction 308 reaction( "c2h4 + ch2co => c4h6 + o", [6.37700E+011, 0, 94340]) # [CK Reaction (+166)] # Reaction 309 reaction( "c4h6 + o => ch2o + c3h4-a", [1.00000E+012, 0, 0]) # [CK Reaction (-166)] # Reaction 310 reaction( "ch2o + c3h4-a => c4h6 + o", [1.07500E+012, 0, 79050]) # [CK Reaction (+167)] # Reaction 311 reaction( "c2h4 + o2 => c2h3 + ho2", [4.00000E+013, 0, 58200]) # [CK Reaction (-167)] # Reaction 312 reaction( "c2h3 + ho2 => c2h4 + o2", [4.93900E+013, -0.5, 1368]) # [CK Reaction (+168)] # Reaction 313 three_body_reaction( "ch2o + M => co + h2 + M", [1.82600E+032, -4.42, 87120]) # [CK Reaction (-168)] # Reaction 314 three_body_reaction( "co + h2 + M => ch2o + M", [5.07000E+027, -3.42, 84350]) # [CK Reaction (+169)] # Reaction 315 reaction( "nc3h7 => ch3 + c2h4", [2.28400E+014, -0.55, 28400]) # [CK Reaction (-169)] # Reaction 316 reaction( "ch3 + c2h4 => nc3h7", [4.10000E+011, 0, 7204]) # [CK Reaction (+170)] # Reaction 317 reaction( "nc3h7 => h + c3h6", [2.66700E+015, -0.64, 36820]) # [CK Reaction (-170)] # Reaction 318 reaction( "h + c3h6 => nc3h7", [1.00000E+013, 0, 2500]) # [CK Reaction (+171)] # Reaction 319 reaction( "nc3h7 + o2 => c3h6 + ho2", [3.00000E+011, 0, 3000]) # [CK Reaction (-171)] # Reaction 320 reaction( "c3h6 + ho2 => nc3h7 + o2", [2.00000E+011, 0, 17500]) # [CK Reaction (+172)] # Reaction 321 reaction( "c2h4 + ch3o => c2h3 + ch3oh", [1.20000E+011, 0, 6750]) # [CK Reaction (-172)] # Reaction 322 reaction( "c2h3 + ch3oh => c2h4 + ch3o", [1.00000E+010, 0, 9000]) # [CK Reaction (+173)] # Reaction 323 reaction( "c3h6 + oh => c3h5-t + h2o", [1.11000E+006, 2, 1451]) # [CK Reaction (-173)] # Reaction 324 reaction( "c3h5-t + h2o => c3h6 + oh", [3.27600E+003, 2.69, 12310]) # [CK Reaction (+174)] # Reaction 325 reaction( "c3h6 + o => c3h5-a + oh", [5.24000E+011, 0.7, 5884]) # [CK Reaction (-174)] # Reaction 326 reaction( "c3h5-a + oh => c3h6 + o", [1.05500E+011, 0.71, 20820]) # [CK Reaction (+175)] # Reaction 327 reaction( "c3h6 + o => c3h5-s + oh", [1.20000E+011, 0.7, 8959]) # [CK Reaction (-175)] # Reaction 328 reaction( "c3h5-s + oh => c3h6 + o", [1.56900E+008, 1.19, 460]) # [CK Reaction (+176)] # Reaction 329 reaction( "c3h6 + o => c3h5-t + oh", [6.03000E+010, 0.7, 7632]) # [CK Reaction (-176)] # Reaction 330 reaction( "c3h5-t + oh => c3h6 + o", [1.80500E+007, 1.39, 1243]) # [CK Reaction (+177)] # Reaction 331 reaction( "c3h6 + h => c3h5-a + h2", [1.73000E+005, 2.5, 2492]) # [CK Reaction (-177)] # Reaction 332 reaction( "c3h5-a + h2 => c3h6 + h", [7.93300E+004, 2.51, 19520]) # [CK Reaction (+178)] # Reaction 333 reaction( "c3h6 + o2 => c3h5-s + ho2", [2.00000E+012, 0, 62900]) # [CK Reaction (-178)] # Reaction 334 reaction( "c3h5-s + ho2 => c3h6 + o2", [1.08100E+008, 0.82, -984]) # [CK Reaction (+179)] # Reaction 335 reaction( "c3h6 + h => c2h4 + ch3", [4.83000E+033, -5.81, 18500]) # [CK Reaction (-179)] # Reaction 