1THERMO 2 300.000 1000.000 5000.000 3H 120186H 1 G 0300.00 5000.00 1000.00 1 4 0.02500000E+02 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 2 5 0.02547163E+06-0.04601176E+01 0.02500000E+02 0.00000000E+00 0.00000000E+00 3 6 0.00000000E+00 0.00000000E+00 0.02547163E+06-0.04601176E+01 4 7H2 121286H 2 G 0300.00 5000.00 1000.00 1 8 0.02991423E+02 0.07000644E-02-0.05633829E-06-0.09231578E-10 0.01582752E-13 2 9-0.08350340E+04-0.01355110E+02 0.03298124E+02 0.08249442E-02-0.08143015E-05 3 10-0.09475434E-09 0.04134872E-11-0.01012521E+05-0.03294094E+02 4 11O 120186O 1 G 0300.00 5000.00 1000.00 1 12 0.02542060E+02-0.02755062E-03-0.03102803E-07 0.04551067E-10-0.04368052E-14 2 13 0.02923080E+06 0.04920308E+02 0.02946429E+02-0.01638166E-01 0.02421032E-04 3 14-0.01602843E-07 0.03890696E-11 0.02914764E+06 0.02963995E+02 4 15O2 121386O 2 G 0300.00 5000.00 1000.00 1 16 0.03697578E+02 0.06135197E-02-0.01258842E-05 0.01775281E-09-0.01136435E-13 2 17-0.01233930E+05 0.03189166E+02 0.03212936E+02 0.01127486E-01-0.05756150E-05 3 18 0.01313877E-07-0.08768554E-11-0.01005249E+05 0.06034738E+02 4 19OH 7/13/ 0 RUCICH 1O 1 0 0G 300.000 5000.000 1710.000 01 20 2.85376040E+00 1.02994334E-03-2.32666477E-07 1.93750704E-11-3.15759847E-16 2 21 3.69949720E+03 5.78756825E+00 3.41896226E+00 3.19255801E-04-3.08292717E-07 3 22 3.64407494E-10-1.00195479E-13 3.45264448E+03 2.54433372E+00 4 23H2O 20387H 2O 1 G 0300.00 5000.00 1000.00 1 24 0.02672146E+02 0.03056293E-01-0.08730260E-05 0.01200996E-08-0.06391618E-13 2 25-0.02989921E+06 0.06862817E+02 0.03386842E+02 0.03474982E-01-0.06354696E-04 3 26 0.06968581E-07-0.02506588E-10-0.03020811E+06 0.02590233E+02 4 27N2 121286N 2 G 0300.00 5000.00 1000.00 1 28 0.02926640E+02 0.01487977E-01-0.05684761E-05 0.01009704E-08-0.06753351E-13 2 29-0.09227977E+04 0.05980528E+02 0.03298677E+02 0.01408240E-01-0.03963222E-04 3 30 0.05641515E-07-0.02444855E-10-0.01020900E+05 0.03950372E+02 4 31HO2 L 5/89H 1O 2 G 200.0 3500.0 1000.0 1 32 4.01721090E+00 2.23982013E-03-6.33658150E-07 1.14246370E-10-1.07908535E-14 2 33 1.11856713E+02 3.78510215E+00 4.30179801E+00-4.74912051E-03 2.11582891E-05 3 34-2.42763894E-08 9.29225124E-12 2.94808040E+02 3.71666245E+00 4 35H2O2 120186H 2O 2 G 0300.00 5000.00 1000.00 1 36 0.04573167E+02 0.04336136E-01-0.01474689E-04 0.02348904E-08-0.01431654E-12 2 37-0.01800696E+06 0.05011370E+01 0.03388754E+02 0.06569226E-01-0.01485013E-05 3 38-0.04625806E-07 0.02471515E-10-0.01766315E+06 0.06785363E+02 4 39AR 120186AR 1 G 0300.00 5000.00 1000.00 1 40 0.02500000E+02 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 2 41-0.07453750E+04 0.04366001E+02 0.02500000E+02 0.00000000E+00 0.00000000E+00 3 42 0.00000000E+00 0.00000000E+00-0.07453750E+04 0.04366001E+02 4 43CH2O 6/29/04 RUSCIC 1H 2O 1 0G 300.000 5000.000 1486.000 01 44 4.02068394E+00 5.09903417E-03-1.76430480E-06 2.76025879E-10-1.60998042E-14 2 45-1.49287258E+04 1.06525547E+00 3.00754197E+00 3.04729496E-03 5.25109246E-06 3 46-5.12019281E-09 1.27133795E-12-1.41188397E+04 8.10120233E+00 4 47CO 29/11/04 C 1O 1 0 0G 300.000 5000.000 1429.000 1 48 3.11216890E+00 1.15948283E-03-3.38480362E-07 4.41403098E-11-2.12862228E-15 2 49-1.42718539E+04 5.71725177E+00 3.19036352E+00 8.94419972E-04-3.24927563E-08 3 50-1.04599967E-10 2.41965693E-14-1.42869054E+04 5.33277914E+00 4 51CO2 29/11/04 C 1O 2 0 0G 300.000 5000.000 1380.000 1 52 5.18953018E+00 2.06006476E-03-7.33575324E-07 1.17004374E-10-6.91729215E-15 2 53-4.93178953E+04-5.18289303E+00 2.57930490E+00 8.24684987E-03-6.42716047E-06 3 54 2.54637024E-09-4.12030443E-13-4.84162830E+04 8.81141041E+00 4 55HCO 29/11/04 H 1C 1O 1 0G 300.000 5000.000 1690.000 1 56 3.44148164E+00 3.52157719E-03-1.24136118E-06 1.97328644E-10-1.16538616E-14 2 57 3.97409684E+03 6.24593456E+00 3.81049965E+00 8.13269825E-04 3.13164701E-06 3 58-2.39478268E-09 5.06894554E-13 4.03859901E+03 4.94843165E+00 4 59HO2CHO 6/26/95 THERMC 1H 2O 3 0G 300.000 5000.000 1378.00 21 60 9.87503878E+00 4.64663708E-03-1.67230522E-06 2.68624413E-10-1.59595232E-14 2 61-3.80502496E+04-2.24939155E+01 2.42464726E+00 2.19706380E-02-1.68705546E-05 3 62 6.25612194E-09-9.11645843E-13-3.54828006E+04 1.75027796E+01 4 63O2CHO 6/26/95 THERMC 1H 1O 3 0G 300.000 5000.000 1368.00 11 64 7.24075139E+00 4.63312951E-03-1.63693995E-06 2.59706693E-10-1.52964699E-14 2 65-1.87027618E+04-6.49547212E+00 3.96059309E+00 1.06002279E-02-5.25713351E-06 3 66 1.01716726E-09-2.87487602E-14-1.73599383E+04 1.17807483E+01 4 67HOCHO 9/27/ 5 THERMC 1H 2O 2 0G 300.000 5000.000 1419.000 11 68 7.67134440E+00 4.43426373E-03-1.60867436E-06 2.59770020E-10-1.54899704E-14 2 69-4.89708660E+04-1.73024418E+01 1.28069021E+00 1.52887758E-02-5.64150476E-06 3 70-1.22968799E-09 8.14273233E-13-4.64347524E+04 1.83142081E+01 4 71HOCO 9/27/ 5 THERMC 1H 1O 2 0G 300.000 5000.000 1549.000 11 72 6.94282268E+00 2.37391844E-03-8.67074662E-07 1.40644617E-10-8.41268695E-15 2 73-2.50292163E+04-1.14792361E+01 8.98154532E-01 1.67269019E-02-1.33663562E-05 3 74 4.83071199E-09-6.38718748E-13-2.30262021E+04 2.07803865E+01 4 75OCHO 9/27/ 5 THERMC 1H 1O 2 0G 300.000 5000.000 1412.000 01 76 6.49815560E+00 3.22319012E-03-1.17099595E-06 1.89272918E-10-1.12937000E-14 2 77-1.81679042E+04-1.00412613E+01 1.42991854E+00 1.22803284E-02-5.28461096E-06 3 78-3.73026551E-10 5.07953571E-13-1.62042814E+04 1.80411779E+01 4 79HOCH2O2H 4/ 9/98 THERMC 1H 4O 3 0G 300.000 5000.000 1422.000 31 80 1.16303827E+01 7.15133688E-03-2.39035030E-06 3.65772791E-10-2.10199524E-14 2 81-4.31079242E+04-3.24276725E+01 1.85716693E+00 3.23153132E-02-2.69928902E-05 3 82 1.11694484E-08-1.81284103E-12-4.00314471E+04 1.90917729E+01 4 83HOCH2O2 4/ 9/98 THERMC 1H 3O 3 0G 300.000 5000.000 1412.000 21 84 9.04545938E+00 7.15223373E-03-2.37005676E-06 3.60083481E-10-2.05750228E-14 2 85-2.49414886E+04-1.74210530E+01 2.85441621E+00 2.33663535E-02-1.88115990E-05 3 86 7.96709515E-09-1.36346618E-12-2.29866196E+04 1.51730565E+01 4 87OCH2O2H 4/ 9/98 THERMC 1H 3O 3 0G 300.000 5000.000 1420.000 21 88 1.15398246E+01 5.34291432E-03-1.81878917E-06 2.81968625E-10-1.63584348E-14 2 89-1.68237489E+04-3.20700633E+01 1.93823075E+00 3.01465730E-02-2.61053152E-05 3 90 1.09463562E-08-1.78312692E-12-1.38166625E+04 1.85042002E+01 4 91HOCH2O 2/16/99 THERMC 1H 3O 2 0G 300.000 5000.000 1452.000 11 92 6.39521515E+00 7.43673043E-03-2.50422354E-06 3.84879712E-10-2.21778689E-14 2 93-2.41108840E+04-6.63865583E+00 4.11183145E+00 7.53850697E-03 3.77337370E-06 3 94-5.38746005E-09 1.45615887E-12-2.28023001E+04 7.46807254E+00 4 95CH3OH 2/25/ 4 THERMC 1H 4O 1 0G 300.000 5000.000 1985.000 11 96 3.92867513E+00 9.81626074E-03-3.40615476E-06 5.35510197E-10-3.13776029E-14 2 97-2.61454175E+04 2.69464483E+00 1.82176844E+00 1.23326420E-02-2.73742177E-06 3 98-1.07387318E-09 4.23644837E-13-2.52222207E+04 1.48104300E+01 4 99CH2OH 2/25/ 4 THERMC 1H 3O 1 0G 300.000 5000.000 1399.000 11 