!AUTOIGNITION MEASUREMENTS AND A VALIDATED KINETIC MODEL FOR THE BIODIESEL SURROGATE, METHYL BUTANOATE. !S. DOOLEY, H.J. CURRAN AND J. M. SIMMIE, COMBUST. FLAME 153 (2008) 2–32. THERMO 300.000 1000.000 5000.000 H 120186H 1 G 0300.00 5000.00 1000.00 1 0.02500000E+02 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 2 0.02547163E+06-0.04601176E+01 0.02500000E+02 0.00000000E+00 0.00000000E+00 3 0.00000000E+00 0.00000000E+00 0.02547163E+06-0.04601176E+01 4 H2 121286H 2 G 0300.00 5000.00 1000.00 1 0.02991423E+02 0.07000644E-02-0.05633829E-06-0.09231578E-10 0.01582752E-13 2 -0.08350340E+04-0.01355110E+02 0.03298124E+02 0.08249442E-02-0.08143015E-05 3 -0.09475434E-09 0.04134872E-11-0.01012521E+05-0.03294094E+02 4 O 120186O 1 G 0300.00 5000.00 1000.00 1 0.02542060E+02-0.02755062E-03-0.03102803E-07 0.04551067E-10-0.04368052E-14 2 0.02923080E+06 0.04920308E+02 0.02946429E+02-0.01638166E-01 0.02421032E-04 3 -0.01602843E-07 0.03890696E-11 0.02914764E+06 0.02963995E+02 4 O2 121386O 2 G 0300.00 5000.00 1000.00 1 0.03697578E+02 0.06135197E-02-0.01258842E-05 0.01775281E-09-0.01136435E-13 2 -0.01233930E+05 0.03189166E+02 0.03212936E+02 0.01127486E-01-0.05756150E-05 3 0.01313877E-07-0.08768554E-11-0.01005249E+05 0.06034738E+02 4 OH 7/13/ 0 RUCICH 1O 1 0 0G 300.000 5000.000 1710.000 01 2.85376040E+00 1.02994334E-03-2.32666477E-07 1.93750704E-11-3.15759847E-16 2 3.69949720E+03 5.78756825E+00 3.41896226E+00 3.19255801E-04-3.08292717E-07 3 3.64407494E-10-1.00195479E-13 3.45264448E+03 2.54433372E+00 4 H2O 20387H 2O 1 G 0300.00 5000.00 1000.00 1 0.02672146E+02 0.03056293E-01-0.08730260E-05 0.01200996E-08-0.06391618E-13 2 -0.02989921E+06 0.06862817E+02 0.03386842E+02 0.03474982E-01-0.06354696E-04 3 0.06968581E-07-0.02506588E-10-0.03020811E+06 0.02590233E+02 4 N2 121286N 2 G 0300.00 5000.00 1000.00 1 0.02926640E+02 0.01487977E-01-0.05684761E-05 0.01009704E-08-0.06753351E-13 2 -0.09227977E+04 0.05980528E+02 0.03298677E+02 0.01408240E-01-0.03963222E-04 3 0.05641515E-07-0.02444855E-10-0.01020900E+05 0.03950372E+02 4 HO2 L 5/89H 1O 2 G 200.000 3500.000 1000.000 1 4.01721090E+00 2.23982013E-03-6.33658150E-07 1.14246370E-10-1.07908535E-14 2 1.11856713E+02 3.78510215E+00 4.30179801E+00-4.74912051E-03 2.11582891E-05 3 -2.42763894E-08 9.29225124E-12 2.94808040E+02 3.71666245E+00 4 H2O2 120186H 2O 2 G 0300.00 5000.00 1000.00 1 0.04573167E+02 0.04336136E-01-0.01474689E-04 0.02348904E-08-0.01431654E-12 2 -0.01800696E+06 0.05011370E+01 0.03388754E+02 0.06569226E-01-0.01485013E-05 3 -0.04625806E-07 0.02471515E-10-0.01766315E+06 0.06785363E+02 4 AR 120186AR 1 G 0300.00 5000.00 1000.00 1 0.02500000E+02 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 2 -0.07453750E+04 0.04366001E+02 0.02500000E+02 0.00000000E+00 0.00000000E+00 3 0.00000000E+00 0.00000000E+00-0.07453750E+04 0.04366001E+02 4 CH2O 6/29/04 RUSCIC 1H 2O 1 0G 300.000 5000.000 1486.000 01 4.02068394E+00 5.09903417E-03-1.76430480E-06 2.76025879E-10-1.60998042E-14 2 -1.49287258E+04 1.06525547E+00 3.00754197E+00 3.04729496E-03 5.25109246E-06 3 -5.12019281E-09 1.27133795E-12-1.41188397E+04 8.10120233E+00 4 CO 29/11/04 C 1O 1 0 0G 300.000 5000.000 1429.000 1 3.11216890E+00 1.15948283E-03-3.38480362E-07 4.41403098E-11-2.12862228E-15 2 -1.42718539E+04 5.71725177E+00 3.19036352E+00 8.94419972E-04-3.24927563E-08 3 -1.04599967E-10 2.41965693E-14-1.42869054E+04 5.33277914E+00 4 CO2 29/11/04 C 1O 2 0 0G 300.000 5000.000 1380.000 1 5.18953018E+00 2.06006476E-03-7.33575324E-07 1.17004374E-10-6.91729215E-15 2 -4.93178953E+04-5.18289303E+00 2.57930490E+00 8.24684987E-03-6.42716047E-06 3 2.54637024E-09-4.12030443E-13-4.84162830E+04 8.81141041E+00 4 HCO 29/11/04 H 1C 1O 1 0G 300.000 5000.000 1690.000 1 3.44148164E+00 3.52157719E-03-1.24136118E-06 1.97328644E-10-1.16538616E-14 2 3.97409684E+03 6.24593456E+00 3.81049965E+00 8.13269825E-04 3.13164701E-06 3 -2.39478268E-09 5.06894554E-13 4.03859901E+03 4.94843165E+00 4 HO2CHO 6/26/95 THERMC 1H 2O 3 0G 300.000 5000.000 1378.00 21 9.87503878E+00 4.64663708E-03-1.67230522E-06 2.68624413E-10-1.59595232E-14 2 -3.80502496E+04-2.24939155E+01 2.42464726E+00 2.19706380E-02-1.68705546E-05 3 6.25612194E-09-9.11645843E-13-3.54828006E+04 1.75027796E+01 4 O2CHO 6/26/95 THERMC 1H 1O 3 0G 300.000 5000.000 1368.00 11 7.24075139E+00 4.63312951E-03-1.63693995E-06 2.59706693E-10-1.52964699E-14 2 -1.87027618E+04-6.49547212E+00 3.96059309E+00 1.06002279E-02-5.25713351E-06 3 1.01716726E-09-2.87487602E-14-1.73599383E+04 1.17807483E+01 4 HOCHO 9/27/ 5 THERMC 1H 2O 2 0G 300.000 5000.000 1419.000 11 7.67134440E+00 4.43426373E-03-1.60867436E-06 2.59770020E-10-1.54899704E-14 2 -4.89708660E+04-1.73024418E+01 1.28069021E+00 1.52887758E-02-5.64150476E-06 3 -1.22968799E-09 8.14273233E-13-4.64347524E+04 1.83142081E+01 4 HOCO 9/27/ 5 THERMC 1H 1O 2 0G 300.000 5000.000 1549.000 11 6.94282268E+00 2.37391844E-03-8.67074662E-07 1.40644617E-10-8.41268695E-15 2 -2.50292163E+04-1.14792361E+01 8.98154532E-01 1.67269019E-02-1.33663562E-05 3 4.83071199E-09-6.38718748E-13-2.30262021E+04 2.07803865E+01 4 OCHO 9/27/ 5 THERMC 1H 1O 2 0G 300.000 5000.000 1412.000 01 6.49815560E+00 3.22319012E-03-1.17099595E-06 1.89272918E-10-1.12937000E-14 2 -1.81679042E+04-1.00412613E+01 1.42991854E+00 1.22803284E-02-5.28461096E-06 3 -3.73026551E-10 5.07953571E-13-1.62042814E+04 1.80411779E+01 4 HOCH2O2H 4/ 9/98 THERMC 1H 4O 3 0G 300.000 5000.000 1422.000 31 1.16303827E+01 7.15133688E-03-2.39035030E-06 3.65772791E-10-2.10199524E-14 2 -4.31079242E+04-3.24276725E+01 1.85716693E+00 3.23153132E-02-2.69928902E-05 3 1.11694484E-08-1.81284103E-12-4.00314471E+04 1.90917729E+01 4 HOCH2O2 4/ 9/98 THERMC 1H 3O 3 0G 300.000 5000.000 1412.000 21 9.04545938E+00 7.15223373E-03-2.37005676E-06 3.60083481E-10-2.05750228E-14 2 -2.49414886E+04-1.74210530E+01 2.85441621E+00 2.33663535E-02-1.88115990E-05 3 7.96709515E-09-1.36346618E-12-2.29866196E+04 1.51730565E+01 4 OCH2O2H 4/ 9/98 THERMC 1H 3O 3 0G 300.000 5000.000 1420.000 21 1.15398246E+01 5.34291432E-03-1.81878917E-06 2.81968625E-10-1.63584348E-14 2 -1.68237489E+04-3.20700633E+01 1.93823075E+00 3.01465730E-02-2.61053152E-05 3 1.09463562E-08-1.78312692E-12-1.38166625E+04 1.85042002E+01 4 HOCH2O 4/ 9/98 THERMC 1H 3O 2 0G 300.000 5000.000 1452.000 11 6.39521515E+00 7.43673043E-03-2.50422354E-06 3.84879712E-10-2.21778689E-14 2 -2.25557758E+04-6.63865583E+00 4.11183145E+00 7.53850697E-03 3.77337370E-06 3 -5.38746005E-09 1.45615887E-12-2.12471918E+04 7.46807254E+00 4 CH3OH 2/25/ 4 THERMC 1H 4O 1 0G 300.000 5000.000 1985.000 11 3.92867513E+00 9.81626074E-03-3.40615476E-06 5.35510197E-10-3.13776029E-14 2 -2.61454175E+04 2.69464483E+00 1.82176844E+00 1.23326420E-02-2.73742177E-06 3 -1.07387318E-09 4.23644837E-13-2.52222207E+04 1.48104300E+01 4 CH2OH 2/25/ 4 THERMC 1H 3O 1 0G 300.000 5000.000 1399.000 11 5.41875913E+00 5.66185244E-03-1.87471136E-06 2.84441938E-10-1.62299798E-14 2 -3.61475540E+03-3.49277963E+00 3.05674228E+00 1.19335634E-02-8.72501303E-06 3 3.82781054E-09-7.22887951E-13-2.83140190E+03 8.98878133E+00 4 CH3O 2/25/ 4 THERMC 1H 3O 1 0G 300.000 5000.000 1381.000 01 4.49405405E+00 7.09791027E-03-2.42105818E-06 3.75112636E-10-2.17301295E-14 2 -2.70574208E+02-1.37381296E+00 1.53767670E+00 1.09828251E-02-2.35050802E-06 3 -1.39266332E-09 5.59124429E-13 1.06959886E+03 1.55939205E+01 4 CH3O2H 1/14/ 5 THERMC 1H 4O 2 0G 300.000 5000.000 1367.000 21 8.80409289E+00 8.09427218E-03-2.85843274E-06 4.53369754E-10-2.66980707E-14 2 -1.98512174E+04-2.17000591E+01 2.83880024E+00 1.86096249E-02-8.48165412E-06 3 1.00387451E-09 1.71612429E-13-1.74033753E+04 1.16092433E+01 4 CH3O2 1/14/ 5 THERMC 1H 3O 2 0G 300.000 5000.000 1365.000 11 6.34718801E+00 7.92089358E-03-2.76601913E-06 4.35360631E-10-2.54984762E-14 2 -1.83436055E+03-7.42552545E+00 3.80497590E+00 9.80784660E-03-3.90940624E-07 3 -2.23072602E-09 6.43310820E-13-4.55625796E+02 7.81789100E+00 4 CH2O2H 1/14/ 5 THERMC 1H 3O 2 0G 300.000 5000.000 1357.000 21 9.10784249E+00 5.27260434E-03-1.88170543E-06 3.00561364E-10-1.77865959E-14 2 3.77440183E+03-2.11741044E+01 4.47228333E+00 1.33401095E-02-5.92919725E-06 3 4.44481025E-10 2.12699899E-13 5.67413711E+03 4.72608208E+00 4 CH4 29/11/04 H 4C 1 0 0G 300.000 5000.000 1462.000 1 4.09617653E+00 7.44330845E-03-2.63871900E-06 4.19577604E-10-2.47508050E-14 2 -1.13835704E+04-4.67561383E+00 3.72113020E+00-2.50293289E-03 1.90246534E-05 3 -1.46871253E-08 3.43791152E-12-1.01424099E+04 1.22776596E+00 4 CH3 C 1H 3 0 0G 300.000 5000.000 1389.000 01 3.51281376E+00 5.11412613E-03-1.67632050E-06 2.52495174E-10-1.43302923E-14 2 1.61238027E+04 1.62436112E+00 3.43858162E+00 4.07752664E-03 3.19830994E-07 3 -9.47669390E-10 2.21828166E-13 1.63164018E+04 2.52807406E+00 4 CH2 120186C 1H 2 G 0250.00 4000.00 1000.00 1 0.03636408E+02 0.01933057E-01-0.01687016E-05-0.01009899E-08 0.01808256E-12 2 0.04534134E+06 0.02156561E+02 0.03762237E+02 0.01159819E-01 0.02489585E-05 3 0.08800836E-08-0.07332435E-11 0.04536791E+06 0.01712578E+02 4 CH2[S] 31287C 1H 2 G 0300.00 4000.00 1000.00 1 0.03552889E+02 0.02066788E-01-0.01914116E-05-0.01104673E-08 0.02021350E-12 2 0.04984975E+06 0.01686570E+02 0.03971265E+02-0.01699089E-02 0.01025369E-04 3 0.02492551E-07-0.01981266E-10 0.04989368E+06 0.05753207E+00 4 CH 121286C 1H 1 G 0300.00 5000.00 1000.00 1 0.02196223E+02 0.02340381E-01-0.07058201E-05 0.09007582E-09-0.03855040E-13 2 0.07086723E+06 0.09178373E+02 0.03200202E+02 0.02072876E-01-0.05134431E-04 3 0.05733890E-07-0.01955533E-10 0.07045259E+06 0.03331588E+02 4 C2H6 8/ 4/ 4 THERMC 2H 6 0 0G 300.000 5000.000 1383.000 11 6.05972630E+00 1.30382837E-02-4.48103942E-06 6.97762095E-10-4.05606353E-14 2 -1.35751226E+04-1.28608001E+01 4.78623203E-02 2.40569127E-02-1.15155912E-05 3 2.48666238E-09-1.78343944E-13-1.10923014E+04 2.06544071E+01 4 C2H5 8/ 4/ 4 THERMC 2H 5 0 0G 300.000 5000.000 1387.000 11 5.88784390E+00 1.03076793E-02-3.46844396E-06 5.32499257E-10-3.06512651E-14 2 1.15065499E+04-8.49651771E+00 1.32730217E+00 1.76656753E-02-6.14926558E-06 3 -3.01143466E-10 4.38617775E-13 1.34284028E+04 1.71789216E+01 4 C2H4 10/ 4/ 5 THERMC 2H 4 0 0G 300.000 5000.000 1395.000 01 5.22176372E+00 8.96137303E-03-3.04868886E-06 4.71465524E-10-2.72739592E-14 