336 reaction( "c2h4 + ch3 => c3h6 + h", [2.31300E+033, -5.9, 31620]) # [CK Reaction (+180)] # Reaction 337 reaction( "ic3h7 => h + c3h6", [8.56900E+018, -1.57, 40340]) # [CK Reaction (-180)] # Reaction 338 reaction( "h + c3h6 => ic3h7", [1.30000E+013, 0, 1560]) # [CK Reaction (+181)] # Reaction 339 reaction( "ic3h7 + h => c2h5 + ch3", [2.00000E+013, 0, 0]) # [CK Reaction (-181)] # Reaction 340 reaction( "c2h5 + ch3 => ic3h7 + h", [4.82200E+009, 0.69, 12090]) # [CK Reaction (+182)] # Reaction 341 reaction( "ic3h7 + o2 => c3h6 + ho2", [4.50000E+011, 0, 5020]) # [CK Reaction (-182)] # Reaction 342 reaction( "c3h6 + ho2 => ic3h7 + o2", [2.00000E+011, 0, 17500]) # [CK Reaction (+183)] # Reaction 343 three_body_reaction( "c3h8 + M => ch3 + c2h5 + M", [7.90000E+022, -1.8, 88630]) # [CK Reaction (-183)] # Reaction 344 three_body_reaction( "ch3 + c2h5 + M => c3h8 + M", [3.65900E+014, -0.36, 989]) # [CK Reaction (+184)] # Reaction 345 reaction( "c3h8 + o2 => ic3h7 + ho2", [4.00000E+013, 0, 47500]) # [CK Reaction (-184)] # Reaction 346 reaction( "ic3h7 + ho2 => c3h8 + o2", [2.08000E+012, 0, 0]) # [CK Reaction (+185)] # Reaction 347 reaction( "c3h8 + o2 => nc3h7 + ho2", [4.00000E+013, 0, 47500]) # [CK Reaction (-185)] # Reaction 348 reaction( "nc3h7 + ho2 => c3h8 + o2", [2.08000E+012, 0, 0]) # [CK Reaction (+186)] # Reaction 349 reaction( "h + c3h8 => h2 + ic3h7", [1.30000E+006, 2.4, 4471]) # [CK Reaction (-186)] # Reaction 350 reaction( "h2 + ic3h7 => h + c3h8", [4.70900E+005, 2.15, 12180]) # [CK Reaction (+187)] # Reaction 351 reaction( "h + c3h8 => h2 + nc3h7", [1.88000E+005, 2.75, 6280]) # [CK Reaction (-187)] # Reaction 352 reaction( "h2 + nc3h7 => h + c3h8", [2.75600E+001, 3.44, 9530]) # [CK Reaction (+188)] # Reaction 353 reaction( "c3h8 + o => ic3h7 + oh", [2.81000E+013, 0, 5200]) # [CK Reaction (-188)] # Reaction 354 reaction( "ic3h7 + oh => c3h8 + o", [1.87000E+012, 0, 9607]) # [CK Reaction (+189)] # Reaction 355 reaction( "c3h8 + o => nc3h7 + oh", [1.13000E+014, 0, 7850]) # [CK Reaction (-189)] # Reaction 356 reaction( "nc3h7 + oh => c3h8 + o", [7.53000E+012, 0, 12260]) # [CK Reaction (+190)] # Reaction 357 reaction( "c3h8 + oh => nc3h7 + h2o", [1.05400E+010, 0.97, 1586]) # [CK Reaction (-190)] # Reaction 358 reaction( "nc3h7 + h2o => c3h8 + oh", [6.93100E+009, 0.97, 23250]) # [CK Reaction (+191)] # Reaction 359 reaction( "c3h8 + oh => ic3h7 + h2o", [4.67000E+007, 1.61, -35]) # [CK Reaction (-191)] # Reaction 360 reaction( "ic3h7 + h2o => c3h8 + oh", [3.07100E+007, 1.61, 21630]) # [CK Reaction (+192)] # Reaction 361 reaction( "c3h8 + ho2 => ic3h7 + h2o2", [5.60000E+012, 0, 17700]) # [CK Reaction (-192)] # Reaction 362 reaction( "ic3h7 + h2o2 => c3h8 + ho2", [4.16000E+011, 0, 7426]) # [CK Reaction (+193)] # Reaction 363 reaction( "c3h8 + ho2 => nc3h7 + h2o2", [1.68000E+013, 0, 20430]) # [CK Reaction (-193)] # Reaction 364 