100 5.41875913E+00 5.66185244E-03-1.87471136E-06 2.84441938E-10-1.62299798E-14 2 101-3.61475540E+03-3.49277963E+00 3.05674228E+00 1.19335634E-02-8.72501303E-06 3 102 3.82781054E-09-7.22887951E-13-2.83140190E+03 8.98878133E+00 4 103CH3O 8/ 9/ 4 THERMC 1H 3O 1 0G 300.000 5000.000 1509.000 01 104 4.64787019E+00 6.90830683E-03-2.34404776E-06 3.61994570E-10-2.09253541E-14 2 105-2.99208881E+02-1.57740193E+00 2.23058023E+00 8.53178586E-03 1.02166624E-06 3 106-3.41046916E-09 9.94691038E-13 9.45939708E+02 1.28377569E+01 4 107CH3O2H 1/14/ 5 THERMC 1H 4O 2 0G 300.000 5000.000 1367.000 21 108 8.80409289E+00 8.09427218E-03-2.85843274E-06 4.53369754E-10-2.66980707E-14 2 109-1.98512174E+04-2.17000591E+01 2.83880024E+00 1.86096249E-02-8.48165412E-06 3 110 1.00387451E-09 1.71612429E-13-1.74033753E+04 1.16092433E+01 4 111CH3O2 1/14/ 5 THERMC 1H 3O 2 0G 300.000 5000.000 1365.000 11 112 6.34718801E+00 7.92089358E-03-2.76601913E-06 4.35360631E-10-2.54984762E-14 2 113-1.83436055E+03-7.42552545E+00 3.80497590E+00 9.80784660E-03-3.90940624E-07 3 114-2.23072602E-09 6.43310820E-13-4.55625796E+02 7.81789100E+00 4 115CH2O2H 1/14/ 5 THERMC 1H 3O 2 0G 300.000 5000.000 1357.000 21 116 9.10784249E+00 5.27260434E-03-1.88170543E-06 3.00561364E-10-1.77865959E-14 2 117 3.77440183E+03-2.11741044E+01 4.47228333E+00 1.33401095E-02-5.92919725E-06 3 118 4.44481025E-10 2.12699899E-13 5.67413711E+03 4.72608208E+00 4 119CH4 29/11/04 H 4C 1 0 0G 300.000 5000.000 1462.000 1 120 4.09617653E+00 7.44330845E-03-2.63871900E-06 4.19577604E-10-2.47508050E-14 2 121-1.13835704E+04-4.67561383E+00 3.72113020E+00-2.50293289E-03 1.90246534E-05 3 122-1.46871253E-08 3.43791152E-12-1.01424099E+04 1.22776596E+00 4 123CH3 C 1H 3 0 0G 300.000 5000.000 1389.000 01 124 3.51281376E+00 5.11412613E-03-1.67632050E-06 2.52495174E-10-1.43302923E-14 2 125 1.61238027E+04 1.62436112E+00 3.43858162E+00 4.07752664E-03 3.19830994E-07 3 126-9.47669390E-10 2.21828166E-13 1.63164018E+04 2.52807406E+00 4 127CH2 120186C 1H 2 G 0250.00 4000.00 1000.00 1 128 0.03636408E+02 0.01933057E-01-0.01687016E-05-0.01009899E-08 0.01808256E-12 2 129 0.04534134E+06 0.02156561E+02 0.03762237E+02 0.01159819E-01 0.02489585E-05 3 130 0.08800836E-08-0.07332435E-11 0.04536791E+06 0.01712578E+02 4 131CH2(S) 31287C 1H 2 G 0300.00 4000.00 1000.00 1 132 0.03552889E+02 0.02066788E-01-0.01914116E-05-0.01104673E-08 0.02021350E-12 2 133 0.04984975E+06 0.01686570E+02 0.03971265E+02-0.01699089E-02 0.01025369E-04 3 134 0.02492551E-07-0.01981266E-10 0.04989368E+06 0.05753207E+00 4 135CH 121286C 1H 1 G 0300.00 5000.00 1000.00 1 136 0.02196223E+02 0.02340381E-01-0.07058201E-05 0.09007582E-09-0.03855040E-13 2 137 0.07086723E+06 0.09178373E+02 0.03200202E+02 0.02072876E-01-0.05134431E-04 3 138 0.05733890E-07-0.01955533E-10 0.07045259E+06 0.03331588E+02 4 139C C 1 G 0300.00 5000.00 1000.00 1 140 0.02602087E+02-0.01787081E-02 0.09087041E-06-0.01149933E-09 0.03310844E-14 2 141 0.08542154E+06 0.04195177E+02 0.02498585E+02 0.08085777E-03-0.02697697E-05 3 142 0.03040729E-08-0.01106652E-11 0.08545878E+06 0.04753459E+02 4 143C2H6 8/ 4/ 4 THERMC 2H 6 0 0G 300.000 5000.000 1383.000 11 144 6.05972630E+00 1.30382837E-02-4.48103942E-06 6.97762095E-10-4.05606353E-14 2 145-1.35751226E+04-1.28608001E+01 4.78623203E-02 2.40569127E-02-1.15155912E-05 3 146 2.48666238E-09-1.78343944E-13-1.10923014E+04 2.06544071E+01 4 147C2H5 8/ 4/ 4 THERMC 2H 5 0 0G 300.000 5000.000 1387.000 11 148 5.88784390E+00 1.03076793E-02-3.46844396E-06 5.32499257E-10-3.06512651E-14 2 149 1.15065499E+04-8.49651771E+00 1.32730217E+00 1.76656753E-02-6.14926558E-06 3 150-3.01143466E-10 4.38617775E-13 1.34284028E+04 1.71789216E+01 4 151C2H4 10/ 4/ 5 THERMC 2H 4 0 0G 300.000 5000.000 1395.000 01 152 5.22176372E+00 8.96137303E-03-3.04868886E-06 4.71465524E-10-2.72739592E-14 2 153 3.60389679E+03-7.47789234E+00 2.33879687E-01 1.96334647E-02-1.16833214E-05 3 154 3.64246453E-09-4.77442715E-13 5.46489338E+03 1.97084228E+01 4 155C2H3 10/ 4/ 5 THERMC 2H 3 0 0G 300.000 5000.000 1395.000 01 156 5.07331248E+00 6.58316278E-03-2.23762924E-06 3.45803379E-10-1.99940490E-14 2 157 3.37234748E+04-3.39792712E+00 1.25329724E+00 1.56258370E-02-1.07803879E-05 3 158 4.18054634E-09-7.01360362E-13 3.50734773E+04 1.71341661E+01 4 159C2H2 10/ 4/ 5 THERMC 2H 2 0 0G 300.000 5000.000 1407.000 01 160 4.98265164E+00 4.25992930E-03-1.37483523E-06 2.04717964E-10-1.15191740E-14 2 161 2.52697118E+04-5.81321385E+00 2.06742667E+00 1.46568506E-02-1.52947063E-05 3 162 8.30965761E-09-1.72932175E-12 2.59578589E+04 8.62758672E+00 4 163C2H 10/ 4/ 5 THERMC 2H 1 0 0G 300.000 5000.000 1361.000 01 164 4.66893822E+00 2.01284720E-03-7.01828634E-07 1.10347228E-10-6.45790465E-15 2 165 6.60310696E+04-2.25424693E+00 4.27708350E+00 1.74130076E-03 7.31180206E-07 3 166-9.71827901E-10 2.36956727E-13 6.63125955E+04 3.16341916E-01 4 167CH3CHO 8/10/ 4 THERMC 2H 4O 1 0G 300.000 5000.000 1377.000 11 168 6.98518866E+00 9.67897787E-03-3.31841954E-06 5.16025901E-10-2.99725903E-14 2 169-2.39807279E+04-1.27484852E+01 1.77060035E+00 1.84475161E-02-7.24138162E-06 3 170 2.34364561E-10 3.35543891E-13-2.18078850E+04 1.65023437E+01 4 171CH3CO 8/10/ 4 THERMC 2H 3O 1 0G 300.000 5000.000 1371.000 11 172 6.56682466E+00 7.55308669E-03-2.59966784E-06 4.05334994E-10-2.35876164E-14 2 173-4.76690401E+03-8.83301965E+00 2.52884150E+00 1.37152173E-02-4.28607476E-06 3 174-7.71684278E-10 4.83836380E-13-3.02546532E+03 1.40340315E+01 4 175CH2CHO 8/10/ 4 THERMC 2H 3O 1 0G 300.000 5000.000 1388.000 11 176 7.54145790E+00 6.82297125E-03-2.36938607E-06 3.71633517E-10-2.17160048E-14 2 177-2.61437239E+03-1.62602766E+01 1.47616956E+00 2.08974186E-02-1.50123552E-05 3 178 5.62967382E-09-8.76624470E-13-4.82050510E+02 1.63756465E+01 4 179CH2CO 121686C 2H 2O 1 G 0300.00 5000.00 1000.00 1 180 0.06038817E+02 0.05804840E-01-0.01920954E-04 0.02794485E-08-0.01458868E-12 2 181-0.08583402E+05-0.07657581E+02 0.02974971E+02 0.01211871E+00-0.02345046E-04 3 182-0.06466685E-07 0.03905649E-10-0.07632637E+05 0.08673553E+02 4 183HCCO 32387H 1C 2O 1 G 0300.00 4000.00 1000.00 1 184 0.06758073E+02 0.02000400E-01-0.02027607E-05-0.01041132E-08 0.01965165E-12 2 185 0.01901513E+06-0.09071262E+02 0.05047965E+02 0.04453478E-01 0.02268283E-05 3 186-0.01482095E-07 0.02250742E-11 0.01965892E+06 0.04818439E+01 4 187HCCOH 32387H 2C 2O 1 G 0300.00 4000.00 1000.00 1 188 0.07328324E+02 0.03336416E-01-0.03024705E-05-0.01781106E-08 0.03245168E-12 2 189 0.07598258E+05-0.01401214E+03 0.03899465E+02 0.09701075E-01-0.03119309E-05 3 190-0.05537732E-07 0.02465732E-10 0.08701190E+05 0.04491875E+02 4 191CH3CO3H 6/26/95 THERMC 2H 4O 3 0G 300.000 5000.000 1391.000 31 192 1.25060485E+01 9.47789695E-03-3.30402246E-06 5.19630793E-10-3.04233568E-14 2 193-4.59856703E+04-3.79195947E+01 2.24135876E+00 3.37963514E-02-2.53887482E-05 3 194 9.67583587E-09-1.49266157E-12-4.24677831E+04 1.70668133E+01 