2 3.60389679E+03-7.47789234E+00 2.33879687E-01 1.96334647E-02-1.16833214E-05 3 3.64246453E-09-4.77442715E-13 5.46489338E+03 1.97084228E+01 4 C2H3 10/ 4/ 5 THERMC 2H 3 0 0G 300.000 5000.000 1395.000 01 5.07331248E+00 6.58316278E-03-2.23762924E-06 3.45803379E-10-1.99940490E-14 2 3.37234748E+04-3.39792712E+00 1.25329724E+00 1.56258370E-02-1.07803879E-05 3 4.18054634E-09-7.01360362E-13 3.50734773E+04 1.71341661E+01 4 C2H2 10/ 4/ 5 THERMC 2H 2 0 0G 300.000 5000.000 1407.000 01 4.98265164E+00 4.25992930E-03-1.37483523E-06 2.04717964E-10-1.15191740E-14 2 2.52697118E+04-5.81321385E+00 2.06742667E+00 1.46568506E-02-1.52947063E-05 3 8.30965761E-09-1.72932175E-12 2.59578589E+04 8.62758672E+00 4 C2H 10/ 4/ 5 THERMC 2H 1 0 0G 300.000 5000.000 1361.000 01 4.66893822E+00 2.01284720E-03-7.01828634E-07 1.10347228E-10-6.45790465E-15 2 6.60310696E+04-2.25424693E+00 4.27708350E+00 1.74130076E-03 7.31180206E-07 3 -9.71827901E-10 2.36956727E-13 6.63125955E+04 3.16341916E-01 4 CH3CHO 8/10/ 4 THERMC 2H 4O 1 0G 300.000 5000.000 1377.000 11 6.98518866E+00 9.67897787E-03-3.31841954E-06 5.16025901E-10-2.99725903E-14 2 -2.39807279E+04-1.27484852E+01 1.77060035E+00 1.84475161E-02-7.24138162E-06 3 2.34364561E-10 3.35543891E-13-2.18078850E+04 1.65023437E+01 4 CH3CO 8/10/ 4 THERMC 2H 3O 1 0G 300.000 5000.000 1371.000 11 6.56682466E+00 7.55308669E-03-2.59966784E-06 4.05334994E-10-2.35876164E-14 2 -4.76690401E+03-8.83301965E+00 2.52884150E+00 1.37152173E-02-4.28607476E-06 3 -7.71684278E-10 4.83836380E-13-3.02546532E+03 1.40340315E+01 4 CH2CHO 8/10/ 4 THERMC 2H 3O 1 0G 300.000 5000.000 1388.000 11 7.54145790E+00 6.82297125E-03-2.36938607E-06 3.71633517E-10-2.17160048E-14 2 -2.61437239E+03-1.62602766E+01 1.47616956E+00 2.08974186E-02-1.50123552E-05 3 5.62967382E-09-8.76624470E-13-4.82050510E+02 1.63756465E+01 4 CH2CO 121686C 2H 2O 1 G 0300.00 5000.00 1000.00 1 0.06038817E+02 0.05804840E-01-0.01920954E-04 0.02794485E-08-0.01458868E-12 2 -0.08583402E+05-0.07657581E+02 0.02974971E+02 0.01211871E+00-0.02345046E-04 3 -0.06466685E-07 0.03905649E-10-0.07632637E+05 0.08673553E+02 4 HCCO 32387H 1C 2O 1 G 0300.00 4000.00 1000.00 1 0.06758073E+02 0.02000400E-01-0.02027607E-05-0.01041132E-08 0.01965165E-12 2 0.01901513E+06-0.09071262E+02 0.05047965E+02 0.04453478E-01 0.02268283E-05 3 -0.01482095E-07 0.02250742E-11 0.01965892E+06 0.04818439E+01 4 HCCOH 32387H 2C 2O 1 G 0300.00 4000.00 1000.00 1 0.07328324E+02 0.03336416E-01-0.03024705E-05-0.01781106E-08 0.03245168E-12 2 0.07598258E+05-0.01401214E+03 0.03899465E+02 0.09701075E-01-0.03119309E-05 3 -0.05537732E-07 0.02465732E-10 0.08701190E+05 0.04491875E+02 4 CH3CO3H 6/26/95 THERMC 2H 4O 3 0G 300.000 5000.000 1391.000 31 1.25060485E+01 9.47789695E-03-3.30402246E-06 5.19630793E-10-3.04233568E-14 2 -4.59856703E+04-3.79195947E+01 2.24135876E+00 3.37963514E-02-2.53887482E-05 3 9.67583587E-09-1.49266157E-12-4.24677831E+04 1.70668133E+01 4 CH3CO3 4/ 3/ 0 THERMC 2H 3O 3 0G 300.000 5000.000 1391.000 21 1.12522498E+01 8.33652672E-03-2.89014530E-06 4.52781734E-10-2.64354456E-14 2 -2.60238584E+04-2.96370457E+01 3.60373432E+00 2.70080341E-02-2.08293438E-05 3 8.50541104E-09-1.43846110E-12-2.34205171E+04 1.12014914E+01 4 CH3CO2 2/14/95 THERMC 2H 3O 2 0G 300.000 5000.000 1395.000 11 8.54059736E+00 8.32951214E-03-2.84722010E-06 4.41927196E-10-2.56373394E-14 2 -2.97290678E+04-2.03883545E+01 1.37440768E+00 2.49115604E-02-1.74308894E-05 3 6.24799508E-09-9.09516835E-13-2.72330150E+04 1.81405454E+01 4 C2H5OH 8/ 9/ 4 THERMC 2H 6O 1 0G 300.000 5000.000 1395.000 21 8.31742137E+00 1.29603294E-02-4.39286497E-06 6.77734995E-10-3.91448231E-14 2 -3.25219715E+04-1.96502783E+01 1.79106094E-01 3.09060081E-02-1.93596697E-05 3 6.31830859E-09-8.53166875E-13-2.95670605E+04 2.44715919E+01 4 PC2H4OH 8/ 9/ 4 THERMC 2H 5O 1 0G 300.000 5000.000 1396.000 21 7.88509591E+00 1.08287795E-02-3.66829683E-06 5.65734300E-10-3.26673351E-14 2 -7.44974622E+03-1.44673770E+01 9.90023426E-01 2.61564272E-02-1.65928300E-05 3 5.50525131E-09-7.57520667E-13-4.96032283E+03 2.28675716E+01 4 SC2H4OH 8/ 9/ 4 THERMC 2H 5O 1 0G 300.000 5000.000 1397.000 21 8.34980768E+00 1.03718068E-02-3.49683481E-06 5.37524748E-10-3.09661005E-14 2 -1.10556188E+04-1.81354112E+01 1.61103852E+00 2.63511867E-02-1.82941500E-05 3 6.91243160E-09-1.10384057E-12-8.71494725E+03 1.80114775E+01 4 C2H5O 8/ 9/ 4 THERMC 2H 5O 1 0G 300.000 5000.000 1393.000 11 8.23717244E+00 1.10885879E-02-3.78808372E-06 5.87613473E-10-3.40712889E-14 2 -6.22948597E+03-1.93190543E+01 2.87429022E-01 2.86500918E-02-1.83857008E-05 3 6.03096179E-09-8.04562643E-13-3.35717377E+03 2.37513898E+01 4 O2C2H4OH 2/14/95 THERMC 2H 5O 3 0G 300.000 5000.000 1392.000 31 1.07432659E+01 1.30957787E-02-4.45370088E-06 6.88548738E-10-3.98230113E-14 2 -2.55911274E+04-2.33254953E+01 4.11839445E+00 2.72240632E-02-1.60824430E-05 3 5.17033408E-09-7.31610168E-13-2.30857785E+04 1.28482112E+01 4 C2H5O2H 1/14/ 5 THERMC 2H 6O 2 0G 300.000 5000.000 1391.000 31 1.12305737E+01 1.20482120E-02-3.96730201E-06 6.00754632E-10-3.42657803E-14 2 -2.47977531E+04-3.25607232E+01 1.57329011E+00 3.52379996E-02-2.53203993E-05 3 9.56802476E-09-1.48167375E-12-2.15278368E+04 1.90472032E+01 4 C2H5O2 1/14/ 5 THERMC 2H 5O 2 0G 300.000 5000.000 1387.000 21 8.77641329E+00 1.18767163E-02-3.87683050E-06 5.83210754E-10-3.31006724E-14 2 -6.78748703E+03-1.83119972E+01 2.58630333E+00 2.61836362E-02-1.68306193E-05 3 6.08749295E-09-9.57302040E-13-4.58588992E+03 1.50486289E+01 4 C2H4O2H 1/14/ 5 THERMC 2H 5O 2 0G 300.000 5000.000 1397.000 31 1.05228954E+01 9.48091381E-03-3.55727763E-06 6.41445994E-10-4.21232247E-14 2 1.55718322E+03-2.31413632E+01 3.46916874E+00 2.71188626E-02-2.08022550E-05 3 8.44284845E-09-1.40756215E-12 3.89688270E+03 1.43400726E+01 4 CH3CHO2H 1/14/ 5 THERMC 2H 5O 2 0G 300.000 5000.000 1385.000 31 1.06284708E+01 1.01662327E-02-3.34915963E-06 5.07257146E-10-2.89352540E-14 2 -2.15391230E+03-2.60363030E+01 3.91433011E+00 2.52722102E-02-1.62112291E-05 3 5.45591592E-09-7.57965290E-13 2.38044573E+02 1.02327238E+01 4 C2H4O1-2 9/ 1/ 0 THERMC 2H 4O 1 0G 300.000 5000.000 1399.000 01 6.99485763E+00 1.00772459E-02-3.45220932E-06 5.36571216E-10-3.11563543E-14 2 -1.04091344E+04-1.59857976E+01-1.44361790E+00 2.91837107E-02-1.96805054E-05 3 6.67472575E-09-9.02139342E-13-7.43433507E+03 2.95212453E+01 4 C2H3O1-2 4/ 3/ 0 THERMC 2H 3O 1 0G 300.000 5000.000 1492.000 01 6.88486471E+00 6.94720501E-03-2.23214698E-06 3.32190767E-10-1.87124555E-14 2 1.26442200E+04-1.23842570E+01-1.62965122E+00 2.93455486E-02-2.43737550E-05 3 1.00522325E-08-1.61259036E-12 1.52459425E+04 3.22782741E+01 4 CH3COCH3 8/30/ 4 THERMC 3H 6O 1 0G 300.000 5000.000 1382.000 21 9.62674379E+00 1.45519245E-02-4.97749457E-06 7.72794591E-10-4.48367165E-14 2 -3.11862263E+04-2.61613449E+01 1.24527408E+00 2.99760255E-02-1.40026661E-05 3 2.16453512E-09 1.27637295E-13-2.78348727E+04 2.03682615E+01 4 CH3COCH2 8/30/ 4 THERMC 3H 5O 1 0G 300.000 5000.000 1388.000 21 1.08892477E+01 1.11540675E-02-3.85516785E-06 6.02834048E-10-3.51533449E-14 2 -1.00741464E+04-3.18043322E+01 1.22337251E+00 3.24546742E-02-2.13542518E-05 3 6.96777735E-09-8.99160299E-13-6.59419324E+03 2.05537233E+01 4 CH3COCH2O2 2/14/95 C 3H 5O 3 0G 300.000 5000.000 1379.00 31 1.27690342E+01 1.42554828E-02-4.92821461E-06 7.70448921E-10-4.49110534E-14 2 -2.34798669E+04-3.27155799E+01 5.95535468E+00 2.70255205E-02-1.37385031E-05 3 3.53735851E-09-4.03922557E-13-2.06679464E+04 5.21436049E+00 4 CH3COCH2O2H 2/14/95 C 3H 6O 3 0G 300.000 5000.000 1381.00 41 1.52372810E+01 1.44114651E-02-5.01290009E-06 7.87071229E-10-4.60225784E-14 2 -4.27564444E+04-4.77383784E+01 4.94789761E+00 3.60474432E-02-2.21719933E-05 3 6.98296874E-09-9.21269260E-13-3.88687178E+04 8.49926130E+00 4 CH3COCH2O 4/ 3/ 0 THERMC 3H 5O 2 0G 300.000 5000.000 1370.000 21 1.14637586E+01 1.32124342E-02-4.56580495E-06 7.13897538E-10-4.16281047E-14 2 -2.23833017E+04-3.15127868E+01 3.72927689E+00 2.63943697E-02-1.09796486E-05 3 8.58185303E-10 3.39474590E-13-1.91551565E+04 1.18505335E+01 4 C2H3CHO 6/26/95 THERMC 3H 4O 1 0G 300.000 5000.000 1393.000 11 1.04184959E+01 9.48963321E-03-3.29310529E-06 5.16279203E-10-3.01587291E-14 2 -1.49630281E+04-3.07235061E+01 2.92355162E-01 3.54321417E-02-2.94936324E-05 3 1.28100124E-08-2.26144108E-12-1.16521584E+04 2.28878280E+01 4 C2H3CO 4/ 3/ 0 THERMC 3H 3O 1 0G 300.000 5000.000 1402.000 01 9.37467676E+00 7.91296900E-03-2.67198280E-06 4.11115430E-10-2.36978981E-14 2 1.92969514E+03-2.40892696E+01 1.36242013E+00 3.15273972E-02-3.00218935E-05 3 1.48167112E-08-2.87971530E-12 4.25770215E+03 1.72626546E+01 4 C2H5CHO 8/10/ 4 THERMC 3H 6O 1 0G 300.000 5000.000 1375.000 21 8.87216223E+00 2.01710762E-02-8.06487647E-06 1.37617784E-09-8.48922325E-14 2 -2.83848527E+04-2.35069163E+01 5.93107530E+00 8.87943855E-03 2.03764325E-05 3 -1.80149348E-08 4.14085655E-12-2.51377751E+04-5.87019974E-01 4 C2H5CO 8/10/ 4 THERMC 3H 5O 1 0G 300.000 5000.000 1362.000 21 1.00147418E+01 1.61527961E-02-6.62976122E-06 1.15290667E-09-7.21263458E-14 2 -1.00430305E+04-2.88570933E+01 8.35352246E+00-4.08739727E-03 3.64217954E-05 3 -2.72457713E-08 6.06440266E-12-6.58577307E+03-1.05948346E+01 4 CH2CH2CHO 8/10/ 4 THERMC 3H 5O 1 0G 300.000 5000.000 1363.000 21 9.96855598E+00 1.61917946E-02-6.64161740E-06 1.15444520E-09-7.21981790E-14 2 -4.16450354E+03-2.73971573E+01 8.36272659E+00-3.90712606E-03 3.59751257E-05 3 -2.69209237E-08 5.98920261E-12-7.55243244E+02-9.53140102E+00 4 CH3CHCHO 8/10/ 4 THERMC 3H 5O 1 0G 300.000 5000.000 1253.000 21 8.27772090E+00 1.95687188E-02-8.47575089E-06 1.53249728E-09-9.86441542E-14 2 -8.34456062E+03-2.17652483E+01-2.72811212E+00 3.80354483E-02-1.96782132E-05 3 5.09554570E-09-7.28789092E-13-3.51122739E+03 4.04496677E+01 4 CH3OCH3 7/20/98 THERMC 2H 6O 1 0G 300.000 5000.000 1368.000 21 8.27745836E+00 1.32135539E-02-4.53264362E-06 7.05316507E-10-4.09933283E-14 2 -2.61982700E+04-2.15190894E+01 1.50763450E+00 2.39914228E-02-8.68910500E-06 3 -9.66835762E-11 4.89319361E-13-2.32810894E+04 1.67317297E+01 4 CH3OCH2 7/20/98 THERMC 2H 5O 1 0G 300.000 5000.000 1376.000 21 8.17137842E+00 1.10086181E-02-3.82352277E-06 5.99637202E-10-3.50317513E-14 2 -3.41941605E+03-1.78650856E+01 