reaction( "nc3h7 + h2o2 => c3h8 + ho2", [2.33000E+012, 0, 9826]) # [CK Reaction (+194)] # Reaction 365 reaction( "ch3 + c3h8 => ch4 + ic3h7", [3.98000E+011, 0, 9500]) # [CK Reaction (-194)] # Reaction 366 reaction( "ch4 + ic3h7 => ch3 + c3h8", [1.58500E+012, 0, 16480]) # [CK Reaction (+195)] # Reaction 367 reaction( "ch3 + c3h8 => ch4 + nc3h7", [1.29000E+012, 0, 11600]) # [CK Reaction (-195)] # Reaction 368 reaction( "ch4 + nc3h7 => ch3 + c3h8", [5.12900E+012, 0, 18580]) # [CK Reaction (+196)] # Reaction 369 reaction( "ic3h7 + c3h8 => nc3h7 + c3h8", [3.00000E+010, 0, 12900]) # [CK Reaction (-196)] # Reaction 370 reaction( "nc3h7 + c3h8 => ic3h7 + c3h8", [3.00000E+010, 0, 12900]) # [CK Reaction (+197)] # Reaction 371 reaction( "c2h3 + c3h8 => c2h4 + ic3h7", [1.00000E+011, 0, 10400]) # [CK Reaction (-197)] # Reaction 372 reaction( "c2h4 + ic3h7 => c2h3 + c3h8", [1.31000E+011, 0, 17800]) # [CK Reaction (+198)] # Reaction 373 reaction( "c2h3 + c3h8 => c2h4 + nc3h7", [1.00000E+011, 0, 10400]) # [CK Reaction (-198)] # Reaction 374 reaction( "c2h4 + nc3h7 => c2h3 + c3h8", [1.31000E+011, 0, 17800]) # [CK Reaction (+199)] # Reaction 375 reaction( "c2h5 + c3h8 => c2h6 + ic3h7", [1.00000E+011, 0, 10400]) # [CK Reaction (-199)] # Reaction 376 reaction( "c2h6 + ic3h7 => c2h5 + c3h8", [3.63000E+010, 0, 9934]) # [CK Reaction (+200)] # Reaction 377 reaction( "c2h5 + c3h8 => c2h6 + nc3h7", [1.00000E+011, 0, 10400]) # [CK Reaction (-200)] # Reaction 378 reaction( "c2h6 + nc3h7 => c2h5 + c3h8", [3.63000E+010, 0, 9934]) # [CK Reaction (+201)] # Reaction 379 reaction( "c3h8 + c3h5-a => ic3h7 + c3h6", [2.00000E+011, 0, 16100]) # [CK Reaction (-201)] # Reaction 380 reaction( "ic3h7 + c3h6 => c3h8 + c3h5-a", [3.98000E+010, 0, 9700]) # [CK Reaction (+202)] # Reaction 381 reaction( "c3h8 + c3h5-a => nc3h7 + c3h6", [7.94000E+011, 0, 20500]) # [CK Reaction (-202)] # Reaction 382 reaction( "nc3h7 + c3h6 => c3h8 + c3h5-a", [1.00000E+011, 0, 9800]) # [CK Reaction (+203)] # Reaction 383 reaction( "c3h8 + ch3o => nc3h7 + ch3oh", [3.00000E+011, 0, 7000]) # [CK Reaction (-203)] # Reaction 384 reaction( "nc3h7 + ch3oh => c3h8 + ch3o", [1.22000E+010, 0, 9182]) # [CK Reaction (+204)] # Reaction 385 reaction( "c3h8 + ch3o => ic3h7 + ch3oh", [3.00000E+011, 0, 7000]) # [CK Reaction (-204)] # Reaction 386 reaction( "ic3h7 + ch3oh => c3h8 + ch3o", [1.22000E+010, 0, 9182]) # [CK Reaction (+205)] # Reaction 387 reaction( "ic4h7 => c3h4-a + ch3", [1.23000E+047, -9.74, 74260]) # [CK Reaction (-205)] # Reaction 388 reaction( "c3h4-a + ch3 => ic4h7", [3.01700E+041, -8.7, 26620]) # [CK Reaction (+206)] # Reaction 389 reaction( "ic4h8 => c3h5-t + ch3", [1.92000E+066, -14.22, 128100]) # [CK Reaction (-206)] # Reaction 390 reaction( "c3h5-t + ch3 => ic4h8", [2.08900E+059, -13.23, 29530]) # [CK Reaction (+207)] # Reaction 391 reaction( "ic4h8 => ic4h7 + h", [3.07000E+055, -11.49, 114300])