4 195CH3CO3 4/ 3/ 0 THERMC 2H 3O 3 0G 300.000 5000.000 1391.000 21 196 1.12522498E+01 8.33652672E-03-2.89014530E-06 4.52781734E-10-2.64354456E-14 2 197-2.60238584E+04-2.96370457E+01 3.60373432E+00 2.70080341E-02-2.08293438E-05 3 198 8.50541104E-09-1.43846110E-12-2.34205171E+04 1.12014914E+01 4 199CH3CO2 2/14/95 THERMC 2H 3O 2 0G 300.000 5000.000 1395.000 11 200 8.54059736E+00 8.32951214E-03-2.84722010E-06 4.41927196E-10-2.56373394E-14 2 201-2.97290678E+04-2.03883545E+01 1.37440768E+00 2.49115604E-02-1.74308894E-05 3 202 6.24799508E-09-9.09516835E-13-2.72330150E+04 1.81405454E+01 4 203C2H5OH 8/ 9/ 4 THERMC 2H 6O 1 0G 300.000 5000.000 1395.000 21 204 8.31742137E+00 1.29603294E-02-4.39286497E-06 6.77734995E-10-3.91448231E-14 2 205-3.25219715E+04-1.96502783E+01 1.79106094E-01 3.09060081E-02-1.93596697E-05 3 206 6.31830859E-09-8.53166875E-13-2.95670605E+04 2.44715919E+01 4 207PC2H4OH 8/ 9/ 4 THERMC 2H 5O 1 0G 300.000 5000.000 1396.000 21 208 7.88509591E+00 1.08287795E-02-3.66829683E-06 5.65734300E-10-3.26673351E-14 2 209-7.44974622E+03-1.44673770E+01 9.90023426E-01 2.61564272E-02-1.65928300E-05 3 210 5.50525131E-09-7.57520667E-13-4.96032283E+03 2.28675716E+01 4 211SC2H4OH 8/ 9/ 4 THERMC 2H 5O 1 0G 300.000 5000.000 1397.000 21 212 8.34980768E+00 1.03718068E-02-3.49683481E-06 5.37524748E-10-3.09661005E-14 2 213-1.10556188E+04-1.81354112E+01 1.61103852E+00 2.63511867E-02-1.82941500E-05 3 214 6.91243160E-09-1.10384057E-12-8.71494725E+03 1.80114775E+01 4 215C2H5O 8/ 9/ 4 THERMC 2H 5O 1 0G 300.000 5000.000 1393.000 11 216 8.23717244E+00 1.10885879E-02-3.78808372E-06 5.87613473E-10-3.40712889E-14 2 217-6.22948597E+03-1.93190543E+01 2.87429022E-01 2.86500918E-02-1.83857008E-05 3 218 6.03096179E-09-8.04562643E-13-3.35717377E+03 2.37513898E+01 4 219O2C2H4OH 2/14/95 THERMC 2H 5O 3 0G 300.000 5000.000 1392.000 31 220 1.07432659E+01 1.30957787E-02-4.45370088E-06 6.88548738E-10-3.98230113E-14 2 221-2.55911274E+04-2.33254953E+01 4.11839445E+00 2.72240632E-02-1.60824430E-05 3 222 5.17033408E-09-7.31610168E-13-2.30857785E+04 1.28482112E+01 4 223C2H5O2H 1/14/ 5 THERMC 2H 6O 2 0G 300.000 5000.000 1391.000 31 224 1.12305737E+01 1.20482120E-02-3.96730201E-06 6.00754632E-10-3.42657803E-14 2 225-2.47977531E+04-3.25607232E+01 1.57329011E+00 3.52379996E-02-2.53203993E-05 3 226 9.56802476E-09-1.48167375E-12-2.15278368E+04 1.90472032E+01 4 227C2H5O2 1/14/ 5 THERMC 2H 5O 2 0G 300.000 5000.000 1387.000 21 228 8.77641329E+00 1.18767163E-02-3.87683050E-06 5.83210754E-10-3.31006724E-14 2 229-6.78748703E+03-1.83119972E+01 2.58630333E+00 2.61836362E-02-1.68306193E-05 3 230 6.08749295E-09-9.57302040E-13-4.58588992E+03 1.50486289E+01 4 231C2H4O2H 1/14/ 5 THERMC 2H 5O 2 0G 300.000 5000.000 1397.000 31 232 1.05228954E+01 9.48091381E-03-3.55727763E-06 6.41445994E-10-4.21232247E-14 2 233 1.55718322E+03-2.31413632E+01 3.46916874E+00 2.71188626E-02-2.08022550E-05 3 234 8.44284845E-09-1.40756215E-12 3.89688270E+03 1.43400726E+01 4 235CH3CHO2H 1/14/ 5 THERMC 2H 5O 2 0G 300.000 5000.000 1385.000 31 236 1.06284708E+01 1.01662327E-02-3.34915963E-06 5.07257146E-10-2.89352540E-14 2 237-2.15391230E+03-2.60363030E+01 3.91433011E+00 2.52722102E-02-1.62112291E-05 3 238 5.45591592E-09-7.57965290E-13 2.38044573E+02 1.02327238E+01 4 239C2H4O1-2 9/ 1/ 0 THERMC 2H 4O 1 0G 300.000 5000.000 1399.000 01 240 6.99485763E+00 1.00772459E-02-3.45220932E-06 5.36571216E-10-3.11563543E-14 2 241-1.04091344E+04-1.59857976E+01-1.44361790E+00 2.91837107E-02-1.96805054E-05 3 242 6.67472575E-09-9.02139342E-13-7.43433507E+03 2.95212453E+01 4 243C2H3O1-2 4/ 3/ 0 THERMC 2H 3O 1 0G 300.000 5000.000 1492.000 01 244 6.88486471E+00 6.94720501E-03-2.23214698E-06 3.32190767E-10-1.87124555E-14 2 245 1.26442200E+04-1.23842570E+01-1.62965122E+00 2.93455486E-02-2.43737550E-05 3 246 1.00522325E-08-1.61259036E-12 1.52459425E+04 3.22782741E+01 4 247CH3COCH3 8/30/ 4 THERMC 3H 6O 1 0G 300.000 5000.000 1382.000 21 248 9.62674379E+00 1.45519245E-02-4.97749457E-06 7.72794591E-10-4.48367165E-14 2 249-3.11862263E+04-2.61613449E+01 1.24527408E+00 2.99760255E-02-1.40026661E-05 3 250 2.16453512E-09 1.27637295E-13-2.78348727E+04 2.03682615E+01 4 251CH3COCH2 8/30/ 4 THERMC 3H 5O 1 0G 300.000 5000.000 1388.000 21 252 1.08892477E+01 1.11540675E-02-3.85516785E-06 6.02834048E-10-3.51533449E-14 2 253-1.00741464E+04-3.18043322E+01 1.22337251E+00 3.24546742E-02-2.13542518E-05 3 254 6.96777735E-09-8.99160299E-13-6.59419324E+03 2.05537233E+01 4 255CH3COCH2O2 2/14/95 C 3H 5O 3 0G 300.000 5000.000 1379.00 31 256 1.27690342E+01 1.42554828E-02-4.92821461E-06 7.70448921E-10-4.49110534E-14 2 257-2.34798669E+04-3.27155799E+01 5.95535468E+00 2.70255205E-02-1.37385031E-05 3 258 3.53735851E-09-4.03922557E-13-2.06679464E+04 5.21436049E+00 4 259CH3COCH2O2H 2/14/95 C 3H 6O 3 0G 300.000 5000.000 1381.00 41 260 1.52372810E+01 1.44114651E-02-5.01290009E-06 7.87071229E-10-4.60225784E-14 2 261-4.27564444E+04-4.77383784E+01 4.94789761E+00 3.60474432E-02-2.21719933E-05 3 262 6.98296874E-09-9.21269260E-13-3.88687178E+04 8.49926130E+00 4 263CH3COCH2O 4/ 3/ 0 THERMC 3H 5O 2 0G 300.000 5000.000 1370.000 21 264 1.14637586E+01 1.32124342E-02-4.56580495E-06 7.13897538E-10-4.16281047E-14 2 265-2.23833017E+04-3.15127868E+01 3.72927689E+00 2.63943697E-02-1.09796486E-05 3 266 8.58185303E-10 3.39474590E-13-1.91551565E+04 1.18505335E+01 4 267C2H3CHO 6/26/95 THERMC 3H 4O 1 0G 300.000 5000.000 1393.000 11 268 1.04184959E+01 9.48963321E-03-3.29310529E-06 5.16279203E-10-3.01587291E-14 2 269-1.49630281E+04-3.07235061E+01 2.92355162E-01 3.54321417E-02-2.94936324E-05 3 270 1.28100124E-08-2.26144108E-12-1.16521584E+04 2.28878280E+01 4 271C2H3CO 4/ 3/ 0 THERMC 3H 3O 1 0G 300.000 5000.000 1402.000 01 272 9.37467676E+00 7.91296900E-03-2.67198280E-06 4.11115430E-10-2.36978981E-14 2 273 1.92969514E+03-2.40892696E+01 1.36242013E+00 3.15273972E-02-3.00218935E-05 3 274 1.48167112E-08-2.87971530E-12 4.25770215E+03 1.72626546E+01 4 275C2H5CHO 8/10/ 4 THERMC 3H 6O 1 0G 300.000 5000.000 1375.000 21 276 8.87216223E+00 2.01710762E-02-8.06487647E-06 1.37617784E-09-8.48922325E-14 2 277-2.83848527E+04-2.35069163E+01 5.93107530E+00 8.87943855E-03 2.03764325E-05 3 278-1.80149348E-08 4.14085655E-12-2.51377751E+04-5.87019974E-01 4 279C2H5CO 8/10/ 4 THERMC 3H 5O 1 0G 300.000 5000.000 1362.000 21 280 1.00147418E+01 1.61527961E-02-6.62976122E-06 1.15290667E-09-7.21263458E-14 2 281-1.00430305E+04-2.88570933E+01 8.35352246E+00-4.08739727E-03 3.64217954E-05 3 282-2.72457713E-08 6.06440266E-12-6.58577307E+03-1.05948346E+01 4 283CH2CH2CHO 8/10/ 4 THERMC 3H 5O 1 0G 300.000 5000.000 1363.000 21 284 9.96855598E+00 1.61917946E-02-6.64161740E-06 1.15444520E-09-7.21981790E-14 2 285-4.16450354E+03-2.73971573E+01 8.36272659E+00-3.90712606E-03 3.59751257E-05 3 286-2.69209237E-08 5.98920261E-12-7.55243244E+02-9.53140102E+00 4 287CH3CHCHO 8/10/ 4 THERMC 3H 