2.91327415E+00 2.03364659E-02-9.59712342E-06 3 2.07478525E-09-1.71343362E-13-1.18844240E+03 1.16066817E+01 4 CH3OCH2O2 7/20/98 THERMC 2H 5O 3 0G 300.000 5000.000 1389.000 31 1.24249729E+01 1.18705986E-02-4.07906532E-06 6.35310809E-10-3.69427867E-14 2 -2.29679238E+04-3.53740145E+01 2.21029612E+00 3.68877454E-02-2.82561555E-05 3 1.15730533E-08-1.97130470E-12-1.94940940E+04 1.91463601E+01 4 CH2OCH2O2H 7/20/98 THERMC 2H 5O 3 0G 300.000 5000.000 1393.000 41 1.51191783E+01 9.23718883E-03-3.19127505E-06 4.99114678E-10-2.91162488E-14 2 -1.84114867E+04-4.85706618E+01 2.52895507E+00 4.24128290E-02-3.73406386E-05 3 1.66639333E-08-2.96443312E-12-1.44293306E+04 1.76899251E+01 4 CH3OCH2O2H 7/20/98 THERMC 2H 6O 3 0G 300.000 5000.000 1392.000 41 1.49370964E+01 1.19465829E-02-4.12746359E-06 6.45422590E-10-3.76427939E-14 2 -4.11001068E+04-4.99552737E+01 1.19855761E+00 4.59060764E-02-3.66252420E-05 3 1.49318970E-08-2.46057445E-12-3.65363161E+04 2.31339904E+01 4 CH3OCH2O 2/ 9/96 THERMC 2H 5O 2 0G 300.000 5000.000 2012.000 21 8.60261845E+00 1.35772195E-02-4.84661602E-06 7.77766193E-10-4.62633624E-14 2 -2.13762444E+04-1.75775023E+01 3.25889339E+00 2.22146359E-02-7.78556340E-06 3 -2.41484158E-10 4.51914496E-13-1.92377212E+04 1.23680069E+01 4 O2CH2OCH2O2H 7/20/98 TRMC 2H 5O 5 0G 300.000 5000.000 1402.000 51 1.92038046E+01 1.04394841E-02-3.60582939E-06 5.63792843E-10-3.28807214E-14 2 -3.79207055E+04-6.51847273E+01 1.99640551E+00 5.83226232E-02-5.53259778E-05 3 2.59810540E-08-4.77141005E-12-3.27628742E+04 2.44215005E+01 4 HO2CH2OCHO 8/31/99 THERMC 2H 4O 4 0G 300.000 5000.000 1387.000 41 1.64584298E+01 8.52683511E-03-3.04113500E-06 4.85596908E-10-2.87316334E-14 2 -6.23959608E+04-5.38924139E+01 3.47935703E+00 4.02952392E-02-3.30109296E-05 3 1.34360117E-08-2.18601580E-12-5.80629934E+04 1.52521392E+01 4 OCH2OCHO 4/ 9/98 THERMC 2H 3O 3 0G 300.000 5000.000 1475.000 21 1.20233916E+01 8.11262659E-03-2.91356462E-06 4.67340384E-10-2.77375525E-14 2 -4.33647231E+04-3.33691809E+01 5.19690837E+00 1.58839723E-02 3.53540547E-07 3 -6.10456923E-09 1.94661801E-12-4.02242792E+04 6.11645828E+00 4 HOCH2OCO 8/31/99 THERMC 2H 3O 3 0G 300.000 5000.000 1603.000 31 1.13737391E+01 8.17663898E-03-2.92034021E-06 4.66695616E-10-2.76276823E-14 2 -4.65575743E+04-2.86035265E+01 6.08180801E+00 1.28768359E-02 2.04419418E-06 3 -6.10154921E-09 1.79820559E-12-4.39526183E+04 2.54054449E+00 4 CH3OCHO 8/31/99 THERMC 2H 4O 2 0G 300.000 5000.000 1686.000 21 8.69123518E+00 1.15503122E-02-4.27782486E-06 7.02533059E-10-4.24333552E-14 2 -4.64364769E+04-1.89301478E+01 3.08839783E+00 2.03760048E-02-6.84777040E-06 3 -7.28186203E-10 5.62130216E-13-4.41855167E+04 1.25364719E+01 4 CH3OCO 8/31/99 THERMC 2H 3O 2 0G 300.000 5000.000 1601.000 21 9.73659803E+00 7.42432713E-03-2.65641779E-06 4.25031143E-10-2.51824924E-14 2 -2.37525535E+04-2.35950854E+01 4.16215406E+00 1.38037511E-02-3.08486109E-07 3 -4.56430814E-09 1.46909632E-12-2.11640115E+04 8.68327214E+00 4 CH2OCHO 4/20/99 THERMC 2H 3O 2 0G 300.000 5000.000 2018.000 21 8.44397265E+00 8.81405857E-03-3.23029618E-06 5.26923491E-10-3.16806839E-14 2 -2.39555479E+04-1.50534594E+01 3.22498899E+00 1.90239604E-02-9.55384264E-06 3 1.70721984E-09 8.54934709E-15-2.20531823E+04 1.35344729E+01 4 C3H8 8/ 4/ 4 THERMC 3H 8 0 0G 300.000 5000.000 1387.000 21 9.31450083E+00 1.73577154E-02-5.94222386E-06 9.22939762E-10-5.35576604E-14 2 -1.77234234E+04-2.89241517E+01-3.08230087E-01 3.65331801E-02-1.97610926E-05 3 5.15283344E-09-5.06336649E-13-1.39792198E+04 2.40478733E+01 4 NC3H7 8/ 4/ 4 THERMC 3H 7 0 0G 300.000 5000.000 1386.000 21 8.88635047E+00 1.52273279E-02-5.21905860E-06 8.11259208E-10-4.71028059E-14 2 7.34671584E+03-2.30727791E+01 4.74365329E-01 3.19190367E-02-1.71909780E-05 3 4.45927887E-09-4.36675398E-13 1.06314565E+04 2.32670929E+01 4 IC3H7 8/ 4/ 4 THERMC 3H 7 0 0G 300.000 5000.000 1373.000 21 8.14705217E+00 1.58727106E-02-5.44611541E-06 8.47207689E-10-4.92178752E-14 2 6.18073367E+03-1.91980850E+01 1.63417589E+00 2.40171372E-02-4.72808067E-06 3 -3.24354603E-09 1.23539044E-12 9.20752889E+03 1.83848082E+01 4 C3H6 10/23/ 5 THERMC 3H 6 0 0G 300.000 5000.000 1388.000 11 8.01595958E+00 1.37023634E-02-4.66249733E-06 7.21254402E-10-4.17370126E-14 2 -1.76749303E+03-2.00160668E+01 3.94615444E-01 2.89107662E-02-1.54886808E-05 3 3.88814209E-09-3.37890352E-13 1.17760132E+03 2.19003736E+01 4 C3H5-A 10/23/ 5 THERMC 3H 5 0 0G 300.000 5000.000 1397.000 01 8.45883958E+00 1.12695483E-02-3.83792864E-06 5.94059119E-10-3.43918030E-14 2 1.64683289E+04-2.32704266E+01-5.29131958E-01 3.34559100E-02-2.53401027E-05 3 1.02865754E-08-1.73258340E-12 1.94941423E+04 2.46172315E+01 4 C3H5-T 10/23/ 5 THERMC 3H 5 0 0G 300.000 5000.000 1382.000 11 7.37492443E+00 1.17510061E-02-4.00021283E-06 6.18947395E-10-3.58215018E-14 2 2.73982108E+04-1.43478655E+01 2.17916644E+00 2.03826623E-02-7.91413834E-06 3 4.76906187E-10 2.70398536E-13 2.96002535E+04 1.48785684E+01 4 C3H5-S 10/23/ 5 THERMC 3H 5 0 0G 300.000 5000.000 1390.000 11 7.88765879E+00 1.13012591E-02-3.84213130E-06 5.93982677E-10-3.43567175E-14 2 2.83484913E+04-1.74291589E+01 1.32807335E+00 2.53107914E-02-1.51530439E-05 3 4.74345565E-09-6.24666084E-13 3.07981100E+04 1.83328787E+01 4 C3H4-A 101993H 4C 3 G 0300.00 4000.00 1400.00 1 0.09776256E+02 0.05302138E-01-0.03701118E-05-0.03026386E-08 0.05089581E-12 2 0.01954972E+06-0.03077061E+03 0.02539831E+02 0.01633437E+00-0.01764950E-04 3 -0.04647365E-07 0.01729131E-10 0.02251243E+06 0.09935702E+02 4 C3H4-P 101993H 4C 3 G 0300.00 4000.00 1400.00 1 0.09768102E+02 0.05219151E-01-0.03753140E-05-0.02992191E-08 0.05107878E-12 2 0.01860277E+06-0.03020678E+03 0.03029730E+02 0.01498961E+00-0.01398500E-04 3 -0.03969619E-07 0.01388217E-10 0.02148408E+06 0.08004594E+02 4 C3H3 82489C 3H 3 G 0300.00 4000.00 1000.00 1 0.08831047E+02 0.04357195E-01-0.04109067E-05-0.02368723E-08 0.04376520E-12 2 0.03847420E+06-0.02177919E+03 0.04754200E+02 0.01108028E+00 0.02793323E-05 3 -0.05479212E-07 0.01949629E-10 0.03988883E+06 0.05854549E+01 4 C3H2 102193H 2C 3 G 0150.00 4000.00 1000.00 1 0.07670981E+02 0.02748749E-01-0.04370943E-05-0.06455599E-09 0.01663887E-12 2 0.06259722E+06-0.01236890E+03 0.03166714E+02 0.02482572E+00-0.04591637E-03 3 0.04268019E-06-0.01482152E-09 0.06350421E+06 0.08869446E+02 4 C3H5O 7/20/95 THERMC 3H 5O 1 0G 300.000 5000.000 1380.000 11 1.02551752E+01 1.14983720E-02-3.84645659E-06 5.88910346E-10-3.38557923E-14 2 6.26560810E+03-2.77655042E+01 1.19822582E+00 3.05579837E-02-1.80630276E-05 3 4.86150033E-09-4.19854562E-13 9.58217784E+03 2.15566221E+01 4 C3H6OOH1-3 7/19/ 0 THERMC 3H 7O 2 0G 300.000 5000.000 1384.000 41 1.46881564E+01 1.49941200E-02-5.24056505E-06 8.25462711E-10-4.83758952E-14 2 -4.77342863E+03-4.77984492E+01 1.88331465E+00 4.40156051E-02-3.07858462E-05 3 1.13214862E-08-1.75323184E-12-1.68779168E+02 2.14040621E+01 4 C3H6OOH1-2 7/19/ 0 THERMC 3H 7O 2 0G 300.000 5000.000 1402.000 41 1.24605763E+01 1.58889526E-02-5.32742106E-06 8.15818791E-10-4.68723250E-14 2 -4.20305196E+03-3.23858947E+01 2.87774562E+00 3.74166999E-02-2.36058063E-05 3 7.79930860E-09-1.06042562E-12-7.82368119E+02 1.93941340E+01 4 C3H6OOH2-1 7/19/ 0 THERMC 3H 7O 2 0G 300.000 5000.000 1407.000 41 1.42163221E+01 1.43382450E-02-4.78004477E-06 7.29133134E-10-4.17761973E-14 2 -5.67381620E+03-4.35770997E+01 2.09193950E+00 4.69220394E-02-3.90280831E-05 3 1.72381453E-08-3.07968979E-12-1.89377918E+03 2.00178282E+01 4 C3H6OOH2-2 7/19/ 0 THERMC 3H 7O 2 0G 300.000 5000.000 1407.000 41 1.42163221E+01 1.43382450E-02-4.78004477E-06 7.29133134E-10-4.17761973E-14 2 -5.67381620E+03-4.35770997E+01 2.09193950E+00 4.69220394E-02-3.90280831E-05 3 1.72381453E-08-3.07968979E-12-1.89377918E+03 2.00178282E+01 4 C3H6OOH1-2O2 7/19/ 0 TRMC 3H 7O 4 0G 300.000 5000.000 1386.000 51 1.91759159E+01 1.59857013E-02-5.61306378E-06 8.86880495E-10-5.20877040E-14 2 -2.64412115E+04-6.77512936E+01 2.65196584E+00 5.74638149E-02-4.72190867E-05 3 2.05591557E-08-3.68787387E-12-2.08829371E+04 2.01547955E+01 4 C3H6OOH1-3O2 7/19/ 0 TRMC 3H 7O 4 0G 300.000 5000.000 1382.000 51 1.85916698E+01 1.65328553E-02-5.81343626E-06 9.19396939E-10-5.40320702E-14 2 -2.39598698E+04-6.42544402E+01 3.14864588E+00 5.33542571E-02-4.08330611E-05 3 1.67542220E-08-2.89288326E-12-1.85473645E+04 1.86305431E+01 4 C3H6OOH2-1O2 7/19/ 0 TRMC 3H 7O 4 0G 300.000 5000.000 1386.000 51 1.91759159E+01 1.59857013E-02-5.61306378E-06 8.86880495E-10-5.20877040E-14 2 -2.64412115E+04-6.77512936E+01 2.65196584E+00 5.74638149E-02-4.72190867E-05 3 2.05591557E-08-3.68787387E-12-2.08829371E+04 2.01547955E+01 4 NC3H7O 8/ 9/ 4 THERMC 3H 7O 1 0G 300.000 5000.000 1398.000 21 1.14771726E+01 1.54936722E-02-5.29459014E-06 8.21476970E-10-4.76382658E-14 2 -1.03998532E+04-3.53681150E+01-2.16869993E-01 4.14789744E-02-2.68724173E-05 3 8.76685704E-09-1.13947550E-12-6.21358042E+03 2.78942641E+01 4 IC3H7O 8/ 9/ 4 THERMC 3H 7O 1 0G 300.000 5000.000 1393.000 21 1.23135031E+01 1.38062606E-02-4.91585531E-06 8.21075632E-10-5.07493001E-14 2 -1.24717023E+04-4.17270532E+01-8.18260771E-01 4.68807147E-02-3.74369377E-05 3 1.55917264E-08-2.64308171E-12-8.15153216E+03 2.79483196E+01 4 NC3H7O2H 7/19/ 0 THERMC 3H 8O 2 0G 300.000 5000.000 1385.000 41 1.50895501E+01 1.71714707E-02-5.98498879E-06 9.40964412E-10-5.50728381E-14 2 -2.98352445E+04-5.28090166E+01 1.13366696E+00 4.84919904E-02-3.31801457E-05 3 1.19308278E-08-1.80905372E-12-2.47845493E+04 2.27256088E+01 4 IC3H7O2H 7/19/ 0 THERMC 3H 8O 2 0G 300.000 5000.000 1389.000 41 1.57046391E+01 1.65924516E-02-5.77250934E-06 9.06453070E-10-5.30084111E-14 2 -3.23268564E+04-5.71735156E+01 5.19265570E-01 5.32111228E-02-4.05156892E-05 3 1.63346713E-08-2.73751233E-12-2.71048486E+04 2.40815065E+01 4 NC3H7O2 7/19/ 0 THERMC 3H 7O 2 0G 300.000 5000.000 1384.000 31 1.26327059E+01 1.69910726E-02-5.88866873E-06 9.22195396E-10-5.38230675E-14 2 -1.19194652E+04-3.85349297E+01 2.10731492E+00 3.96164986E-02-2.49491599E-05 3 8.59450300E-09-1.31240330E-12-7.93745567E+03 1.89082748E+01 4 IC3H7O2 7/19/ 0 THERMC 3H 7O 2 0G 300.000 5000.000 1388.000 31 1.32493493E+01 1.64082190E-02-5.67432062E-06 8.87336340E-10-5.17361535E-14 2 -1.44109855E+04-4.29066213E+01 1.49941639E+00 4.43081205E-02-3.22414456E-05 