5O 1 0G 300.000 5000.000 1253.000 21 288 8.27772090E+00 1.95687188E-02-8.47575089E-06 1.53249728E-09-9.86441542E-14 2 289-8.34456062E+03-2.17652483E+01-2.72811212E+00 3.80354483E-02-1.96782132E-05 3 290 5.09554570E-09-7.28789092E-13-3.51122739E+03 4.04496677E+01 4 291CH3OCH3 7/20/98 THERMC 2H 6O 1 0G 300.000 5000.000 1368.000 21 292 8.27745836E+00 1.32135539E-02-4.53264362E-06 7.05316507E-10-4.09933283E-14 2 293-2.61982700E+04-2.15190894E+01 1.50763450E+00 2.39914228E-02-8.68910500E-06 3 294-9.66835762E-11 4.89319361E-13-2.32810894E+04 1.67317297E+01 4 295CH3OCH2 7/20/98 THERMC 2H 5O 1 0G 300.000 5000.000 1376.000 21 296 8.17137842E+00 1.10086181E-02-3.82352277E-06 5.99637202E-10-3.50317513E-14 2 297-3.41941605E+03-1.78650856E+01 2.91327415E+00 2.03364659E-02-9.59712342E-06 3 298 2.07478525E-09-1.71343362E-13-1.18844240E+03 1.16066817E+01 4 299CH3OCH2O2 7/20/98 THERMC 2H 5O 3 0G 300.000 5000.000 1389.000 31 300 1.24249729E+01 1.18705986E-02-4.07906532E-06 6.35310809E-10-3.69427867E-14 2 301-2.29679238E+04-3.53740145E+01 2.21029612E+00 3.68877454E-02-2.82561555E-05 3 302 1.15730533E-08-1.97130470E-12-1.94940940E+04 1.91463601E+01 4 303CH2OCH2O2H 7/20/98 THERMC 2H 5O 3 0G 300.000 5000.000 1393.000 41 304 1.51191783E+01 9.23718883E-03-3.19127505E-06 4.99114678E-10-2.91162488E-14 2 305-1.84114867E+04-4.85706618E+01 2.52895507E+00 4.24128290E-02-3.73406386E-05 3 306 1.66639333E-08-2.96443312E-12-1.44293306E+04 1.76899251E+01 4 307CH3OCH2O2H 7/20/98 THERMC 2H 6O 3 0G 300.000 5000.000 1392.000 41 308 1.49370964E+01 1.19465829E-02-4.12746359E-06 6.45422590E-10-3.76427939E-14 2 309-4.11001068E+04-4.99552737E+01 1.19855761E+00 4.59060764E-02-3.66252420E-05 3 310 1.49318970E-08-2.46057445E-12-3.65363161E+04 2.31339904E+01 4 311CH3OCH2O 2/ 9/96 THERMC 2H 5O 2 0G 300.000 5000.000 2012.000 21 312 8.60261845E+00 1.35772195E-02-4.84661602E-06 7.77766193E-10-4.62633624E-14 2 313-2.13762444E+04-1.75775023E+01 3.25889339E+00 2.22146359E-02-7.78556340E-06 3 314-2.41484158E-10 4.51914496E-13-1.92377212E+04 1.23680069E+01 4 315O2CH2OCH2O2H 7/20/98 TRMC 2H 5O 5 0G 300.000 5000.000 1402.000 51 316 1.92038046E+01 1.04394841E-02-3.60582939E-06 5.63792843E-10-3.28807214E-14 2 317-3.79207055E+04-6.51847273E+01 1.99640551E+00 5.83226232E-02-5.53259778E-05 3 318 2.59810540E-08-4.77141005E-12-3.27628742E+04 2.44215005E+01 4 319HO2CH2OCHO 8/31/99 THERMC 2H 4O 4 0G 300.000 5000.000 1387.000 41 320 1.64584298E+01 8.52683511E-03-3.04113500E-06 4.85596908E-10-2.87316334E-14 2 321-6.23959608E+04-5.38924139E+01 3.47935703E+00 4.02952392E-02-3.30109296E-05 3 322 1.34360117E-08-2.18601580E-12-5.80629934E+04 1.52521392E+01 4 323OCH2OCHO 4/ 9/98 THERMC 2H 3O 3 0G 300.000 5000.000 1475.000 21 324 1.20233916E+01 8.11262659E-03-2.91356462E-06 4.67340384E-10-2.77375525E-14 2 325-4.33647231E+04-3.33691809E+01 5.19690837E+00 1.58839723E-02 3.53540547E-07 3 326-6.10456923E-09 1.94661801E-12-4.02242792E+04 6.11645828E+00 4 327HOCH2OCO 8/31/99 THERMC 2H 3O 3 0G 300.000 5000.000 1603.000 31 328 1.13737391E+01 8.17663898E-03-2.92034021E-06 4.66695616E-10-2.76276823E-14 2 329-4.65575743E+04-2.86035265E+01 6.08180801E+00 1.28768359E-02 2.04419418E-06 3 330-6.10154921E-09 1.79820559E-12-4.39526183E+04 2.54054449E+00 4 331CH3OCHO 4/15/ 8 THERMC 2H 4O 2 0G 300.000 5000.000 1452.000 21 332 1.06569185E+01 9.38112723E-03-3.37677206E-06 5.42455596E-10-3.22295330E-14 2 333-4.84651758E+04-3.27579443E+01 2.43526200E+00 1.81948325E-02 1.91236590E-06 3 334-8.44248945E-09 2.61758910E-12-4.46514732E+04 1.49522265E+01 4 335CH3OCO 4/15/ 8 THERMC 2H 3O 2 0G 300.000 5000.000 1423.000 21 336 1.02053021E+01 7.12269668E-03-2.57594255E-06 4.15104358E-10-2.47168227E-14 2 337-2.46870635E+04-2.86407262E+01 2.83313145E+00 1.53447505E-02 1.89583962E-06 3 338-7.70200413E-09 2.41564410E-12-2.13431832E+04 1.39524183E+01 4 339CH2OCHO 4/15/ 8 THERMC 2H 3O 2 0G 300.000 5000.000 1442.000 21 340 1.00960096E+01 7.19887066E-03-2.59813465E-06 4.18110812E-10-2.48723387E-14 2 341-2.36389018E+04-2.71144175E+01 2.31031671E+00 1.80474065E-02-2.71519637E-06 3 342-4.60918579E-09 1.70037078E-12-2.02910878E+04 1.71549722E+01 4 343HE 120186HE 1 G 0300.00 5000.00 1000.00 1 344 0.02500000E+02 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 2 345-0.07453750E+04 0.09153489E+01 0.02500000E+02 0.00000000E+00 0.00000000E+00 3 346 0.00000000E+00 0.00000000E+00-0.07453750E+04 0.09153488E+01 4 347C3H8 8/ 4/ 4 THERMC 3H 8 0 0G 300.000 5000.000 1387.000 21 348 9.31450083E+00 1.73577154E-02-5.94222386E-06 9.22939762E-10-5.35576604E-14 2 349-1.77234234E+04-2.89241517E+01-3.08230087E-01 3.65331801E-02-1.97610926E-05 3 350 5.15283344E-09-5.06336649E-13-1.39792198E+04 2.40478733E+01 4 351NC3H7 8/ 4/ 4 THERMC 3H 7 0 0G 300.000 5000.000 1386.000 21 352 8.88635047E+00 1.52273279E-02-5.21905860E-06 8.11259208E-10-4.71028059E-14 2 353 7.34671584E+03-2.30727791E+01 4.74365329E-01 3.19190367E-02-1.71909780E-05 3 354 4.45927887E-09-4.36675398E-13 1.06314565E+04 2.32670929E+01 4 355IC3H7 8/ 4/ 4 THERMC 3H 7 0 0G 300.000 5000.000 1373.000 21 356 8.14705217E+00 1.58727106E-02-5.44611541E-06 8.47207689E-10-4.92178752E-14 2 357 6.18073367E+03-1.91980850E+01 1.63417589E+00 2.40171372E-02-4.72808067E-06 3 358-3.24354603E-09 1.23539044E-12 9.20752889E+03 1.83848082E+01 4 359C3H6 10/23/ 5 THERMC 3H 6 0 0G 300.000 5000.000 1388.000 11 360 8.01595958E+00 1.37023634E-02-4.66249733E-06 7.21254402E-10-4.17370126E-14 2 361-1.76749303E+03-2.00160668E+01 3.94615444E-01 2.89107662E-02-1.54886808E-05 3 362 3.88814209E-09-3.37890352E-13 1.17760132E+03 2.19003736E+01 4 363C3H5-A 10/23/ 5 THERMC 3H 5 0 0G 300.000 5000.000 1397.000 01 364 8.45883958E+00 1.12695483E-02-3.83792864E-06 5.94059119E-10-3.43918030E-14 2 365 1.64683289E+04-2.32704266E+01-5.29131958E-01 3.34559100E-02-2.53401027E-05 3 366 1.02865754E-08-1.73258340E-12 1.94941423E+04 2.46172315E+01 4 367C3H5-T 10/23/ 5 THERMC 3H 5 0 0G 300.000 5000.000 1382.000 11 368 7.37492443E+00 1.17510061E-02-4.00021283E-06 6.18947395E-10-3.58215018E-14 2 369 2.73982108E+04-1.43478655E+01 2.17916644E+00 2.03826623E-02-7.91413834E-06 3 370 4.76906187E-10 2.70398536E-13 2.96002535E+04 1.48785684E+01 4 371C3H5-S 10/23/ 5 THERMC 3H 5 0 0G 300.000 5000.000 1390.000 11 372 7.88765879E+00 1.13012591E-02-3.84213130E-06 5.93982677E-10-3.43567175E-14 2 373 2.83484913E+04-1.74291589E+01 1.32807335E+00 2.53107914E-02-1.51530439E-05 3 374 4.74345565E-09-6.24666084E-13 3.07981100E+04 1.83328787E+01 4 375C3H4-A 101993H 4C 3 G 0300.00 4000.00 1400.00 1 376 0.09776256E+02 0.05302138E-01-0.03701118E-05-0.03026386E-08 0.05089581E-12 2 377 0.01954972E+06-0.03077061E+03 0.02539831E+02 0.01633437E+00-0.01764950E-04 3 378-0.04647365E-07 0.01729131E-10 0.02251243E+06 0.09935702E+02 4 379C3H4-P 101993H 4C 3 G 0300.00 4000.00 1400.00 1 380 0.09768102E+02 0.05219151E-01-0.03753140E-05-0.02992191E-08 0.05107878E-12 2 381 0.01860277E+06-0.03020678E+03 0.03029730E+02 0.01498961E+00-0.01398500E-04 3 382-0.03969619E-07 0.01388217E-10 0.02148408E+06 0.08004594E+02 4 383C3H3 82489C 3H 3 G 0300.00 4000.00 1000.00 1 384 0.08831047E+02 0.04357195E-01-0.04109067E-05-0.02368723E-08 0.04376520E-12 2 385 0.03847420E+06-0.02177919E+03 0.04754200E+02 0.01108028E+00 0.02793323E-05 3 386-0.05479212E-07 0.01949629E-10 0.03988883E+06 0.05854549E+01 4 387C3H2 102193H 2C 3 G 0150.00 4000.00 1000.00 1 388 0.07670981E+02 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415C3H6OOH1-3O2 7/19/ 0 TRMC 3H 7O 4 0G 300.000 5000.000 1382.000 51 416 1.85916698E+01 1.65328553E-02-5.81343626E-06 9.19396939E-10-5.40320702E-14 2 417-2.39598698E+04-6.42544402E+01 3.14864588E+00 5.33542571E-02-4.08330611E-05 3 418 1.67542220E-08-2.89288326E-12-1.85473645E+04 1.86305431E+01 4 419C3H6OOH2-1O2 7/19/ 0 TRMC 3H 7O 4 0G 300.000 5000.000 1386.000 51 420 1.91759159E+01 1.59857013E-02-5.61306378E-06 8.86880495E-10-5.20877040E-14 2 421-2.64412115E+04-6.77512936E+01 2.65196584E+00 5.74638149E-02-4.72190867E-05 3 422 2.05591557E-08-3.68787387E-12-2.08829371E+04 2.01547955E+01 4 423NC3H7O 8/ 9/ 4 THERMC 3H 7O 1 0G 300.000 5000.000 1398.000 21 424 1.14771726E+01 1.54936722E-02-5.29459014E-06 8.21476970E-10-4.76382658E-14 2 425-1.03998532E+04-3.53681150E+01-2.16869993E-01 4.14789744E-02-2.68724173E-05 3 426 8.76685704E-09-1.13947550E-12-6.21358042E+03 2.78942641E+01 4 427IC3H7O 8/ 9/ 4 THERMC 3H 7O 1 0G 300.000 5000.000 1393.000 21 428 1.23135031E+01 1.38062606E-02-4.91585531E-06 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469-1.92864584E+04-7.69636561E+01 2.55619708E+00 6.13504487E-02-5.23205391E-05 3 470 2.28208029E-08-4.02231508E-12-1.31353414E+04 2.21043799E+01 4 471C3H52-1,3OOH 8/26/3 THRMC 3H 7O 4 0G 300.000 5000.000 1379.000 61 472 2.02817964E+01 1.48155431E-02-5.25503386E-06 8.35963453E-10-4.93308915E-14 2 473-1.80085066E+04-7.22688262E+01 4.12253742E+00 5.19553611E-02-3.83733727E-05 3 474 1.45851637E-08-2.29820536E-12-1.22759164E+04 1.48367359E+01 4 475C3H6OH 1/ 7/98 THERMC 3H 7O 1 0G 300.000 5000.000 1674.000 31 476 9.31287816E+00 1.67579212E-02-5.75555480E-06 9.00584362E-10-5.26566836E-14 2 477-1.20169635E+04-1.95011064E+01 1.20494302E+00 3.30857885E-02-1.63893637E-05 3 478 3.18103918E-09-6.84229288E-14-9.12961720E+03 2.47155202E+01 4 479HOC3H6O2 1/ 7/98 THERMC 3H 7O 3 0G 300.000 5000.000 1397.000 41 480 1.42691004E+01 1.71837825E-02-5.83419536E-06 9.00994191E-10-5.20716210E-14 2 481-3.14501750E+04-4.15295035E+01 3.06954289E+00 4.43105640E-02-3.18636260E-05 3 482 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509-5.88659450E+03-3.64627206E+01-8.33377133E-01 4.54141123E-02-2.97609030E-05 3 510 1.03518354E-08-1.51975733E-12-1.49161811E+03 2.94327905E+01 4 511C4H8-2 6/29/ 4 THERMC 4H 8 0 0G 300.000 5000.000 1384.000 21 512 1.07864376E+01 1.84629194E-02-6.28289490E-06 9.72052191E-10-5.62579166E-14 2 513-7.11649782E+03-3.44892763E+01 6.69213599E-01 3.76839941E-02-1.85689683E-05 3 514 3.69571062E-09-1.03095209E-13-3.11675402E+03 2.14868169E+01 4 515C4H71-1 4/ 2/97 THERMC 4H 7 0 0G 300.000 5000.000 1393.000 21 516 1.12162042E+01 1.56658034E-02-5.34224661E-06 8.27633431E-10-4.79428797E-14 2 517 2.41404271E+04-3.38119007E+01 1.19943124E-01 4.15804401E-02-2.89254150E-05 3 518 1.08174803E-08-1.70622296E-12 2.80390734E+04 2.58581923E+01 4 519C4H71-2 4/ 2/97 THERMC 4H 7 0 0G 300.000 5000.000 1389.000 21 520 1.07092407E+01 1.61102825E-02-5.49846133E-06 8.52304018E-10-4.93905022E-14 2 521 2.31874323E+04-3.07648054E+01 9.64124370E-01 3.66781354E-02-2.17105448E-05 3 522 6.55880219E-09-8.11791145E-13 2.68423270E+04 2.24365633E+01 4 523C4H71-3 4/ 2/97 THERMC 4H 7 0 0G 300.000 5000.000 1392.000 11 524 1.09470170E+01 1.63724387E-02-5.59896200E-06 8.69147693E-10-5.04214389E-14 2 525 1.11181741E+04-3.54908400E+01-1.12475112E+00 4.34882854E-02-2.87750454E-05 3 526 9.88046971E-09-1.40120341E-12 1.54420160E+04 2.97651156E+01 4 527C4H71-4 4/ 2/97 THERMC 4H 7 0 0G 300.000 5000.000 1392.000 21 528 1.09215027E+01 1.59294073E-02-5.43642246E-06 8.42695797E-10-4.88353299E-14 2 529 1.90921144E+04-3.12721325E+01-4.09581101E-02 4.06024409E-02-2.67339769E-05 3 530 9.28995844E-09-1.35368138E-12 2.30309664E+04 2.79985374E+01 4 531C4H72-2 4/ 2/97 THERMC 4H 7 0 0G 300.000 5000.000 1379.000 21 532 1.01554133E+01 1.65013248E-02-5.61672328E-06 8.69103603E-10-5.03037094E-14 2 533 2.18242102E+04-2.81884706E+01 2.43874352E+00 2.92295980E-02-1.10907624E-05 3 534 3.35089369E-10 4.95669524E-13 2.50864168E+04 1.52219548E+01 4 535C4H6 4/ 4/ 0 THERMC 4H 6 0 0G 300.000 5000.000 1398.000 11 536 1.11633789E+01 1.37163965E-02-4.69715783E-06 7.29693836E-10-4.23486203E-14 2 537 7.79039770E+03-3.69847949E+01-1.43095121E+00 4.78706062E-02-4.15446800E-05 3 538 1.91549552E-08-3.57158507E-12 1.17551314E+04 2.90825833E+01 4 539PC4H9O2H 7/19/ 0 THERMC 4H 10O 2 0G 300.000 5000.000 1387.000 51 540 1.82687454E+01 2.16940079E-02-7.54629828E-06 1.18484806E-09-6.92818498E-14 2 541-3.39441633E+04-6.84816300E+01 6.34644286E-01 6.20007657E-02-4.34477749E-05 3 542 1.61407616E-08-2.53121507E-12-2.76345805E+04 2.67026090E+01 4 543SC4H9O2H 7/19/ 0 THERMC 4H 10O 2 0G 300.000 5000.000 1390.000 51 544 1.88587916E+01 2.11200987E-02-7.33205568E-06 1.14969842E-09-6.71656991E-14 2 545-3.64236058E+04-7.20026458E+01 3.40587657E-01 6.52078069E-02-4.84840460E-05 3 546 1.91011830E-08-3.13833073E-12-3.00007960E+04 2.72835451E+01 4 547PC4H9O2 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1385.000 41 548 1.57845448E+01 2.15210910E-02-7.44909017E-06 1.16558071E-09-6.79885609E-14 2 549-1.60146054E+04-5.40388525E+01 1.94363650E+00 5.15513163E-02-3.28284400E-05 3 550 1.13064860E-08-1.70118606E-12-1.08358103E+04 2.13503149E+01 4 551SC4H9O2 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1389.000 41 552 1.64031135E+01 2.09361006E-02-7.23393011E-06 1.13058996E-09-6.58938667E-14 2 553-1.85074517E+04-5.77331636E+01 1.32689044E+00 5.62785583E-02-4.01717786E-05 3 554 1.57120967E-08-2.62948443E-12-1.31557057E+04 2.34069659E+01 4 555PC4H9O 8/ 9/ 4 THERMC 4H 9O 1 0G 300.000 5000.000 1403.000 31 556 1.49315588E+01 1.95927054E-02-6.66958265E-06 1.03222635E-09-5.97583630E-14 2 557-1.46178979E+04-5.25561919E+01-4.99964924E-01 5.37157310E-02-3.44426650E-05 3 558 1.08145957E-08-1.29600044E-12-9.11644218E+03 3.09183423E+01 4 559SC4H9O 8/ 9/ 4 THERMC 4H 9O 1 0G 300.000 5000.000 1679.000 31 560 1.43323395E+01 2.04542365E-02-7.12271896E-06 1.12545447E-09-6.62697853E-14 2 561-1.60006806E+04-5.02030895E+01-4.09000900E-01 5.38573427E-02-3.39105695E-05 3 562 1.01023834E-08-1.11268025E-12-1.11109627E+04 2.88554742E+01 4 563C4H7O 4/ 3/ 0 THERMC 4H 7O 1 0G 300.000 5000.000 1395.000 21 564 1.53137780E+01 1.43427017E-02-4.81625517E-06 7.39574839E-10-4.26140814E-14 2 