3 1.29687136E-08-2.23370569E-12-1.02587980E+04 2.02336490E+01 4 C3H6O1-3 1/22/95 THERMC 3H 6O 1 0G 300.000 5000.000 2035.000 41 1.02363953E+01 1.50514705E-02-5.63636534E-06 9.32463455E-10-5.66102441E-14 2 -1.46212029E+04-3.36724732E+01-2.75717996E+00 4.26371602E-02-2.56831231E-05 3 6.62981208E-09-5.31193325E-13-1.00990375E+04 3.67181804E+01 4 C3H6O1-2 1/22/95 THERMC 3H 6O 1 0G 300.000 5000.000 1379.00 41 1.19825289E+01 1.23964696E-02-4.39113813E-06 6.97911182E-10-4.11585127E-14 2 -1.69739189E+04-4.22894035E+01-1.21988153E+00 4.28578772E-02-3.17530249E-05 3 1.21763736E-08-1.94154303E-12-1.22953761E+04 2.88467826E+01 4 C3KET12 7/19/ 0 THERMC 3H 6O 3 0G 300.000 5000.000 1388.000 41 1.70756225E+01 1.31013491E-02-4.61949408E-06 7.31991329E-10-4.30788679E-14 2 -4.17008637E+04-5.95778952E+01 1.10507238E+00 5.27396706E-02-4.31805774E-05 3 1.81618292E-08-3.10535568E-12-3.63627536E+04 2.54111636E+01 4 C3KET13 7/19/ 0 THERMC 3H 6O 3 0G 300.000 5000.000 1379.000 41 1.58927479E+01 1.40990923E-02-4.96118851E-06 7.84992198E-10-4.61488928E-14 2 -3.93774829E+04-5.26049341E+01 3.55241022E+00 4.18720270E-02-2.94550370E-05 3 1.09982900E-08-1.75045977E-12-3.48902671E+04 1.42082894E+01 4 C3KET21 7/19/ 0 THERMC 3H 6O 3 0G 300.000 5000.000 1371.000 41 1.56377776E+01 1.44059342E-02-5.08808082E-06 8.07076119E-10-4.75295650E-14 2 -4.30657975E+04-5.13105869E+01 4.55686367E+00 3.57076837E-02-1.94712054E-05 3 4.70695431E-09-3.69753807E-13-3.86710975E+04 9.97761694E+00 4 C3H51-2,3OOH 8/26/3 THRMC 3H 7O 4 0G 300.000 5000.000 1386.000 61 2.12378169E+01 1.39519596E-02-4.94539222E-06 7.86381389E-10-4.63925564E-14 2 -1.92864584E+04-7.69636561E+01 2.55619708E+00 6.13504487E-02-5.23205391E-05 3 2.28208029E-08-4.02231508E-12-1.31353414E+04 2.21043799E+01 4 C3H52-1,3OOH 8/26/3 THRMC 3H 7O 4 0G 300.000 5000.000 1379.000 61 2.02817964E+01 1.48155431E-02-5.25503386E-06 8.35963453E-10-4.93308915E-14 2 -1.80085066E+04-7.22688262E+01 4.12253742E+00 5.19553611E-02-3.83733727E-05 3 1.45851637E-08-2.29820536E-12-1.22759164E+04 1.48367359E+01 4 C3H6OH 1/ 7/98 THERMC 3H 7O 1 0G 300.000 5000.000 1674.000 31 9.31287816E+00 1.67579212E-02-5.75555480E-06 9.00584362E-10-5.26566836E-14 2 -1.20169635E+04-1.95011064E+01 1.20494302E+00 3.30857885E-02-1.63893637E-05 3 3.18103918E-09-6.84229288E-14-9.12961720E+03 2.47155202E+01 4 HOC3H6O2 1/ 7/98 THERMC 3H 7O 3 0G 300.000 5000.000 1397.000 41 1.42691004E+01 1.71837825E-02-5.83419536E-06 9.00994191E-10-5.20716210E-14 2 -3.14501750E+04-4.15295035E+01 3.06954289E+00 4.43105640E-02-3.18636260E-05 3 1.26409287E-08-2.12751901E-12-2.75893676E+04 1.83891218E+01 4 CH3CHCO 03/03/95 THERMC 3H 4O 1 0G 300.000 5000.000 1400.00 41 1.00219123E+01 9.56966300E-03-3.26221644E-06 5.05231706E-10-2.92593257E-14 2 -1.42482738E+04-2.77829973E+01 1.48380119E+00 3.22203013E-02-2.70250033E-05 3 1.20499164E-08-2.18365931E-12-1.15276540E+04 1.71552068E+01 4 AC3H5OOH 7/20/98 THERMC 3H 6O 2 0G 300.000 5000.000 1394.000 31 1.36837693E+01 1.33968049E-02-4.61533631E-06 7.19988958E-10-4.19109988E-14 2 -1.33165248E+04-4.31904193E+01 2.43934647E+00 4.02070638E-02-2.95322679E-05 3 1.14715600E-08-1.85170511E-12-9.43679906E+03 1.70549969E+01 4 C2H3OOH 8/26/ 3 THERMC 2H 4O 2 0G 300.000 5000.000 1397.000 21 1.21879394E+01 7.54512107E-03-2.61792475E-06 4.10374249E-10-2.39697182E-14 2 -1.18702589E+04-3.78377265E+01 2.14763346E-01 4.40080434E-02-4.59936948E-05 3 2.37161965E-08-4.71151482E-12-8.50786546E+03 2.35437100E+01 4 HE 120186HE 1 G 0300.00 5000.00 1000.00 1 0.02500000E+02 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 2 -0.07453750E+04 0.09153489E+01 0.02500000E+02 0.00000000E+00 0.00000000E+00 3 0.00000000E+00 0.00000000E+00-0.07453750E+04 0.09153488E+01 4 C C 1 G 0300.00 5000.00 1000.00 1 0.02602087E+02-0.01787081E-02 0.09087041E-06-0.01149933E-09 0.03310844E-14 2 0.08542154E+06 0.04195177E+02 0.02498585E+02 0.08085777E-03-0.02697697E-05 3 0.03040729E-08-0.01106652E-11 0.08545878E+06 0.04753459E+02 4 CH2(S) 31287C 1H 2 G 0300.00 4000.00 1000.00 1 0.03552889E+02 0.02066788E-01-0.01914116E-05-0.01104673E-08 0.02021350E-12 2 0.04984975E+06 0.01686570E+02 0.03971265E+02-0.01699089E-02 0.01025369E-04 3 0.02492551E-07-0.01981266E-10 0.04989368E+06 0.05753207E+00 4 C4H10 8/ 4/ 4 THERMC 4H 10 0 0G 300.000 5000.000 1392.000 31 1.24940183E+01 2.17726258E-02-7.44272215E-06 1.15487023E-09-6.69712949E-14 2 -2.18403437E+04-4.45558921E+01-4.55756824E-01 4.80323389E-02-2.65497552E-05 3 6.92544700E-09-6.38317504E-13-1.68960904E+04 2.64870966E+01 4 PC4H9 8/ 4/ 4 THERMC 4H 9 0 0G 300.000 5000.000 1391.000 31 1.20779744E+01 1.96264778E-02-6.71302199E-06 1.04206424E-09-6.04469282E-14 2 3.22550473E+03-3.87719384E+01 3.20730933E-01 4.34654454E-02-2.40584970E-05 3 6.28245308E-09-5.80113166E-13 7.71490893E+03 2.57301085E+01 4 SC4H9 8/ 4/ 4 THERMC 4H 9 0 0G 300.000 5000.000 1381.000 31 1.16934304E+01 1.96402287E-02-6.65306517E-06 1.02631895E-09-5.92826294E-14 2 1.96382429E+03-3.61626672E+01 8.49159986E-01 3.82085320E-02-1.49626797E-05 3 2.04499211E-10 8.24254437E-13 6.38832956E+03 2.44466606E+01 4 C4H8-1 6/29/ 4 THERMC 4H 8 0 0G 300.000 5000.000 1391.000 21 1.13456574E+01 1.80843428E-02-6.17276514E-06 9.56925815E-10-5.54586212E-14 2 -5.88659450E+03-3.64627206E+01-8.33377133E-01 4.54141123E-02-2.97609030E-05 3 1.03518354E-08-1.51975733E-12-1.49161811E+03 2.94327905E+01 4 C4H8-2 6/29/ 4 THERMC 4H 8 0 0G 300.000 5000.000 1384.000 21 1.07864376E+01 1.84629194E-02-6.28289490E-06 9.72052191E-10-5.62579166E-14 2 -7.11649782E+03-3.44892763E+01 6.69213599E-01 3.76839941E-02-1.85689683E-05 3 3.69571062E-09-1.03095209E-13-3.11675402E+03 2.14868169E+01 4 C4H71-1 4/ 2/97 THERMC 4H 7 0 0G 300.000 5000.000 1393.000 21 1.12162042E+01 1.56658034E-02-5.34224661E-06 8.27633431E-10-4.79428797E-14 2 2.41404271E+04-3.38119007E+01 1.19943124E-01 4.15804401E-02-2.89254150E-05 3 1.08174803E-08-1.70622296E-12 2.80390734E+04 2.58581923E+01 4 C4H71-2 4/ 2/97 THERMC 4H 7 0 0G 300.000 5000.000 1389.000 21 1.07092407E+01 1.61102825E-02-5.49846133E-06 8.52304018E-10-4.93905022E-14 2 2.31874323E+04-3.07648054E+01 9.64124370E-01 3.66781354E-02-2.17105448E-05 3 6.55880219E-09-8.11791145E-13 2.68423270E+04 2.24365633E+01 4 C4H71-3 4/ 2/97 THERMC 4H 7 0 0G 300.000 5000.000 1392.000 11 1.09470170E+01 1.63724387E-02-5.59896200E-06 8.69147693E-10-5.04214389E-14 2 1.11181741E+04-3.54908400E+01-1.12475112E+00 4.34882854E-02-2.87750454E-05 3 9.88046971E-09-1.40120341E-12 1.54420160E+04 2.97651156E+01 4 C4H71-4 4/ 2/97 THERMC 4H 7 0 0G 300.000 5000.000 1392.000 21 1.09215027E+01 1.59294073E-02-5.43642246E-06 8.42695797E-10-4.88353299E-14 2 1.90921144E+04-3.12721325E+01-4.09581101E-02 4.06024409E-02-2.67339769E-05 3 9.28995844E-09-1.35368138E-12 2.30309664E+04 2.79985374E+01 4 C4H72-2 4/ 2/97 THERMC 4H 7 0 0G 300.000 5000.000 1379.000 21 1.01554133E+01 1.65013248E-02-5.61672328E-06 8.69103603E-10-5.03037094E-14 2 2.18242102E+04-2.81884706E+01 2.43874352E+00 2.92295980E-02-1.10907624E-05 3 3.35089369E-10 4.95669524E-13 2.50864168E+04 1.52219548E+01 4 C4H6 4/ 4/ 0 THERMC 4H 6 0 0G 300.000 5000.000 1398.000 11 1.11633789E+01 1.37163965E-02-4.69715783E-06 7.29693836E-10-4.23486203E-14 2 7.79039770E+03-3.69847949E+01-1.43095121E+00 4.78706062E-02-4.15446800E-05 3 1.91549552E-08-3.57158507E-12 1.17551314E+04 2.90825833E+01 4 PC4H9O2H 7/19/ 0 THERMC 4H 10O 2 0G 300.000 5000.000 1387.000 51 1.82687454E+01 2.16940079E-02-7.54629828E-06 1.18484806E-09-6.92818498E-14 2 -3.39441633E+04-6.84816300E+01 6.34644286E-01 6.20007657E-02-4.34477749E-05 3 1.61407616E-08-2.53121507E-12-2.76345805E+04 2.67026090E+01 4 SC4H9O2H 7/19/ 0 THERMC 4H 10O 2 0G 300.000 5000.000 1390.000 51 1.88587916E+01 2.11200987E-02-7.33205568E-06 1.14969842E-09-6.71656991E-14 2 -3.64236058E+04-7.20026458E+01 3.40587657E-01 6.52078069E-02-4.84840460E-05 3 1.91011830E-08-3.13833073E-12-3.00007960E+04 2.72835451E+01 4 PC4H9O2 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1385.000 41 1.57845448E+01 2.15210910E-02-7.44909017E-06 1.16558071E-09-6.79885609E-14 2 -1.60146054E+04-5.40388525E+01 1.94363650E+00 5.15513163E-02-3.28284400E-05 3 1.13064860E-08-1.70118606E-12-1.08358103E+04 2.13503149E+01 4 SC4H9O2 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1389.000 41 1.64031135E+01 2.09361006E-02-7.23393011E-06 1.13058996E-09-6.58938667E-14 2 -1.85074517E+04-5.77331636E+01 1.32689044E+00 5.62785583E-02-4.01717786E-05 3 1.57120967E-08-2.62948443E-12-1.31557057E+04 2.34069659E+01 4 PC4H9O 8/ 9/ 4 THERMC 4H 9O 1 0G 300.000 5000.000 1403.000 31 1.49315588E+01 1.95927054E-02-6.66958265E-06 1.03222635E-09-5.97583630E-14 2 -1.46178979E+04-5.25561919E+01-4.99964924E-01 5.37157310E-02-3.44426650E-05 3 1.08145957E-08-1.29600044E-12-9.11644218E+03 3.09183423E+01 4 SC4H9O 8/ 9/ 4 THERMC 4H 9O 1 0G 300.000 5000.000 1679.000 31 1.43323395E+01 2.04542365E-02-7.12271896E-06 1.12545447E-09-6.62697853E-14 2 -1.60006806E+04-5.02030895E+01-4.09000900E-01 5.38573427E-02-3.39105695E-05 3 1.01023834E-08-1.11268025E-12-1.11109627E+04 2.88554742E+01 4 C4H7O 4/ 3/ 0 THERMC 4H 7O 1 0G 300.000 5000.000 1395.000 21 1.53137780E+01 1.43427017E-02-4.81625517E-06 7.39574839E-10-4.26140814E-14 2 -7.29342884E+02-5.52937859E+01-1.60619192E+00 5.58562682E-02-4.35595767E-05 3 1.70589279E-08-2.65635180E-12 4.85090326E+03 3.47112559E+01 4 C4H8O1-2 4/ 3/ 0 THERMC 4H 8O 1 0G 300.000 5000.000 1399.000 21 1.39197290E+01 1.85551492E-02-6.36014179E-06 9.88844645E-10-5.74274779E-14 2 -2.09452548E+04-5.06788231E+01-2.42033073E+00 5.79308508E-02-4.30236499E-05 3 1.66679793E-08-2.64714350E-12-1.53950880E+04 3.66425242E+01 4 C4H8O1-3 1/22/95 THERMC 4H 8O 1 0G 300.000 5000.000 1371.000 51 1.54227092E+01 1.70211052E-02-6.06347951E-06 9.67354762E-10-5.71992419E-14 2 -2.20194174E+04-6.13871862E+01-2.53690104E+00 5.43995707E-02-3.43390305E-05 3 1.01079922E-08-1.10262736E-12-1.52980680E+04 3.67400719E+01 4 C4H8O1-4 1/22/95 THERMC 4H 8O 1 0G 300.000 5000.000 1361.000 51 1.42360731E+01 1.81176105E-02-6.46263809E-06 1.03194372E-09-6.10557331E-14 2 -2.99478670E+04-5.52081041E+01-3.28505561E+00 5.04800902E-02-2.51998984E-05 3 3.65743744E-09 3.94863161E-13-2.30067422E+04 