565-7.29342884E+02-5.52937859E+01-1.60619192E+00 5.58562682E-02-4.35595767E-05 3 566 1.70589279E-08-2.65635180E-12 4.85090326E+03 3.47112559E+01 4 567C4H8O1-2 4/ 3/ 0 THERMC 4H 8O 1 0G 300.000 5000.000 1399.000 21 568 1.39197290E+01 1.85551492E-02-6.36014179E-06 9.88844645E-10-5.74274779E-14 2 569-2.09452548E+04-5.06788231E+01-2.42033073E+00 5.79308508E-02-4.30236499E-05 3 570 1.66679793E-08-2.64714350E-12-1.53950880E+04 3.66425242E+01 4 571C4H8O1-3 1/22/95 THERMC 4H 8O 1 0G 300.000 5000.000 1371.000 51 572 1.54227092E+01 1.70211052E-02-6.06347951E-06 9.67354762E-10-5.71992419E-14 2 573-2.20194174E+04-6.13871862E+01-2.53690104E+00 5.43995707E-02-3.43390305E-05 3 574 1.01079922E-08-1.10262736E-12-1.52980680E+04 3.67400719E+01 4 575C4H8O1-4 1/22/95 THERMC 4H 8O 1 0G 300.000 5000.000 1361.000 51 576 1.42360731E+01 1.81176105E-02-6.46263809E-06 1.03194372E-09-6.10557331E-14 2 577-2.99478670E+04-5.52081041E+01-3.28505561E+00 5.04800902E-02-2.51998984E-05 3 578 3.65743744E-09 3.94863161E-13-2.30067422E+04 4.19349253E+01 4 579C4H8O2-3 1/22/95 THERMC 4H 8O 1 0G 300.000 5000.000 1384.000 51 580 1.58263859E+01 1.64400938E-02-5.80680311E-06 9.21146000E-10-5.42511002E-14 2 581-2.35334573E+04-6.34844562E+01-2.98701197E+00 6.32678880E-02-5.20855777E-05 3 582 2.24064364E-08-3.95416618E-12-1.71957196E+04 3.66920390E+01 4 583C4H8OH-1 2/14/95 THERMC 4H 9O 1 0G 300.000 5000.000 2017.000 41 584 1.22411698E+01 2.14192799E-02-7.36540176E-06 1.15346865E-09-6.74843941E-14 2 585-1.59314041E+04-3.35659613E+01 8.93729480E-01 4.56458552E-02-2.50918881E-05 3 586 6.24130181E-09-4.99533512E-13-1.20051696E+04 2.78453352E+01 4 587C4H8OH-2 2/14/95 THERMC 4H 9O 1 0G 300.000 5000.000 1390.000 41 588 1.40098964E+01 1.96303998E-02-6.61483807E-06 1.01686276E-09-5.85950747E-14 2 589-1.90865900E+04-4.50052542E+01 7.34225848E-01 4.82233506E-02-2.92566110E-05 3 590 8.78396067E-09-1.01812519E-12-1.42394556E+04 2.71427693E+01 4 591C4H8OH-1O2 6/26/95 THERMC 4H 9O 3 0G 300.000 5000.000 1396.000 51 592 1.74383247E+01 2.16778876E-02-7.37772628E-06 1.14128811E-09-6.60391451E-14 2 593-3.55892620E+04-5.71247140E+01 2.88497398E+00 5.63287929E-02-3.98403503E-05 3 594 1.53891643E-08-2.51940787E-12-3.05246721E+04 2.09293355E+01 4 595C4H8OH-2O2 6/26/95 THERMC 4H 9O 3 0G 300.000 5000.000 1399.000 51 596 1.82942871E+01 2.09395389E-02-7.12096934E-06 1.10103094E-09-6.36889768E-14 2 597-3.80505855E+04-6.29154326E+01 2.10003504E+00 6.17528218E-02-4.77238541E-05 3 598 1.99145784E-08-3.44416275E-12-3.26698755E+04 2.30901271E+01 4 599C4H8OOH1-1 3/27/97 THERMC 4H 9O 2 0G 300.000 5000.000 1379.000 51 600 1.80477436E+01 1.92137176E-02-6.66503008E-06 1.04468117E-09-6.10170737E-14 2 601-1.23069570E+04-6.33580990E+01 4.36087539E+00 4.46153162E-02-2.14784588E-05 3 602 3.14619957E-09 3.03152649E-13-6.89950326E+03 1.24757248E+01 4 603C4H8OOH1-2 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1393.000 51 604 1.58327906E+01 2.07220436E-02-7.09869028E-06 1.10302045E-09-6.40251984E-14 2 605-8.53034314E+03-5.04399828E+01 1.51698234E+00 5.44584331E-02-3.84524319E-05 3 606 1.48145523E-08-2.42809434E-12-3.49728423E+03 2.64916926E+01 4 607C4H8OOH1-3 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1377.000 51 608 1.76442170E+01 1.91706536E-02-6.57168641E-06 1.02246571E-09-5.94304735E-14 2 609-1.01859280E+04-6.17115813E+01 1.94106276E+00 5.18789351E-02-3.10411683E-05 3 610 8.63568881E-09-8.42841994E-13-4.34315962E+03 2.40230471E+01 4 611C4H8OOH1-4 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1386.000 51 612 1.78623700E+01 1.95212501E-02-6.80351173E-06 1.06960529E-09-6.26000540E-14 2 613-8.87923008E+03-6.34393359E+01 1.45017084E+00 5.72418991E-02-4.06431218E-05 3 614 1.52821793E-08-2.42123218E-12-3.02905522E+03 2.50737890E+01 4 615C4H8OOH2-1 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1390.000 51 616 1.84555673E+01 1.89543719E-02-6.59381457E-06 1.03538370E-09-6.05467101E-14 2 617-1.13637100E+04-6.69839138E+01 1.01711681E+00 6.10560866E-02-4.65789185E-05 3 618 1.88024138E-08-3.15265575E-12-5.37391474E+03 2.63059691E+01 4 619C4H8OOH2-2 3/27/97 THERMC 4H 9O 2 0G 300.000 5000.000 1383.000 51 620 1.63837700E+01 2.04422768E-02-7.04524557E-06 1.09927552E-09-6.39967086E-14 2 621-1.45616229E+04-5.33147431E+01 4.40329034E+00 4.30478989E-02-2.14076129E-05 3 622 4.28267268E-09-1.27804885E-13-9.79432029E+03 1.30514046E+01 4 623C4H8OOH2-3 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1387.000 51 624 1.79338472E+01 1.92153623E-02-6.64486961E-06 1.03940007E-09-6.06239862E-14 2 625-1.25767913E+04-6.36194089E+01 1.45436266E+00 5.63121286E-02-3.84161425E-05 3 626 1.34229297E-08-1.92382914E-12-6.68916116E+03 2.54247554E+01 4 627C4H8OOH2-4 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1390.000 51 628 1.84555673E+01 1.89543719E-02-6.59381457E-06 1.03538370E-09-6.05467101E-14 2 629-1.13637100E+04-6.69839138E+01 1.01711681E+00 6.10560866E-02-4.65789185E-05 3 630 1.88024138E-08-3.15265575E-12-5.37391474E+03 2.63059691E+01 4 631C4H8OOH1-2O2 7/19/ 0 TRMC 4H 9O 4 0G 300.000 5000.000 1387.000 61 632 2.23244015E+01 2.05474775E-02-7.19076348E-06 1.13361536E-09-6.64744383E-14 2 633-3.05468277E+04-8.32666070E+01 2.22400728E+00 7.04994620E-02-5.66978827E-05 3 634 2.42627751E-08-4.29715459E-12-2.37391490E+04 2.38371533E+01 4 635C4H8OOH1-3O2 7/19/ 0 TRMC 4H 9O 4 0G 300.000 5000.000 1387.000 61 636 2.23244015E+01 2.05474775E-02-7.19076348E-06 1.13361536E-09-6.64744383E-14 2 637-3.05468277E+04-8.32666070E+01 2.22400728E+00 7.04994620E-02-5.66978827E-05 3 638 2.42627751E-08-4.29715459E-12-2.37391490E+04 2.38371533E+01 4 639C4H8OOH1-4O2 7/19/ 0 TRMC 4H 9O 4 0G 300.000 5000.000 1383.000 61 640 2.17116470E+01 2.11216172E-02-7.40101448E-06 1.16772959E-09-6.85139846E-14 2 641-2.80483124E+04-7.95885249E+01 3.12351717E+00 6.46725908E-02-4.78357914E-05 3 642 1.89656817E-08-3.18025828E-12-2.14664300E+04 2.04322494E+01 4 643C4H8OOH2-1O2 7/19/ 0 TRMC 4H 9O 4 0G 300.000 5000.000 1387.000 61 644 2.23244015E+01 2.05474775E-02-7.19076348E-06 1.13361536E-09-6.64744383E-14 2 645-3.05468277E+04-8.32666070E+01 2.22400728E+00 7.04994620E-02-5.66978827E-05 3 646 2.42627751E-08-4.29715459E-12-2.37391490E+04 2.38371533E+01 4 647C4H8OOH2-3O2 7/19/ 0 TRMC 4H 9O 4 0G 300.000 5000.000 1389.000 61 648 2.29951044E+01 1.99238919E-02-6.96326765E-06 1.09677832E-09-6.42747281E-14 2 649-3.30095408E+04-8.71461958E+01 2.19248006E+00 7.36763430E-02-6.24428300E-05 3 650 2.79371307E-08-5.10126013E-12-2.61773538E+04 2.29568752E+01 4 651C4H8OOH2-4O2 7/19/ 0 TRMC 4H 9O 4 0G 300.000 5000.000 1387.000 61 652 2.23244015E+01 2.05474775E-02-7.19076348E-06 1.13361536E-09-6.64744383E-14 2 653-3.05468277E+04-8.32666070E+01 2.22400728E+00 7.04994620E-02-5.66978827E-05 3 654 2.42627751E-08-4.29715459E-12-2.37391490E+04 2.38371533E+01 4 655NC4KET12 7/19/ 0 THERMC 4H 8O 3 0G 300.000 5000.000 1388.000 51 656 2.02458485E+01 1.76440360E-02-6.19054598E-06 9.77688024E-10-5.74053258E-14 2 657-4.58141511E+04-7.52145443E+01 8.05387149E-01 6.52375119E-02-5.18373651E-05 3 658 2.13454896E-08-3.59860255E-12-3.92395961E+04 2.84908472E+01 4 659NC4KET13 7/19/ 0 THERMC 4H 8O 3 0G 300.000 5000.000 1386.000 51 660 1.96430808E+01 1.80940566E-02-6.33063232E-06 9.97860399E-10-5.85076458E-14 2 661-4.59588851E+04-7.16905094E+01 2.74883461E+00 5.86936745E-02-4.49605895E-05 3 662 1.83200130E-08-3.11765369E-12-4.01065878E+04 1.88072090E+01 4 663NC4KET14 7/19/ 0 THERMC 4H 8O 3 0G 300.000 5000.000 1382.000 51 664 1.90283822E+01 1.86604765E-02-6.53616227E-06 1.03102482E-09-6.04833256E-14 2 665-4.34678787E+04-6.80210373E+01 3.40797147E+00 5.37386096E-02-3.72613233E-05 3 666 1.36862855E-08-2.13798779E-12-3.77919233E+04 1.65580190E+01 4 667NC4KET21 7/19/ 0 THERMC 4H 8O 3 0G 300.000 5000.000 1376.000 51 668 1.86231473E+01 1.90969401E-02-6.70745998E-06 1.05994690E-09-6.22564248E-14 2 669-4.71929933E+04-6.55477892E+01 4.69785973E+00 4.83859623E-02-3.05576939E-05 3 670 1.02705744E-08-1.51713483E-12-4.18665528E+04 1.06715264E+01 4 671NC4KET23 7/19/ 0 THERMC 4H 8O 3 0G 300.000 5000.000 1387.000 51 672 1.99512969E+01 1.79558596E-02-6.31230878E-06 9.98217386E-10-5.86636973E-14 2 673-4.95585495E+04-7.43071328E+01 4.50575961E-01 6.48862527E-02-5.04446464E-05 3 674 2.03085220E-08-3.35952497E-12-4.28779359E+04 3.00153676E+01 4 675NC4KET24 7/19/ 0 THERMC 4H 8O 3 0G 300.000 5000.000 1380.000 51 676 1.87707201E+01 1.89490823E-02-6.65182145E-06 1.05080860E-09-6.17069393E-14 2 677-4.72319802E+04-6.73335107E+01 2.93007283E+00 5.39296076E-02-3.66164919E-05 3 678 1.30880106E-08-1.99245456E-12-4.14118815E+04 1.86567511E+01 4 679C2H5COCH3 4/ 3/ 0 THERMC 4H 8O 1 0G 300.000 5000.000 1381.000 31 680 1.29004080E+01 1.92211770E-02-6.63870986E-06 1.03733411E-09-6.04509514E-14 2 681-3.52062426E+04-4.20803599E+01 1.60664724E+00 4.13951332E-02-2.23585444E-05 3 682 5.78456048E-09-5.69530338E-13-3.07586009E+04 2.02429671E+01 4 683C2H5COCH2 4/ 3/ 0 THERMC 4H 7O 1 0G 300.000 5000.000 1383.000 31 684 1.42098738E+01 1.57866459E-02-5.50529183E-06 8.65870540E-10-5.06913329E-14 2 685-1.41284951E+04-4.87132911E+01 1.54013856E+00 4.39486258E-02-2.97002421E-05 3 686 1.05495313E-08-1.58598769E-12-9.50796505E+03 1.99706641E+01 4 687CH2CH2COCH3 6/21/95 THERC 4H 7O 1 0G 300.000 5000.000 1380.00 31 688 1.24694368E+01 1.71022143E-02-5.92156726E-06 9.26816806E-10-5.40730504E-14 2 689-1.01378242E+04-3.62186375E+01 2.40255609E+00 3.67294268E-02-1.97316510E-05 3 690 5.07323216E-09-4.99655275E-13-6.15006886E+03 1.93993386E+01 4 691CH3CHCOCH3 4/ 3/ 0 THERMC 4H 7O 1 0G 300.000 5000.000 1384.000 31 692 1.31388032E+01 1.66091073E-02-5.76924215E-06 9.04978165E-10-5.28826527E-14 2 693-1.51162098E+04-4.38876580E+01 8.12941079E-01 4.29256944E-02-2.69230252E-05 3 694 8.59326807E-09-1.13188129E-12-1.05247481E+04 2.32952685E+01 4 695C2H3COCH3 6/19/95 THERMC 4H 6O 1 0G 300.000 5000.000 1386.00 21 696 1.25571995E+01 1.49672645E-02-5.20015351E-06 8.15864365E-10-4.76824406E-14 2 697-2.14622958E+04-4.01434299E+01 2.45578501E-01 4.26432049E-02-2.91126822E-05 3 698 1.03478392E-08-1.53551381E-12-1.70305379E+04 2.64430799E+01 4 699CH3CHOOCOCH3 6/27/95 C 4H 7O 3 0G 300.000 5000.000 1393.00 41 700 1.72170832E+01 1.76740453E-02-6.10387321E-06 9.53711693E-10-5.55757409E-14 2 701-3.05280370E+04-5.67959657E+01 1.59405312E+00 5.74729487E-02-4.65071459E-05 3 702 2.01816805E-08-3.61175600E-12-2.53445178E+04 2.60857480E+01 4 703CH2CHOOHCOCH3 6/27/95 C 4H 7O 3 0G 300.000 5000.000 1394.00 51 704 1.93158016E+01 1.56592602E-02-5.45395604E-06 8.57160086E-10-5.01582885E-14 2 705-2.47752201E+04-6.70296581E+01 1.55204769E+00 6.08201262E-02-5.04704383E-05 3 706 2.16347587E-08-3.75674081E-12-1.89563540E+04 2.71011896E+01 4 707NC3H7CHO 9/27/95 THERMC 4H 8O 1 0G 300.000 5000.000 1378.00 31 708 1.35988068E+01 1.81652474E-02-6.17844458E-06 9.55980208E-10-5.53442958E-14 2 709-3.15845348E+04-4.51790228E+01 1.87415959E+00 4.19240315E-02-2.35148779E-05 3 710 6.26913673E-09-6.09443908E-13-2.71032194E+04 1.91568574E+01 4 711NC3H7CO 9/27/95 THERMC 4H 7O 1 0G 300.000 5000.000 1380.00 31 712 1.30026331E+01 1.63104877E-02-5.57642899E-06 8.65670629E-10-5.02255667E-14 2 713-1.25523385E+04-4.02608515E+01 2.67256826E+00 3.71198825E-02-2.06862859E-05 3 714 5.48873888E-09-5.35864183E-13-8.58050888E+03 1.64848950E+01 4 715C3H6CHO-1 9/27/95 THERMC 4H 7O 1 0G 300.000 5000.000 1379.000 31 716 1.30322954E+01 1.62418373E-02-5.54388124E-06 8.59723685E-10-4.98459726E-14 2 717-6.45915975E+03-3.92399021E+01 2.67672303E+00 3.73064128E-02-2.11281405E-05 3 718 5.80472681E-09-6.09688236E-13-2.49714183E+03 1.75750933E+01 4 719C3H6CHO-2 11/15/95 THERMC 4H 7O 1 0G 300.000 5000.000 1682.000 31 720 1.11942816E+01 1.81806772E-02-6.35916662E-06 1.00727333E-09-5.93943618E-14 2 721-6.86826460E+03-2.80298956E+01 2.95067531E+00 3.34223079E-02-1.45356815E-05 3 722 1.67282048E-09 2.62011555E-13-3.79034324E+03 1.74324072E+01 4 723C3H6CHO-3 11/15/95 THERMC 4H 7O 1 0G 300.000 5000.000 1387.000 31 724 1.34301738E+01 1.62250792E-02-5.60631713E-06 8.76356273E-10-5.10864241E-14 2 725-1.13561098E+04-4.47371262E+01 1.35168659E+00 4.23714083E-02-2.69123192E-05 3 726 8.70132567E-09-1.15287455E-12-6.91166610E+03 2.09381509E+01 4 727C2H5CHCO 9/27/95 THERMC 4H 6O 1 0G 300.000 5000.000 1400.00 21 728 1.34100537E+01 1.38766678E-02-4.74130143E-06 7.35504188E-10-4.26457752E-14 2 729-1.83790837E+04-4.45295352E+01 2.76600655E-01 4.82966593E-02-4.02376928E-05 3 730 1.76564254E-08-3.14365357E-12-1.41717351E+04 2.47118671E+01 4 731SC3H5CHO 11/15/95 THERC 4H 6O 1 0G 300.000 5000.000 1390.000 21 732 1.31695904E+01 1.42484434E-02-4.90843998E-06 7.65789041E-10-4.45834896E-14 2 733-2.04032613E+04-4.43673205E+01 4.35795171E-01 4.48719314E-02-3.36582931E-05 3 734 1.33066870E-08-2.17839128E-12-1.60394651E+04 2.37597452E+01 4 735SC3H5CO 11/15/95 THERMC 4H 5O 1 0G 300.000 5000.000 1392.000 21 736 1.25514754E+01 1.22521948E-02-4.22382101E-06 6.59184896E-10-3.83818826E-14 2 737-4.25349795E+03-4.02864145E+01 1.74191343E+00 3.97229536E-02-3.20061901E-05 3 738 1.38227925E-08-2.46272017E-12-6.64428100E+02 1.70762023E+01 4 739IC4H10 8/ 4/ 4 THERMC 4H 10 0 0G 300.000 5000.000 1387.000 31 740 1.25375828E+01 2.20249881E-02-7.59339274E-06 1.18498137E-09-6.89902468E-14 2 741-2.29421635E+04-4.67741623E+01-9.72807331E-01 5.08660928E-02-3.12355006E-05 3 742 1.02057756E-08-1.44168766E-12-1.78542290E+04 2.69572545E+01 4 743IC4H9 8/ 4/ 4 THERMC 4H 9 0 0G 300.000 5000.000 1386.000 31 744 1.21276930E+01 1.98689494E-02-6.85937004E-06 1.07141528E-09-6.24184609E-14 2 745 2.11952051E+03-4.08727278E+01-2.21457835E-01 4.63756324E-02-2.88282920E-05 3 746 9.60200646E-09-1.39021034E-12 6.76153637E+03 2.64801220E+01 4 747TC4H9 8/ 4/ 4 THERMC 4H 9 0 0G 300.000 5000.000 1372.000 31 748 1.05855083E+01 2.11892055E-02-7.31668360E-06 