4.19349253E+01 4 C4H8O2-3 1/22/95 THERMC 4H 8O 1 0G 300.000 5000.000 1384.000 51 1.58263859E+01 1.64400938E-02-5.80680311E-06 9.21146000E-10-5.42511002E-14 2 -2.35334573E+04-6.34844562E+01-2.98701197E+00 6.32678880E-02-5.20855777E-05 3 2.24064364E-08-3.95416618E-12-1.71957196E+04 3.66920390E+01 4 C4H8OH-1 2/14/95 THERMC 4H 9O 1 0G 300.000 5000.000 2017.000 41 1.22411698E+01 2.14192799E-02-7.36540176E-06 1.15346865E-09-6.74843941E-14 2 -1.59314041E+04-3.35659613E+01 8.93729480E-01 4.56458552E-02-2.50918881E-05 3 6.24130181E-09-4.99533512E-13-1.20051696E+04 2.78453352E+01 4 C4H8OH-2 2/14/95 THERMC 4H 9O 1 0G 300.000 5000.000 1390.000 41 1.40098964E+01 1.96303998E-02-6.61483807E-06 1.01686276E-09-5.85950747E-14 2 -1.90865900E+04-4.50052542E+01 7.34225848E-01 4.82233506E-02-2.92566110E-05 3 8.78396067E-09-1.01812519E-12-1.42394556E+04 2.71427693E+01 4 C4H8OH-1O2 6/26/95 THERMC 4H 9O 3 0G 300.000 5000.000 1396.000 51 1.74383247E+01 2.16778876E-02-7.37772628E-06 1.14128811E-09-6.60391451E-14 2 -3.55892620E+04-5.71247140E+01 2.88497398E+00 5.63287929E-02-3.98403503E-05 3 1.53891643E-08-2.51940787E-12-3.05246721E+04 2.09293355E+01 4 C4H8OH-2O2 6/26/95 THERMC 4H 9O 3 0G 300.000 5000.000 1399.000 51 1.82942871E+01 2.09395389E-02-7.12096934E-06 1.10103094E-09-6.36889768E-14 2 -3.80505855E+04-6.29154326E+01 2.10003504E+00 6.17528218E-02-4.77238541E-05 3 1.99145784E-08-3.44416275E-12-3.26698755E+04 2.30901271E+01 4 C4H8OOH1-1 3/27/97 THERMC 4H 9O 2 0G 300.000 5000.000 1379.000 51 1.80477436E+01 1.92137176E-02-6.66503008E-06 1.04468117E-09-6.10170737E-14 2 -1.23069570E+04-6.33580990E+01 4.36087539E+00 4.46153162E-02-2.14784588E-05 3 3.14619957E-09 3.03152649E-13-6.89950326E+03 1.24757248E+01 4 C4H8OOH1-2 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1393.000 51 1.58327906E+01 2.07220436E-02-7.09869028E-06 1.10302045E-09-6.40251984E-14 2 -8.53034314E+03-5.04399828E+01 1.51698234E+00 5.44584331E-02-3.84524319E-05 3 1.48145523E-08-2.42809434E-12-3.49728423E+03 2.64916926E+01 4 C4H8OOH1-3 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1377.000 51 1.76442170E+01 1.91706536E-02-6.57168641E-06 1.02246571E-09-5.94304735E-14 2 -1.01859280E+04-6.17115813E+01 1.94106276E+00 5.18789351E-02-3.10411683E-05 3 8.63568881E-09-8.42841994E-13-4.34315962E+03 2.40230471E+01 4 C4H8OOH1-4 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1386.000 51 1.78623700E+01 1.95212501E-02-6.80351173E-06 1.06960529E-09-6.26000540E-14 2 -8.87923008E+03-6.34393359E+01 1.45017084E+00 5.72418991E-02-4.06431218E-05 3 1.52821793E-08-2.42123218E-12-3.02905522E+03 2.50737890E+01 4 C4H8OOH2-1 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1390.000 51 1.84555673E+01 1.89543719E-02-6.59381457E-06 1.03538370E-09-6.05467101E-14 2 -1.13637100E+04-6.69839138E+01 1.01711681E+00 6.10560866E-02-4.65789185E-05 3 1.88024138E-08-3.15265575E-12-5.37391474E+03 2.63059691E+01 4 C4H8OOH2-2 3/27/97 THERMC 4H 9O 2 0G 300.000 5000.000 1383.000 51 1.63837700E+01 2.04422768E-02-7.04524557E-06 1.09927552E-09-6.39967086E-14 2 -1.45616229E+04-5.33147431E+01 4.40329034E+00 4.30478989E-02-2.14076129E-05 3 4.28267268E-09-1.27804885E-13-9.79432029E+03 1.30514046E+01 4 C4H8OOH2-3 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1387.000 51 1.79338472E+01 1.92153623E-02-6.64486961E-06 1.03940007E-09-6.06239862E-14 2 -1.25767913E+04-6.36194089E+01 1.45436266E+00 5.63121286E-02-3.84161425E-05 3 1.34229297E-08-1.92382914E-12-6.68916116E+03 2.54247554E+01 4 C4H8OOH2-4 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1390.000 51 1.84555673E+01 1.89543719E-02-6.59381457E-06 1.03538370E-09-6.05467101E-14 2 -1.13637100E+04-6.69839138E+01 1.01711681E+00 6.10560866E-02-4.65789185E-05 3 1.88024138E-08-3.15265575E-12-5.37391474E+03 2.63059691E+01 4 C4H8OOH1-2O2 7/19/ 0 TRMC 4H 9O 4 0G 300.000 5000.000 1387.000 61 2.23244015E+01 2.05474775E-02-7.19076348E-06 1.13361536E-09-6.64744383E-14 2 -3.05468277E+04-8.32666070E+01 2.22400728E+00 7.04994620E-02-5.66978827E-05 3 2.42627751E-08-4.29715459E-12-2.37391490E+04 2.38371533E+01 4 C4H8OOH1-3O2 7/19/ 0 TRMC 4H 9O 4 0G 300.000 5000.000 1387.000 61 2.23244015E+01 2.05474775E-02-7.19076348E-06 1.13361536E-09-6.64744383E-14 2 -3.05468277E+04-8.32666070E+01 2.22400728E+00 7.04994620E-02-5.66978827E-05 3 2.42627751E-08-4.29715459E-12-2.37391490E+04 2.38371533E+01 4 C4H8OOH1-4O2 7/19/ 0 TRMC 4H 9O 4 0G 300.000 5000.000 1383.000 61 2.17116470E+01 2.11216172E-02-7.40101448E-06 1.16772959E-09-6.85139846E-14 2 -2.80483124E+04-7.95885249E+01 3.12351717E+00 6.46725908E-02-4.78357914E-05 3 1.89656817E-08-3.18025828E-12-2.14664300E+04 2.04322494E+01 4 C4H8OOH2-1O2 7/19/ 0 TRMC 4H 9O 4 0G 300.000 5000.000 1387.000 61 2.23244015E+01 2.05474775E-02-7.19076348E-06 1.13361536E-09-6.64744383E-14 2 -3.05468277E+04-8.32666070E+01 2.22400728E+00 7.04994620E-02-5.66978827E-05 3 2.42627751E-08-4.29715459E-12-2.37391490E+04 2.38371533E+01 4 C4H8OOH2-3O2 7/19/ 0 TRMC 4H 9O 4 0G 300.000 5000.000 1389.000 61 2.29951044E+01 1.99238919E-02-6.96326765E-06 1.09677832E-09-6.42747281E-14 2 -3.30095408E+04-8.71461958E+01 2.19248006E+00 7.36763430E-02-6.24428300E-05 3 2.79371307E-08-5.10126013E-12-2.61773538E+04 2.29568752E+01 4 C4H8OOH2-4O2 7/19/ 0 TRMC 4H 9O 4 0G 300.000 5000.000 1387.000 61 2.23244015E+01 2.05474775E-02-7.19076348E-06 1.13361536E-09-6.64744383E-14 2 -3.05468277E+04-8.32666070E+01 2.22400728E+00 7.04994620E-02-5.66978827E-05 3 2.42627751E-08-4.29715459E-12-2.37391490E+04 2.38371533E+01 4 NC4KET12 7/19/ 0 THERMC 4H 8O 3 0G 300.000 5000.000 1388.000 51 2.02458485E+01 1.76440360E-02-6.19054598E-06 9.77688024E-10-5.74053258E-14 2 -4.58141511E+04-7.52145443E+01 8.05387149E-01 6.52375119E-02-5.18373651E-05 3 2.13454896E-08-3.59860255E-12-3.92395961E+04 2.84908472E+01 4 NC4KET13 7/19/ 0 THERMC 4H 8O 3 0G 300.000 5000.000 1386.000 51 1.96430808E+01 1.80940566E-02-6.33063232E-06 9.97860399E-10-5.85076458E-14 2 -4.59588851E+04-7.16905094E+01 2.74883461E+00 5.86936745E-02-4.49605895E-05 3 1.83200130E-08-3.11765369E-12-4.01065878E+04 1.88072090E+01 4 NC4KET14 7/19/ 0 THERMC 4H 8O 3 0G 300.000 5000.000 1382.000 51 1.90283822E+01 1.86604765E-02-6.53616227E-06 1.03102482E-09-6.04833256E-14 2 -4.34678787E+04-6.80210373E+01 3.40797147E+00 5.37386096E-02-3.72613233E-05 3 1.36862855E-08-2.13798779E-12-3.77919233E+04 1.65580190E+01 4 NC4KET21 7/19/ 0 THERMC 4H 8O 3 0G 300.000 5000.000 1376.000 51 1.86231473E+01 1.90969401E-02-6.70745998E-06 1.05994690E-09-6.22564248E-14 2 -4.71929933E+04-6.55477892E+01 4.69785973E+00 4.83859623E-02-3.05576939E-05 3 1.02705744E-08-1.51713483E-12-4.18665528E+04 1.06715264E+01 4 NC4KET23 7/19/ 0 THERMC 4H 8O 3 0G 300.000 5000.000 1387.000 51 1.99512969E+01 1.79558596E-02-6.31230878E-06 9.98217386E-10-5.86636973E-14 2 -4.95585495E+04-7.43071328E+01 4.50575961E-01 6.48862527E-02-5.04446464E-05 3 2.03085220E-08-3.35952497E-12-4.28779359E+04 3.00153676E+01 4 NC4KET24 7/19/ 0 THERMC 4H 8O 3 0G 300.000 5000.000 1380.000 51 1.87707201E+01 1.89490823E-02-6.65182145E-06 1.05080860E-09-6.17069393E-14 2 -4.72319802E+04-6.73335107E+01 2.93007283E+00 5.39296076E-02-3.66164919E-05 3 1.30880106E-08-1.99245456E-12-4.14118815E+04 1.86567511E+01 4 C2H5COCH3 4/ 3/ 0 THERMC 4H 8O 1 0G 300.000 5000.000 1381.000 31 1.29004080E+01 1.92211770E-02-6.63870986E-06 1.03733411E-09-6.04509514E-14 2 -3.52062426E+04-4.20803599E+01 1.60664724E+00 4.13951332E-02-2.23585444E-05 3 5.78456048E-09-5.69530338E-13-3.07586009E+04 2.02429671E+01 4 C2H5COCH2 4/ 3/ 0 THERMC 4H 7O 1 0G 300.000 5000.000 1383.000 31 1.42098738E+01 1.57866459E-02-5.50529183E-06 8.65870540E-10-5.06913329E-14 2 -1.41284951E+04-4.87132911E+01 1.54013856E+00 4.39486258E-02-2.97002421E-05 3 1.05495313E-08-1.58598769E-12-9.50796505E+03 1.99706641E+01 4 CH2CH2COCH3 6/21/95 THERC 4H 7O 1 0G 300.000 5000.000 1380.00 31 1.24694368E+01 1.71022143E-02-5.92156726E-06 9.26816806E-10-5.40730504E-14 2 -1.01378242E+04-3.62186375E+01 2.40255609E+00 3.67294268E-02-1.97316510E-05 3 5.07323216E-09-4.99655275E-13-6.15006886E+03 1.93993386E+01 4 CH3CHCOCH3 4/ 3/ 0 THERMC 4H 7O 1 0G 300.000 5000.000 1384.000 31 1.31388032E+01 1.66091073E-02-5.76924215E-06 9.04978165E-10-5.28826527E-14 2 -1.51162098E+04-4.38876580E+01 8.12941079E-01 4.29256944E-02-2.69230252E-05 3 8.59326807E-09-1.13188129E-12-1.05247481E+04 2.32952685E+01 4 C2H3COCH3 6/19/95 THERMC 4H 6O 1 0G 300.000 5000.000 1386.00 21 1.25571995E+01 1.49672645E-02-5.20015351E-06 8.15864365E-10-4.76824406E-14 2 -2.14622958E+04-4.01434299E+01 2.45578501E-01 4.26432049E-02-2.91126822E-05 3 1.03478392E-08-1.53551381E-12-1.70305379E+04 2.64430799E+01 4 CH3CHOOCOCH3 6/27/95 C 4H 7O 3 0G 300.000 5000.000 1393.00 41 1.72170832E+01 1.76740453E-02-6.10387321E-06 9.53711693E-10-5.55757409E-14 2 -3.05280370E+04-5.67959657E+01 1.59405312E+00 5.74729487E-02-4.65071459E-05 3 2.01816805E-08-3.61175600E-12-2.53445178E+04 2.60857480E+01 4 CH2CHOOHCOCH3 6/27/95 C 4H 7O 3 0G 300.000 5000.000 1394.00 51 1.93158016E+01 1.56592602E-02-5.45395604E-06 8.57160086E-10-5.01582885E-14 2 -2.47752201E+04-6.70296581E+01 1.55204769E+00 6.08201262E-02-5.04704383E-05 3 2.16347587E-08-3.75674081E-12-1.89563540E+04 2.71011896E+01 4 NC3H7CHO 9/27/95 THERMC 4H 8O 1 0G 300.000 5000.000 1378.00 31 1.35988068E+01 1.81652474E-02-6.17844458E-06 9.55980208E-10-5.53442958E-14 2 -3.15845348E+04-4.51790228E+01 1.87415959E+00 4.19240315E-02-2.35148779E-05 3 6.26913673E-09-6.09443908E-13-2.71032194E+04 1.91568574E+01 4 NC3H7CO 9/27/95 THERMC 4H 7O 1 0G 300.000 5000.000 1380.00 31 1.30026331E+01 1.63104877E-02-5.57642899E-06 8.65670629E-10-5.02255667E-14 2 -1.25523385E+04-4.02608515E+01 2.67256826E+00 3.71198825E-02-2.06862859E-05 3 5.48873888E-09-5.35864183E-13-8.58050888E+03 1.64848950E+01 4 C3H6CHO-1 9/27/95 THERMC 4H 7O 1 0G 300.000 5000.000 1379.000 31 1.30322954E+01 1.62418373E-02-5.54388124E-06 8.59723685E-10-4.98459726E-14 2 -6.45915975E+03-3.92399021E+01 2.67672303E+00 3.73064128E-02-2.11281405E-05 3 5.80472681E-09-6.09688236E-13-2.49714183E+03 1.75750933E+01 4 C3H6CHO-2 11/15/95 THERMC 4H 7O 1 0G 300.000 5000.000 1682.000 31 1.11942816E+01 1.81806772E-02-6.35916662E-06 1.00727333E-09-5.93943618E-14 2 -6.86826460E+03-2.80298956E+01 2.95067531E+00 3.34223079E-02-1.45356815E-05 3 1.67282048E-09 2.62011555E-13-3.79034324E+03 1.74324072E+01 4 C3H6CHO-3 11/15/95 THERMC 4H 7O 1 0G 300.000 5000.000 1387.000 31 1.34301738E+01 1.62250792E-02-5.60631713E-06 8.76356273E-10-5.10864241E-14 2 -1.13561098E+04-4.47371262E+01 1.35168659E+00 4.23714083E-02-2.69123192E-05 3 8.70132567E-09-1.15287455E-12-6.91166610E+03 2.09381509E+01 4 C2H5CHCO 9/27/95 THERMC 4H 6O 1 0G 300.000 5000.000 1400.00 21 1.34100537E+01 1.38766678E-02-4.74130143E-06 7.35504188E-10-4.26457752E-14 2 -1.83790837E+04-4.45295352E+01 2.76600655E-01 4.82966593E-02-4.02376928E-05 3 1.76564254E-08-3.14365357E-12-1.41717351E+04 2.47118671E+01 4 SC3H5CHO 11/15/95 THERC 4H 6O 1 0G 300.000 5000.000 1390.000 21 1.31695904E+01 1.42484434E-02-4.90843998E-06 7.65789041E-10-4.45834896E-14 2 -2.04032613E+04-4.43673205E+01 4.35795171E-01 4.48719314E-02-3.36582931E-05 3 1.33066870E-08-2.17839128E-12-1.60394651E+04 2.37597452E+01 4 SC3H5CO 11/15/95 THERMC 4H 5O 1 0G 300.000 5000.000 1392.000 21 1.25514754E+01 1.22521948E-02-4.22382101E-06 6.59184896E-10-3.83818826E-14 2 -4.25349795E+03-4.02864145E+01 1.74191343E+00 3.97229536E-02-3.20061901E-05 3 1.38227925E-08-2.46272017E-12-6.64428100E+02 1.70762023E+01 4 IC4H10 8/ 4/ 4 THERMC 4H 10 0 0G 300.000 5000.000 1387.000 31 1.25375828E+01 2.20249881E-02-7.59339274E-06 1.18498137E-09-6.89902468E-14 2 -2.29421635E+04-4.67741623E+01-9.72807331E-01 5.08660928E-02-3.12355006E-05 3 1.02057756E-08-1.44168766E-12-1.78542290E+04 2.69572545E+01 4 IC4H9 8/ 4/ 4 THERMC 4H 9 0 0G 300.000 5000.000 1386.000 31 1.21276930E+01 1.98689494E-02-6.85937004E-06 1.07141528E-09-6.24184609E-14 2 2.11952051E+03-4.08727278E+01-2.21457835E-01 4.63756324E-02-2.88282920E-05 3 9.60200646E-09-1.39021034E-12 6.76153637E+03 2.64801220E+01 4 TC4H9 8/ 4/ 4 THERMC 4H 9 0 0G 300.000 5000.000 1372.000 31 1.05855083E+01 2.11892055E-02-7.31668360E-06 1.14296173E-09-6.65898835E-14 2 3.18311189E+02-3.20671258E+01 3.04300181E+00 2.91276259E-02-4.01386786E-06 3 -4.90273974E-09 1.64014891E-12 4.04780980E+03 1.21127351E+01 4 IC4H8 10/23/ 5 THERMC 4H 8 0 0G 300.000 5000.000 1388.000 21 1.12258330E+01 1.81795798E-02-6.20348592E-06 9.61444458E-10-5.57088057E-14 2 -7.90617899E+03-3.66411888E+01 9.38433173E-01 3.90547287E-02-2.16437148E-05 3 5.87267077E-09-6.14435479E-13-3.95452013E+03 1.98337802E+01 4 IC4H7 10/23/ 5 THERMC 4H 7 0 0G 300.000 5000.000 1393.000 11 1.16382753E+01 1.57681299E-02-5.38538858E-06 8.35172927E-10-4.84141083E-14 2 1.03408230E+04-3.90259890E+01-7.20881697E-04 4.36495730E-02-3.16385877E-05 3 1.23984983E-08-2.04378360E-12 1.43654373E+04 2.33234340E+01 4 IC4H9O2 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1387.000 41 1.59741221E+01 2.13534740E-02-7.39001105E-06 1.15624411E-09-6.74408046E-14 2 -1.72329304E+04-5.65302409E+01 1.21434293E+00 5.45388311E-02-3.67001593E-05 3 1.34131042E-08-2.11741793E-12-1.18482450E+04 2.34153048E+01 4 TC4H9O2 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1388.000 41 1.67061556E+01 2.07327780E-02-7.17596169E-06 1.12282473E-09-6.54941386E-14 2 -2.04046924E+04-6.35558608E+01 1.08742583E+00 5.82780709E-02-4.33292697E-05 3 1.76892535E-08-3.06769606E-12-1.49456640E+04 2.01871963E+01 4 TC4H8O2H-I 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1405.000 51 1.78060253E+01 1.84952716E-02-6.21268423E-06 9.52753962E-10-5.48010330E-14 2 -1.17555816E+04-6.40180236E+01 1.57469723E+00 6.04648659E-02-4.84991814E-05 3 2.05236181E-08-3.52974722E-12-6.54190901E+03 2.16852700E+01 4 IC4H8O2H-I 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1388.000 51 1.80246456E+01 1.93668264E-02-6.74676496E-06 1.06040129E-09-6.20506445E-14 2 -1.00858977E+04-6.57629693E+01 9.94784793E-01 5.89212240E-02-4.25202225E-05 3 1.61370574E-08-2.55904902E-12-4.08029057E+03 2.58950880E+01 4 IC4H8O2H-T 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1397.000 51 1.52395012E+01 2.06496983E-02-6.94791927E-06 1.06651097E-09-6.13782754E-14 2 -1.02271199E+04-4.70908585E+01 3.77633001E+00 4.50889269E-02-2.62423875E-05 3 7.74736900E-09-9.11520393E-13-5.98295842E+03 1.53503399E+01 4 IC4H8O 7/19/95 THERMC 4H 8O 1 0G 300.000 5000.000 1399.000 21 1.44624830E+01 1.80562860E-02-6.18008791E-06 9.59941341E-10-5.57132297E-14 2 -2.30230616E+04-5.61190165E+01-2.97373741E+00 6.24618637E-02-5.04348211E-05 3 2.13345360E-08-3.67382824E-12-1.73274318E+04 3.62336362E+01 4 CC4H8O 6/29/95 THERMC 4H 8O 1 0G 300.000 5000.000 1401.000 11 1.35131704E+01 1.91666441E-02-6.53902359E-06 1.01366570E-09-5.87546671E-14 2 -2.00311488E+04-5.22146967E+01-5.27768230E+00 6.52482242E-02-5.00209030E-05 3 1.97452179E-08-3.15605813E-12-1.37706522E+04 4.78500688E+01 4 TC4H9O 8/ 9/ 4 THERMC 4H 9O 1 0G 300.000 5000.000 1397.000 31 1.50819361E+01 1.94454128E-02-6.61333610E-06 1.02279160E-09-5.91796928E-14 2 -1.88111456E+04-5.71658947E+01-5.32084074E-01 5.71613469E-02-4.20177228E-05 3 1.63745425E-08-2.64124700E-12-1.34963439E+04 2.62776957E+01 4 IC4H9O 8/ 9/ 4 THERMC 4H 9O 1 0G 300.000 5000.000 1393.000 31 1.46765729E+01 2.00942091E-02-6.90362097E-06 1.07495878E-09-6.24925271E-14 2 -1.55789914E+04-5.26039549E+01-7.66695776E-01 5.55173852E-02-3.81796473E-05 3 1.37862085E-08-2.07312751E-12-1.01111245E+04 3.06331234E+01 4 IC4H9O2H 7/19/ 0 THERMC 4H 10O 2 0G 300.000 5000.000 1388.000 51 1.84308794E+01 2.15337606E-02-7.48623965E-06 1.17499240E-09-6.86890788E-14 2 -3.51483277E+04-7.08030846E+01 2.44181899E-01 6.34027841E-02-4.49162379E-05 3 1.67406877E-08-2.61216478E-12-2.86959808E+04 2.72156229E+01 4 TC4H9O2H 7/19/ 0 THERMC 4H 10O 2 0G 300.000 5000.000 1390.000 51 1.91617041E+01 2.09157249E-02-7.27346821E-06 1.14180989E-09-6.67577135E-14 2 -3.83201687E+04-7.78230874E+01 1.14505932E-01 6.71507854E-02-5.15578410E-05 3 2.10256365E-08-3.56467024E-12-3.17928725E+04 2.40011030E+01 4 IC4H7O 4/ 3/ 0 THERMC 4H 7O 1 0G 300.000 5000.000 1386.000 21 1.33457615E+01 1.61218588E-02-5.44376403E-06 8.38199374E-10-4.83608280E-14 2 6.11443644E+02-4.36818838E+01 1.74700687E+00 4.07783436E-02-2.44750243E-05 3 7.06502958E-09-7.51570589E-13 4.86979233E+03 1.94535999E+01 4 IC4H8OH 2/14/95 THERMC 4H 9O 1 0G 300.000 5000.000 1376.000 41 1.25605997E+01 2.10637488E-02-7.15019648E-06 1.10439262E-09-6.38428695E-14 2 -1.86203249E+04-3.67889430E+01 3.29612707E+00 3.47649647E-02-1.02505618E-05 3 -2.04641931E-09 1.18879408E-12-1.45627247E+04 1.58606320E+01 4 IO2C4H8OH 8/23/95 THERMC 4H 9O 3 0G 300.000 5000.000 1395.000 51 1.79798208E+01 2.13452115E-02-7.29108198E-06 1.13068846E-09-6.55402236E-14 2 -3.85769917E+04-6.23553522E+01 2.88826008E+00 5.80363124E-02-4.26690874E-05 3 1.71759332E-08-2.91842186E-12-3.33881503E+04 1.83381149E+01 4 IC3H7CHO 2/22/96 THERMC 4H 8O 1 0G 300.000 5000.000 1391.000 31 1.37501656E+01 1.83126722E-02-6.28572629E-06 9.78250756E-10-5.68538653E-14 2 -3.26936771E+04-4.77270548E+01-2.73021382E-01 4.89696307E-02-3.12770049E-05 3 1.00052945E-08-1.27512074E-12-2.76054737E+04 2.83451139E+01 4 TC3H6CHO 2/22/96 THERMC 4H 7O 1 0G 300.000 5000.000 1389.000 21 1.31013047E+01 1.66391865E-02-5.68457623E-06 8.81808351E-10-5.11290161E-14 2 -1.30638647E+04-4.42705813E+01 1.87052762E+00 4.14869677E-02-2.66815701E-05 3 9.01531610E-09-1.27870633E-12-8.97730744E+03 1.66174178E+01 4 IC3H6CHO 2/22/96 THERMC 4H 7O 1 0G 300.000 5000.000 1390.000 31 1.33102250E+01 1.62097959E-02-5.57575891E-06 8.69003718E-10-5.05554202E-14 2 -7.62177931E+03-4.25050854E+01 5.21481767E-01 4.43114357E-02-2.86617314E-05 3 9.30319894E-09-1.20761563E-12-2.99677086E+03 2.68182130E+01 4 IC3H7CO 2/22/96 THERMC 4H 7O 1 0G 300.000 5000.000 1390.000 31 1.33305736E+01 1.61873930E-02-5.56711402E-06 8.67575951E-10-5.04696549E-14 2 -1.37307001E+04-4.33958746E+01 5.03452639E-01 4.41607510E-02-2.82139091E-05 3 8.93548675E-09-1.11327422E-12-9.07755468E+03 2.61991461E+01 4 TC4H8OOH-IO2 7/19/ 0 TRMC 4H 9O 4 0G 300.000 5000.000 1386.000 61 2.26382889E+01 2.03246143E-02-7.12390770E-06 1.12425028E-09-6.59732993E-14 2 -3.24406877E+04-8.80387843E+01 2.17782096E+00 7.17785118E-02-5.88836046E-05 3 2.56759171E-08-4.61678643E-12-2.55622378E+04 2.07846231E+01 4 IC4H8OOH-IO2 7/19/ 0 TRMC 4H 9O 4 0G 300.000 5000.000 1385.000 61 2.18969581E+01 2.09637874E-02-7.34664900E-06 1.15926594E-09-6.80225413E-14 2 -2.92664889E+04-8.20540807E+01 2.39424426E+00 6.76572549E-02-5.17083682E-05 3 2.10796041E-08-3.59960373E-12-2.24787495E+04 2.25029839E+01 4 IC4H8OOH-TO2 7/19/ 0 TRMC 4H 9O 4 0G 300.000 5000.000 1386.000 61 2.26382889E+01 2.03246143E-02-7.12390770E-06 1.12425028E-09-6.59732993E-14 2 -3.24406877E+04-8.80387843E+01 2.17782096E+00 7.17785118E-02-5.88836046E-05 3 2.56759171E-08-4.61678643E-12-2.55622378E+04 2.07846231E+01 4 IC4KETII 7/19/ 0 THERMC 4H 8O 3 0G 300.000 5000.000 1387.000 51 1.95143059E+01 1.82377395E-02-6.38908606E-06 1.00801571E-09-5.91440350E-14 2 -4.46884836E+04-7.17167584E+01 1.15501614E+00 6.10622345E-02-4.49711323E-05 3 1.70514654E-08-2.65948602E-12-3.82747956E+04 2.69612235E+01 4 IC4KETIT 7/19/ 0 THERMC 4H 8O 3 0G 300.000 5000.000 1388.000 51 2.09369850E+01 1.71090955E-02-6.01892169E-06 9.52353863E-10-5.59926176E-14 2 -4.77819819E+04-8.27717611E+01 1.14243741E+00 6.33840797E-02-4.73084738E-05 3 1.77145373E-08-2.67265475E-12-4.09366796E+04 2.34844867E+01 4 IC4H7OH 4/ 8/97 THERMC 4H 8O 1 0G 300.000 5000.000 1384.000 31 1.35043419E+01 1.78646968E-02-5.99304371E-06 9.18717641E-10-5.28435302E-14 2 -2.58255688E+04-4.44645715E+01 1.69099899E+00 4.27168891E-02-2.49281695E-05 3 7.00961522E-09-7.23262828E-13-2.14512334E+04 1.99500833E+01 4 IC4H6OH 8/19/95 THERMC 4H 7O 1 0G 300.000 5000.000 1390.000 31 1.40310926E+01 1.55317541E-02-5.32754961E-06 8.28785902E-10-4.81545257E-14 2 -7.69378228E+03-4.76555306E+01 8.63371227E-01 4.68711282E-02-3.43580339E-05 3 1.33031052E-08-2.13914975E-12-3.14948305E+03 2.29075523E+01 4 IC3H5CHO 7/19/95 THERMC 4H 6O 1 0G 300.000 5000.000 1396.000 21 1.36203958E+01 1.37917192E-02-4.73370118E-06 7.36655226E-10-4.20097974E-14 2 -2.00025274E+04-4.73184531E+01 6.27183793E-01 4.66780254E-02-3.74430631E-05 3 1.58330542E-08-2.73952155E-12-1.57203117E+04 2.16034294E+01 4 IC3H5CO 4/ 3/ 0 THERMC 4H 5O 1 0G 300.000 5000.000 1397.000 21 1.30667437E+01 1.16704244E-02-3.99106523E-06 6.19498148E-10-3.59348249E-14 2 -3.36519344E+03-4.35803090E+01 1.85097069E+00 4.18855846E-02-3.62553731E-05 3 1.65690659E-08-3.05850846E-12 1.70381441E+02 1.53014433E+01 4 TC3H6OCHO 8/25/95 THERMC 4H 7O 2 0G 300.000 5000.000 1394.00 31 1.70371287E+01 1.54400645E-02-5.28332886E-06 8.21085347E-10-4.76898429E-14 2 -2.75871941E+04-6.37271230E+01 3.70830259E-01 5.38475661E-02-3.82477565E-05 3 1.32882237E-08-1.79228730E-12-2.18391262E+04 2.58142112E+01 4 IC3H6CO 03/03/95 THERMC 4H 6O 1 0G 300.000 5000.000 1397.00 41 1.32548232E+01 1.40142787E-02-4.78910215E-06 7.42924342E-10-4.30737566E-14 2 -2.00529779E+04-4.44810221E+01 2.28039055E+00 4.17016989E-02-3.25089661E-05 3 1.37243419E-08-2.40573132E-12-1.63939712E+04 1.38187714E+01 4 IC4H7OOH 7/19/95 THERMC 4H 8O 2 0G 300.000 5000.000 1392.00 41 1.69234564E+01 1.78396769E-02-6.14273279E-06 9.57895028E-10-5.57438304E-14 2 -2.00040686E+04-5.94746070E+01 2.99117402E+00 5.03349278E-02-3.56280061E-05 3 1.33952154E-08-2.11053409E-12-1.51095046E+04 1.54537413E+01 4 TC3H6OHCHO 8/ 1/95 THERMC 4H 8O 2 0G 300.000 5000.000 1396.00 41 1.70788996E+01 1.74005554E-02-5.93008112E-06 9.18860909E-10-5.32512140E-14 2 -5.38730427E+04-6.38638754E+01 2.10033500E-01 5.63086284E-02-3.95158669E-05 3 1.37780428E-08-1.89068805E-12-4.80402638E+04 2.67836070E+01 4 TC3H6OH 8/ 1/95 THERMC 3H 7O 1 0G 300.000 5000.000 1389.00 31 1.01256920E+01 1.61868427E-02-5.52405957E-06 8.56051932E-10-4.95935542E-14 2 -1.70083112E+04-2.59254163E+01 2.31803956E+00 3.17304980E-02-1.69638706E-05 3 4.59998773E-09-5.18285520E-13-1.39382712E+04 1.71105868E+01 4 IC3H5OH 8/ 1/95 THERMC 3H 6O 1 0G 300.000 5000.000 1374.00 21 1.07381025E+01 1.31698194E-02-4.41529622E-06 6.77009837E-10-3.89608901E-14 2 -2.47298321E+04-3.13634050E+01 1.58376391E+00 3.16215366E-02-1.73664942E-05 3 4.18927663E-09-2.79899620E-13-2.12643496E+04 1.88313766E+01 4 TC3H6O2CHO 8/ 2/95 THERMC 4H 7O 3 0G 300.000 5000.000 1386.00 41 1.85534443E+01 1.68774389E-02-5.90752965E-06 9.31518085E-10-5.46345187E-14 2 -2.85447191E+04-6.82486667E+01 2.17883383E+00 5.41595832E-02-3.83435886E-05 3 1.38308104E-08-2.04190147E-12-2.27394154E+04 2.00751264E+01 4 TC3H6O2HCO 8/ 2/95 THERMC 4H 7O 3 0G 300.000 5000.000 1387.00 51 2.06472678E+01 1.48526500E-02-5.25104875E-06 8.33619219E-10-4.91256069E-14 2 -2.88719869E+04-7.95951389E+01 2.03864428E+00 5.80421003E-02-4.32123528E-05 3 1.58792094E-08-2.32209543E-12-2.24284673E+04 2.03680990E+01 4 IC3H5O2HCHO 8/2/95 THERMC 4H 7O 3 0G 300.000 5000.000 1387.00 51 2.06288832E+01 1.48625539E-02-5.25305276E-06 8.33772951E-10-4.91277401E-14 2 -2.27589076E+04-7.82962888E+01 2.05984770E+00 5.82331716E-02-4.37672100E-05 3 1.63249918E-08-2.43462051E-12-1.63496250E+04 2.13687921E+01 4 CH2CCH2OH 9/ 8/95 THERMC 3H 5O 1 0G 300.000 5000.000 1372.00 21 9.70702027E+00 1.13972660E-02-3.77993962E-06 5.75209277E-10-3.29229125E-14 2 9.13212884E+03-2.25012933E+01 2.88422544E+00 2.42428071E-02-1.14152268E-05 3 1.71775334E-09 1.42177454E-13 1.17935615E+04 1.52102335E+01 4 TC4H8CHO 9/ 7/95 THERMC 5H 9O 1 0G 300.000 5000.000 1397.00 41 1.79663933E+01 1.94207117E-02-6.67409451E-06 1.03969221E-09-6.04702651E-14 2 -1.33368585E+04-6.79819424E+01-9.58078294E-01 6.42003258E-02-4.70776827E-05 3 1.75737698E-08-2.64896151E-12-6.86582501E+03 3.33781112E+01 4 O2C4H8CHO 9/ 7/95 THERMC 5H 9O 3 0G 300.000 5000.000 1395.00 51 2.12629904E+01 2.14072282E-02-7.38342949E-06 1.15281523E-09-6.71508438E-14 2 -3.16854524E+04-7.99828703E+01 1.91847699E+00 6.67245869E-02-4.80871046E-05 3 1.78588690E-08-2.71163880E-12-2.49837984E+04 2.38577867E+01 4 O2HC4H8CO 9/ 7/95 THERMC 5H 9O 3 0G 300.000 5000.000 1394.00 61 2.38219630E+01 1.91411448E-02-6.67919154E-06 1.05127303E-09-6.15876805E-14 2 -3.23093973E+04-9.42580755E+01 1.82607262E+00 6.93466111E-02-4.93125140E-05 3 1.69848340E-08-2.26117657E-12-2.46578311E+04 2.41167544E+01 4 C3H5OH 9/ 8/95 THERMC 3H 6O 1 0G 300.000 5000.000 1388.00 21 1.02818222E+01 1.34248012E-02-4.47039448E-06 6.81924195E-10-3.90899553E-14 2 -1.99960114E+04-2.77736680E+01 1.08899314E+00 3.28481769E-02-1.91322648E-05 3 5.21635136E-09-4.82394566E-13-1.66282463E+04 2.22754535E+01 4 MB 11/28/99 C 5H 10O 2 0G 300.000 5000.000 1380.000 51 1.90094725E+01 2.36503722E-02-8.22978452E-06 1.29246265E-09-7.55862836E-14 2 -6.34989152E+04-7.32469099E+01 3.16208825E+00 5.52915358E-02-3.11610102E-05 3 8.42394129E-09-8.72222021E-13-5.73385240E+04 1.39723817E+01 4 MB4J*O 11/28/99 C 5H 7O 3 0G 300.000 5000.000 1373.000 51 1.94102021E+01 1.84335491E-02-6.48009491E-06 1.02463804E-09-6.02087278E-14 2 -5.40515840E+04-6.92144592E+01 6.38426236E+00 4.37450180E-02-2.41898607E-05 3 6.30686346E-09-6.26838199E-13-4.88853020E+04 2.78080598E+00 4 MBMJ*O 11/28/99 C 5H 7O 3 0G 300.000 5000.000 1386.000 51 2.00506288E+01 1.76795859E-02-6.17293681E-06 9.71744630E-10-5.69273631E-14 2 -5.29824268E+04-7.60130076E+01 3.08666210E+00 5.76146250E-02-4.27917498E-05 3 1.65945506E-08-2.66852301E-12-4.70701309E+04 1.50737674E+01 4 MB2D 11/28/99 C 5H 8O 2 0G 300.000 5000.000 1382.000 41 1.80897111E+01 1.98686931E-02-6.95006986E-06 1.09534848E-09-6.42176494E-14 2 -4.97652739E+04-6.65655065E+01 2.12280888E+00 5.41231045E-02-3.47438144E-05 3 1.13620695E-08-1.54117689E-12-4.38302847E+04 2.04119815E+01 4 MB3D 11/28/99 C 5H 8O 2 0G 300.000 5000.000 1384.000 41 1.81198114E+01 1.98228224E-02-6.92991482E-06 1.09176485E-09-6.39917285E-14 2 -4.71489742E+04-6.76519597E+01 9.53846565E-01 5.80042013E-02-3.94176609E-05 3 1.37938985E-08-2.00503547E-12-4.09300863E+04 2.53322728E+01 4 MB4*O 11/28/99 C 5H 8O 3 0G 300.000 5000.000 1375.000 51 1.97941596E+01 2.06252716E-02-7.22918339E-06 1.14082169E-09-6.69430136E-14 2 -7.30040810E+04-7.29449904E+01 5.63718132E+00 4.84424662E-02-2.71323608E-05 3 7.33939250E-09-7.87676907E-13-6.74180240E+04 5.19514478E+00 4 MBM*O 11/28/99 C 5H 8O 3 0G 300.000 5000.000 1387.000 51 2.04657217E+01 1.98095605E-02-6.89317189E-06 1.08265848E-09-6.33244680E-14 2 -7.66732544E+04-7.97684052E+01 2.28892965E+00 6.25201246E-02-4.59995280E-05 3 1.77521590E-08-2.84909209E-12-7.03256425E+04 1.78663076E+01 4 MB4O 11/28/99 C 5H 9O 3 0G 300.000 5000.000 1382.000 51 2.06375124E+01 2.23216370E-02-7.78401166E-06 1.22423957E-09-7.16704098E-14 2 -5.56901732E+04-7.75496703E+01 3.67824444E+00 5.85187362E-02-3.70507685E-05 3 1.20353269E-08-1.63522073E-12-4.93520453E+04 1.49257879E+01 4 MB3O 11/28/99 C 5H 9O 3 0G 300.000 5000.000 1385.000 51 2.12246355E+01 2.18066703E-02-7.60243241E-06 1.19545912E-09-6.99760834E-14 2 -5.79870079E+04-8.10512860E+01 3.13467578E+00 6.30456975E-02-4.42387253E-05 3 1.64295867E-08-2.57646370E-12-5.14999905E+04 1.66385677E+01 4 MB2O 11/28/99 C 5H 9O 3 0G 300.000 5000.000 1388.000 51 2.19086180E+01 2.12984216E-02-7.44484957E-06 1.17284216E-09-6.87435476E-14 2 -5.77030409E+04-8.54884588E+01 1.10723649E+00 6.98963165E-02-5.13654106E-05 3 1.95192515E-08-3.05845387E-12-5.04383329E+04 2.62970853E+01 4 MBMO 11/28/99 C 5H 9O 3 0G 300.000 5000.000 1377.000 51 2.06107774E+01 2.23923237E-02-7.81939315E-06 1.23093790E-09-7.21089360E-14 2 -6.17784710E+04-7.81319167E+01 5.10625642E+00 5.23330759E-02-2.79738832E-05 3 6.53560014E-09-4.50018254E-13-5.56673735E+04 7.53177303E+00 4 MB4OH3J 11/28/99 C 5H 9O 3 0G 300.000 5000.000 1365.000 61 2.04747726E+01 2.11407817E-02-7.19507820E-06 1.11463612E-09-6.46110406E-14 2 -5.83798358E+04-7.32783890E+01 4.80276319E+00 5.08772473E-02-2.55208868E-05 3 4.48802201E-09 1.21789913E-13-5.22588125E+04 1.33170844E+01 4 MB2OH3J 11/28/99 C 5H 9O 3 0G 300.000 5000.000 1377.000 61 2.15959828E+01 2.02105376E-02-6.87999133E-06 1.06613311E-09-6.18168118E-14 2 -6.03147751E+04-8.03103172E+01 2.17131567E+00 6.26699582E-02-4.09124821E-05 3 1.28380127E-08-1.52146068E-12-5.33376241E+04 2.49496214E+01 4 MB3OH4J 11/28/99 C 5H 9O 3 0G 300.000 5000.000 1386.000 61 2.09759334E+01 2.15152369E-02-7.48381906E-06 1.17499515E-09-6.87035811E-14 2 -5.92529511E+04-7.68048747E+01 3.98781775E+00 6.00803666E-02-4.16474031E-05 3 1.53723419E-08-2.40874305E-12-5.31331221E+04 1.50116192E+01 4 MB3OOH3J 11/28/99 C 5H 9O 4 0G 300.000 5000.000 1378.000 71 2.33404967E+01 2.17439388E-02-7.58860497E-06 1.19410676E-09-6.99296867E-14 2 -5.60521877E+04-8.53955279E+01 8.96906512E+00 4.90868502E-02-2.55220895E-05 3 5.65769198E-09-3.28688689E-13-5.03334204E+04-5.82494239E+00 4 MB3OH4OO 11/28/99 C 5H 9O 5 0G 300.000 5000.000 1386.000 71 2.42348672E+01 2.33791046E-02-8.11752196E-06 1.27291127E-09-7.43632425E-14 2 -7.83158287E+04-8.83426923E+01 6.82076367E+00 6.26862027E-02-4.28355893E-05 3 1.57186773E-08-2.46828189E-12-7.20002019E+04 5.88891952E+00 4 MB2OH3OO 11/28/99 C 5H 9O 5 0G 300.000 5000.000 1392.000 71 2.51497628E+01 2.25779991E-02-7.83678500E-06 1.22870792E-09-7.17763813E-14 2 -8.01433560E+04-9.52997103E+01 4.06288722E+00 7.41147900E-02-5.73305704E-05 3 2.33973372E-08-3.94545505E-12-7.29814806E+04 1.72542099E+01 4 MB4OOHMOO 11/28/99 C 5H 9O 6 0G 300.000 5000.000 1391.000 81 2.84270587E+01 2.20552782E-02-7.68807742E-06 1.20888169E-09-7.07619347E-14 2 -7.27968210E+04-1.07724315E+02 6.66761447E+00 7.48831434E-02-5.79318356E-05 3 2.34591240E-08-3.91522378E-12-6.53824251E+04 8.52661304E+00 4 MBMOOH4OO 11/28/99 C 5H 9O 6 0G 300.000 5000.000 1391.000 81 2.84270587E+01 2.20552782E-02-7.68807742E-06 1.20888169E-09-7.07619347E-14 2 -7.27968210E+04-1.07724315E+02 6.66761447E+00 7.48831434E-02-5.79318356E-05 3 2.34591240E-08-3.91522378E-12-6.53824251E+04 8.52661304E+00 4 MB2OO 11/28/99 C 5H 9O 4 0G 300.000 5000.000 1389.000 61 2.39858210E+01 2.15853843E-02-7.52744905E-06 1.18399497E-09-6.93214730E-14 2 -5.85136568E+04-9.39864883E+01 3.19155163E+00 7.04371930E-02-5.19794760E-05 3 1.98887214E-08-3.13840389E-12-5.12803874E+04 1.76613732E+01 4 MB3OO 11/28/99 C 5H 9O 4 0G 300.000 5000.000 1382.000 61 2.16332137E+01 2.35522969E-02-8.19715973E-06 1.28746765E-09-7.52984877E-14 2 -5.96222400E+04-8.00363845E+01 5.29418016E+00 5.78295087E-02-3.54164037E-05 3 1.11894585E-08-1.49582244E-12-5.34244911E+04 9.32139264E+00 4 MB4OO 11/28/99 C 5H 9O 4 0G 300.000 5000.000 1378.000 61 2.12057766E+01 2.39899967E-02-8.36517435E-06 1.31550730E-09-7.70057845E-14 2 -5.74358281E+04-7.63886529E+01 6.02462803E+00 5.29337859E-02-2.77099866E-05 3 6.47884478E-09-4.87532752E-13-5.13701878E+04 7.69531750E+00 4 MBMOO 11/28/99 C 5H 9O 4 0G 300.000 5000.000 1390.000 61 2.29983447E+01 2.22214703E-02-7.69966028E-06 1.20576967E-09-7.03767364E-14 2 -6.06244269E+04-8.62310682E+01 3.91998917E+00 6.82937112E-02-5.16228283E-05 3 2.08593299E-08-3.52067891E-12-5.40543953E+04 1.58576906E+01 4 MB3D 11/28/99 C 5H 8O 2 0G 300.000 5000.000 1384.000 41 1.81198114E+01 1.98228224E-02-6.92991482E-06 1.09176485E-09-6.39917285E-14 2 -4.71489742E+04-6.76519597E+01 9.53846565E-01 5.80042013E-02-3.94176609E-05 3 1.37938985E-08-2.00503547E-12-4.09300863E+04 2.53322728E+01 4 ME2*O 11/28/99 C 3H 4O 3 0G 300.000 5000.000 2036.000 31 1.32342841E+01 1.26547753E-02-4.73598618E-06 7.83181029E-10-4.75331455E-14 2 -5.95970849E+04-3.95014226E+01 2.97564841E+00 3.39801893E-02-1.96979934E-05 3 4.74764207E-09-3.15088446E-13-5.59770438E+04 1.62451782E+01 4 ME2J 11/28/99 C 3H 5O 2 0G 300.000 5000.000 1376.000 31 1.34749717E+01 1.14688572E-02-4.05151839E-06 6.42781967E-10-3.78606108E-14 2 -3.16810801E+04-4.61602203E+01 2.69086507E+00 3.38248090E-02-2.08509956E-05 3 6.00451093E-09-6.34484103E-13-2.76337923E+04 1.27963293E+01 4 ME2J*O 11/28/99 C 3H 3O 3 0G 300.000 5000.000 1666.000 31 1.31176318E+01 1.00195794E-02-3.77691326E-06 6.27548335E-10-3.82123974E-14 2 -4.07550994E+04-3.72776955E+01 3.52662076E+00 3.01375260E-02-1.79730307E-05 3 4.37410569E-09-2.78066542E-13-3.74143315E+04 1.47418718E+01 4 MM1O 11/28/99 C 2H 3O 3 0G 300.000 5000.000 1369.000 21 1.25424537E+01 7.62116954E-03-2.73211983E-06 4.37719551E-10-2.59584712E-14 2 -5.06831250E+04-4.12652926E+01 2.83912633E+00 2.82845016E-02-1.86859928E-05 3 5.65887946E-09-6.18353637E-13-4.71331387E+04 1.15273446E+01 4 MMMO 11/28/99 C 2H 3O 3 0G 300.000 5000.000 1475.000 21 1.20233916E+01 8.11262659E-03-2.91356462E-06 4.67340384E-10-2.77375525E-14 2 -4.56646728E+04-3.40234335E+01 5.19690837E+00 1.58839723E-02 3.53540547E-07 3 -6.10456923E-09 1.94661801E-12-4.25242289E+04 5.46220563E+00 4 MP2D 11/28/99 C 4H 6O 2 0G 300.000 5000.000 1382.000 31 1.53838778E+01 1.49244222E-02-5.23903493E-06 8.27660248E-10-4.86053247E-14 2 -4.42947912E+04-5.31029638E+01 2.05265608E+00 4.42654500E-02-2.98476063E-05 3 1.02829815E-08-1.46723207E-12-3.94315114E+04 1.92244429E+01 4 MP2OH3J 11/28/99 C 4H 7O 3 0G 300.000 5000.000 1388.000 51 1.83405295E+01 1.65918991E-02-5.79907810E-06 9.13494504E-10-5.35389065E-14 2 -5.47645612E+04-6.47559405E+01 1.99093068E+00 5.54839544E-02-4.18825240E-05 3 1.64839204E-08-2.68106873E-12-4.91125091E+04 2.28789334E+01 4 MP2OH3OO 11/28/99 C 4H 7O 5 0G 300.000 5000.000 1388.000 61 2.16636969E+01 1.84122553E-02-6.42028095E-06 1.00972593E-09-5.91114171E-14 2 -7.38463814E+04-7.66482717E+01 5.07748961E+00 5.71628740E-02-4.16965194E-05 3 1.59704839E-08-2.54972796E-12-6.80245370E+04 1.25337496E+01 4 MP3*O 11/26/99 C 4H 6O 3 0G 300.000 5000.000 2021.000 41 1.47014654E+01 1.91324837E-02-7.10622685E-06 1.16926651E-09-7.07190057E-14 2 -6.76572655E+04-4.57224716E+01 3.05791046E+00 4.08245981E-02-1.91405508E-05 3 2.51837622E-09 2.78176317E-13-6.32919872E+04 1.84703831E+01 4 MP3J 11/28/99 C 4H 7O 2 0G 300.000 5000.000 1376.000 41 1.54260382E+01 1.69789201E-02-5.93961909E-06 9.36106835E-10-5.48809672E-14 2 -3.43012110E+04-5.25677530E+01 4.06577480E+00 3.88324925E-02-2.08048750E-05 3 5.06251249E-09-4.21741752E-13-2.97848227E+04 1.02796868E+01 4 MP3J*O 11/26/99 C 4H 5O 3 0G 300.000 5000.000 1674.000 41 1.60502569E+01 1.52384273E-02-5.70811867E-06 9.44490933E-10-5.73459761E-14 2 -4.64698351E+04-5.22156991E+01 4.96745222E+00 3.62480066E-02-1.77176819E-05 3 2.48155628E-09 2.42724279E-13-4.23820090E+04 8.71610358E+00 4 CJHCHCHCO 11/28/99 C 4H 3O 1 0G 300.000 5000.000 1402.000 11 1.34486832E+01 6.80709677E-03-2.34271024E-06 3.65242712E-10-2.12532152E-14 2 2.53504715E+04-4.38578127E+01 6.64782318E-01 4.72293419E-02-5.15535776E-05 3 2.71181935E-08-5.42654263E-12 2.87663279E+04 2.11083886E+01 4 CHOOCO 11/28/99 C 2H 1O 3 0G 300.000 5000.000 1400.000 21 1.13111696E+01 3.41167336E-03-1.24322295E-06 2.01350134E-10-1.20310784E-14 2 -3.66759553E+04-3.07533656E+01 2.78875605E+00 2.44800708E-02-2.08392263E-05 3 8.32687865E-09-1.27754638E-12-3.39103033E+04 1.44765150E+01 4 C5H7O2 11/28/99 C 5H 7O 2 0G 300.000 5000.000 1379.000 41 1.82623737E+01 1.73785356E-02-6.13910755E-06 9.73984196E-10-5.73692006E-14 2 -3.02996668E+04-6.98442618E+01 9.98440168E-01 5.44041933E-02-3.55466741E-05 3 1.12528385E-08-1.39202431E-12-2.39532533E+04 2.40832606E+01 4 CH2CHCHCO 11/28/99 C 4H 4O 1 0G 300.000 5000.000 1401.000 11 1.32918890E+01 9.42783712E-03-3.23329764E-06 5.02853718E-10-2.92089737E-14 2 -4.65486164E+03-4.48053204E+01-1.74329010E-01 4.99882693E-02-5.08353583E-05 3 2.57383902E-08-5.04416081E-12-8.53247629E+02 2.43466973E+01 4 CH2COOH 11/ 8/ 6 C 2H 3O 2 0G 300.000 5000.000 1390.000 21 8.86469894E+00 7.91565144E-03-2.73714924E-06 4.26587776E-10-2.47690229E-14 2 -3.02226060E+04-1.82550646E+01 1.69124618E+00 2.53013086E-02-1.91526770E-05 3 7.60687742E-09-1.24622437E-12-2.77850622E+04 2.00638791E+01 4 C2H3CO2 11/22/ 6 C 3H 3O 2 0G 300.000 5000.000 1397.000 11 1.10391147E+01 8.91049963E-03-3.08146337E-06 4.81978458E-10-2.81094197E-14 2 -1.57622858E+04-3.06214039E+01 4.35773054E-01 3.77979036E-02-3.41142335E-05 3 1.58434041E-08-2.93447894E-12-1.24695031E+04 2.49020597E+01 4 CH3COCH3 5/ 4/92 THERMC 3H 6O 1 0G 300.000 5000.000 1374.000 21 9.91421984E+00 1.46030709E-02-5.06085765E-06 7.92682855E-10-4.62739645E-14 2 -3.11167423E+04-2.86113215E+01 1.30767163E+00 2.92021742E-02-1.19045617E-05 3 6.52150087E-10 4.67751203E-13-2.75328269E+04 1.96395025E+01 4 C4H72-1 4/ 7/97 THERMC 4H 7 0 0G 300.000 5000.000 1392.000 11 1.12103578E+01 1.60483196E-02-5.46502292E-06 8.45941053E-10-4.89772739E-14 2 1.09041937E+04-3.62538159E+01-3.50508352E-01 4.26511243E-02-2.90979373E-05 3 1.05403914E-08-1.60059854E-12 1.49933591E+04 2.60350552E+01 4 CH3CHOCHO 11/14/95 THERMC 3H 5O 2 0G 300.000 5000.000 1395.000 21 1.27827539E+01 1.21529347E-02-4.21228103E-06 6.59844007E-10-3.85228684E-14 2 -2.15946846E+04-3.94512036E+01 5.06096897E-01 4.26121702E-02-3.37628379E-05 3 1.39422914E-08-2.35317319E-12-1.74952136E+04 2.58742916E+01 4 C3H6OOH-3,1 7/19/ 0 C 3H 7O 2 0G 300.000 5000.000 1384.000 41 1.46881564E+01 1.49941200E-02-5.24056505E-06 8.25462711E-10-4.83758952E-14 2 -4.77342863E+03-4.77984492E+01 1.88331465E+00 4.40156051E-02-3.07858462E-05 3 1.13214862E-08-1.75323184E-12-1.68779168E+02 2.14040621E+01 4 C3H6OOH-2,1 7/19/ 0 C 3H 7O 2 0G 300.000 5000.000 1402.000 41 1.24605763E+01 1.58889526E-02-5.32742106E-06 8.15818791E-10-4.68723250E-14 2 -4.20305196E+03-3.23858947E+01 2.87774562E+00 3.74166999E-02-2.36058063E-05 3 7.79930860E-09-1.06042562E-12-7.82368119E+02 1.93941340E+01 4 C3H6OOH-1,2 7/19/ 0 C 3H 7O 2 0G 300.000 5000.000 1407.000 41 1.42163221E+01 1.43382450E-02-4.78004477E-06 7.29133134E-10-4.17761973E-14 2 -5.67381620E+03-4.35770997E+01 2.09193950E+00 4.69220394E-02-3.90280831E-05 3 1.72381453E-08-3.07968979E-12-1.89377918E+03 2.00178282E+01 4 MB4J DOOLEY ET AL C 5H 9O 2 0G 300.000 5000.000 1379.000 51 1.86469757E+01 2.14568602E-02-7.48357349E-06 1.17708065E-09-6.89125730E-14 2 -3.84763059E+04-6.83763828E+01 3.80046694E+00 5.12461895E-02-2.92784207E-05 3 8.08008533E-09-8.67877952E-13-3.27198149E+04 1.32824736E+01 4 MB3J DOOLEY ET AL C 5H 9O 2 0G 300.000 5000.000 1360.000 51 1.87286876E+01 2.06468062E-02-7.05571540E-06 1.09601350E-09-6.36503391E-14 2 -3.98969910E+04-6.83331046E+01 4.23259914E+00 4.61048242E-02-1.97581616E-05 3 1.29579481E-09 7.73894868E-13-3.40252853E+04 1.25001418E+01 4 MB2J DOOLEY ET AL C 5H 9O 2 0G 300.000 5000.000 1378.000 51 2.01491211E+01 2.04083481E-02-7.17464545E-06 1.13454897E-09-6.66724568E-14 2 -4.28621602E+04-7.89181749E+01 2.83707661E+00 5.72149406E-02-3.66205872E-05 3 1.18010771E-08-1.56537395E-12-3.63944327E+04 1.55051596E+01 4 MBMJ DOOLEY ET AL C 5H 9O 2 0G 300.000 5000.000 1390.000 51 1.87822563E+01 2.09831341E-02-7.23950265E-06 1.13048403E-09-6.58524760E-14 2 -3.87611422E+04-6.92943273E+01 2.73723554E+00 5.65367209E-02-3.71218633E-05 3 1.25308215E-08-1.74166718E-12-3.29545003E+04 1.76311079E+01 4 MP2D3J 26_NOV.DAT C 4H 5O 2 0G 300.000 5000.000 1392.000 31 1.43220183E+01 1.36783854E-02-4.74486362E-06 7.29334182E-10-4.14511703E-14 2 -2.02082226E+04-4.75994987E+01 3.06570984E+00 3.96162757E-02-2.79425307E-05 3 1.03652294E-08-1.61024935E-12-1.62172152E+04 1.30574799E+01 4 MP2D2J 12/ 9/ 6 C 4H 5O 2 0G 300.000 5000.000 1387.000 31 1.53321008E+01 1.33723125E-02-4.81964489E-06 7.64848539E-10-4.46143582E-14 2 -2.31016473E+04-5.50822485E+01 1.93515521E+00 4.54099414E-02-3.45825082E-05 3 1.35630436E-08-2.18777192E-12-1.85057687E+04 1.66354308E+01 4 MP2DMJ 12/ 9/ 6 C 4H 5O 2 0G 300.000 5000.000 1391.000 31 1.68847567E+01 1.11178481E-02-3.92616850E-06 6.21898660E-10-3.64954634E-14 2 -2.01393309E+04-6.22634480E+01 3.33358736E+00 4.52872230E-02-3.75332781E-05 3 1.58798086E-08-2.71244352E-12-1.56896797E+04 9.61623922E+00 4 ME 12/ 9/ 6 C 3H 6O 2 0G 300.000 5000.000 1388.000 31 1.06495263E+01 1.75944655E-02-6.24213581E-06 9.77186686E-10-5.64391305E-14 2 -5.42575676E+04-3.07561590E+01 2.52235820E+00 3.41931289E-02-1.89047438E-05 3 5.32401883E-09-6.33100827E-13-5.11185412E+04 1.38680663E+01 4 MEMJ 12/ 9/ 6 C 3H 5O 2 0G 300.000 5000.000 1392.000 31 1.38587401E+01 1.13235183E-02-3.91663105E-06 6.00684427E-10-3.40584427E-14 2 -3.08875399E+04-4.66699226E+01 3.87187920E+00 3.46323614E-02-2.50705349E-05 3 9.51853192E-09-1.50518911E-12-2.73821006E+04 7.03163958E+00 4 BA4J 12/ 9/ 6 C 4H 7O 2 0G 300.000 5000.000 1390.000 41 1.53128920E+01 1.64832757E-02-5.59903777E-06 8.65487464E-10-5.00455361E-14 2 -3.95158614E+04-5.07782036E+01 1.80576858E+00 4.90137730E-02-3.61169100E-05 3 1.41367909E-08-2.29713521E-12-3.49007549E+04 2.14545929E+01 4 BAOJ 10/30/ 6 C 4H 7O 2 0G 300.000 5000.000 1390.000 41 1.48935116E+01 1.71270286E-02-5.84341434E-06 9.02570250E-10-5.20973801E-14 2 -3.49625905E+04-4.95301961E+01 1.40541432E+00 4.93070945E-02-3.57244840E-05 3 1.37694761E-08-2.21243174E-12-3.03180933E+04 2.27178782E+01 4 END