1.14296173E-09-6.65898835E-14 2 749 3.18311189E+02-3.20671258E+01 3.04300181E+00 2.91276259E-02-4.01386786E-06 3 750-4.90273974E-09 1.64014891E-12 4.04780980E+03 1.21127351E+01 4 751IC4H8 10/23/ 5 THERMC 4H 8 0 0G 300.000 5000.000 1388.000 21 752 1.12258330E+01 1.81795798E-02-6.20348592E-06 9.61444458E-10-5.57088057E-14 2 753-7.90617899E+03-3.66411888E+01 9.38433173E-01 3.90547287E-02-2.16437148E-05 3 754 5.87267077E-09-6.14435479E-13-3.95452013E+03 1.98337802E+01 4 755IC4H7 10/23/ 5 THERMC 4H 7 0 0G 300.000 5000.000 1393.000 11 756 1.16382753E+01 1.57681299E-02-5.38538858E-06 8.35172927E-10-4.84141083E-14 2 757 1.03408230E+04-3.90259890E+01-7.20881697E-04 4.36495730E-02-3.16385877E-05 3 758 1.23984983E-08-2.04378360E-12 1.43654373E+04 2.33234340E+01 4 759IC4H9O2 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1387.000 41 760 1.59741221E+01 2.13534740E-02-7.39001105E-06 1.15624411E-09-6.74408046E-14 2 761-1.72329304E+04-5.65302409E+01 1.21434293E+00 5.45388311E-02-3.67001593E-05 3 762 1.34131042E-08-2.11741793E-12-1.18482450E+04 2.34153048E+01 4 763TC4H9O2 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1388.000 41 764 1.67061556E+01 2.07327780E-02-7.17596169E-06 1.12282473E-09-6.54941386E-14 2 765-2.04046924E+04-6.35558608E+01 1.08742583E+00 5.82780709E-02-4.33292697E-05 3 766 1.76892535E-08-3.06769606E-12-1.49456640E+04 2.01871963E+01 4 767TC4H8O2H-I 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1405.000 51 768 1.78060253E+01 1.84952716E-02-6.21268423E-06 9.52753962E-10-5.48010330E-14 2 769-1.17555816E+04-6.40180236E+01 1.57469723E+00 6.04648659E-02-4.84991814E-05 3 770 2.05236181E-08-3.52974722E-12-6.54190901E+03 2.16852700E+01 4 771IC4H8O2H-I 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1388.000 51 772 1.80246456E+01 1.93668264E-02-6.74676496E-06 1.06040129E-09-6.20506445E-14 2 773-1.00858977E+04-6.57629693E+01 9.94784793E-01 5.89212240E-02-4.25202225E-05 3 774 1.61370574E-08-2.55904902E-12-4.08029057E+03 2.58950880E+01 4 775IC4H8O2H-T 7/19/ 0 THERMC 4H 9O 2 0G 300.000 5000.000 1397.000 51 776 1.52395012E+01 2.06496983E-02-6.94791927E-06 1.06651097E-09-6.13782754E-14 2 777-1.02271199E+04-4.70908585E+01 3.77633001E+00 4.50889269E-02-2.62423875E-05 3 778 7.74736900E-09-9.11520393E-13-5.98295842E+03 1.53503399E+01 4 779IC4H8O 7/19/95 THERMC 4H 8O 1 0G 300.000 5000.000 1399.000 21 780 1.44624830E+01 1.80562860E-02-6.18008791E-06 9.59941341E-10-5.57132297E-14 2 781-2.30230616E+04-5.61190165E+01-2.97373741E+00 6.24618637E-02-5.04348211E-05 3 782 2.13345360E-08-3.67382824E-12-1.73274318E+04 3.62336362E+01 4 783CC4H8O 6/29/95 THERMC 4H 8O 1 0G 300.000 5000.000 1401.000 11 784 1.35131704E+01 1.91666441E-02-6.53902359E-06 1.01366570E-09-5.87546671E-14 2 785-2.00311488E+04-5.22146967E+01-5.27768230E+00 6.52482242E-02-5.00209030E-05 3 786 1.97452179E-08-3.15605813E-12-1.37706522E+04 4.78500688E+01 4 787TC4H9O 8/ 9/ 4 THERMC 4H 9O 1 0G 300.000 5000.000 1397.000 31 788 1.50819361E+01 1.94454128E-02-6.61333610E-06 1.02279160E-09-5.91796928E-14 2 789-1.88111456E+04-5.71658947E+01-5.32084074E-01 5.71613469E-02-4.20177228E-05 3 790 1.63745425E-08-2.64124700E-12-1.34963439E+04 2.62776957E+01 4 791IC4H9O 8/ 9/ 4 THERMC 4H 9O 1 0G 300.000 5000.000 1393.000 31 792 1.46765729E+01 2.00942091E-02-6.90362097E-06 1.07495878E-09-6.24925271E-14 2 793-1.55789914E+04-5.26039549E+01-7.66695776E-01 5.55173852E-02-3.81796473E-05 3 794 1.37862085E-08-2.07312751E-12-1.01111245E+04 3.06331234E+01 4 795IC4H9O2H 7/19/ 0 THERMC 4H 10O 2 0G 300.000 5000.000 1388.000 51 796 1.84308794E+01 2.15337606E-02-7.48623965E-06 1.17499240E-09-6.86890788E-14 2 797-3.51483277E+04-7.08030846E+01 2.44181899E-01 6.34027841E-02-4.49162379E-05 3 798 1.67406877E-08-2.61216478E-12-2.86959808E+04 2.72156229E+01 4 799TC4H9O2H 7/19/ 0 THERMC 4H 10O 2 0G 300.000 5000.000 1390.000 51 800 1.91617041E+01 2.09157249E-02-7.27346821E-06 1.14180989E-09-6.67577135E-14 2 801-3.83201687E+04-7.78230874E+01 1.14505932E-01 6.71507854E-02-5.15578410E-05 3 802 2.10256365E-08-3.56467024E-12-3.17928725E+04 2.40011030E+01 4 803IC4H7O 4/ 3/ 0 THERMC 4H 7O 1 0G 300.000 5000.000 1386.000 21 804 1.33457615E+01 1.61218588E-02-5.44376403E-06 8.38199374E-10-4.83608280E-14 2 805 6.11443644E+02-4.36818838E+01 1.74700687E+00 4.07783436E-02-2.44750243E-05 3 806 7.06502958E-09-7.51570589E-13 4.86979233E+03 1.94535999E+01 4 807IC4H8OH 2/14/95 THERMC 4H 9O 1 0G 300.000 5000.000 1376.000 41 808 1.25605997E+01 2.10637488E-02-7.15019648E-06 1.10439262E-09-6.38428695E-14 2 809-1.86203249E+04-3.67889430E+01 3.29612707E+00 3.47649647E-02-1.02505618E-05 3 810-2.04641931E-09 1.18879408E-12-1.45627247E+04 1.58606320E+01 4 811IO2C4H8OH 8/23/95 THERMC 4H 9O 3 0G 300.000 5000.000 1395.000 51 812 1.79798208E+01 2.13452115E-02-7.29108198E-06 1.13068846E-09-6.55402236E-14 2 813-3.85769917E+04-6.23553522E+01 2.88826008E+00 5.80363124E-02-4.26690874E-05 3 814 1.71759332E-08-2.91842186E-12-3.33881503E+04 1.83381149E+01 4 815IC3H7CHO 2/22/96 THERMC 4H 8O 1 0G 300.000 5000.000 1391.000 31 816 1.37501656E+01 1.83126722E-02-6.28572629E-06 9.78250756E-10-5.68538653E-14 2 817-3.26936771E+04-4.77270548E+01-2.73021382E-01 4.89696307E-02-3.12770049E-05 3 818 1.00052945E-08-1.27512074E-12-2.76054737E+04 2.83451139E+01 4 819TC3H6CHO 2/22/96 THERMC 4H 7O 1 0G 300.000 5000.000 1389.000 21 820 1.31013047E+01 1.66391865E-02-5.68457623E-06 8.81808351E-10-5.11290161E-14 2 821-1.30638647E+04-4.42705813E+01 1.87052762E+00 4.14869677E-02-2.66815701E-05 3 822 9.01531610E-09-1.27870633E-12-8.97730744E+03 1.66174178E+01 4 823IC3H6CHO 2/22/96 THERMC 4H 7O 1 0G 300.000 5000.000 1390.000 31 824 1.33102250E+01 1.62097959E-02-5.57575891E-06 8.69003718E-10-5.05554202E-14 2 825-7.62177931E+03-4.25050854E+01 5.21481767E-01 4.43114357E-02-2.86617314E-05 3 826 9.30319894E-09-1.20761563E-12-2.99677086E+03 2.68182130E+01 4 827IC3H7CO 2/22/96 THERMC 4H 7O 1 0G 300.000 5000.000 1390.000 31 828 1.33305736E+01 1.61873930E-02-5.56711402E-06 8.67575951E-10-5.04696549E-14 2 829-1.37307001E+04-4.33958746E+01 5.03452639E-01 4.41607510E-02-2.82139091E-05 3 830 8.93548675E-09-1.11327422E-12-9.07755468E+03 2.61991461E+01 4 831TC4H8OOH-IO2 7/19/ 0 TRMC 4H 9O 4 0G 300.000 5000.000 1386.000 61 832 2.26382889E+01 2.03246143E-02-7.12390770E-06 1.12425028E-09-6.59732993E-14 2 833-3.24406877E+04-8.80387843E+01 2.17782096E+00 7.17785118E-02-5.88836046E-05 3 834 2.56759171E-08-4.61678643E-12-2.55622378E+04 2.07846231E+01 4 835IC4H8OOH-IO2 7/19/ 0 TRMC 4H 9O 4 0G 300.000 5000.000 1385.000 61 836 2.18969581E+01 2.09637874E-02-7.34664900E-06 1.15926594E-09-6.80225413E-14 2 837-2.92664889E+04-8.20540807E+01 2.39424426E+00 6.76572549E-02-5.17083682E-05 3 838 2.10796041E-08-3.59960373E-12-2.24787495E+04 2.25029839E+01 4 839IC4H8OOH-TO2 7/19/ 0 TRMC 4H 9O 4 0G 300.000 5000.000 1386.000 61 840 2.26382889E+01 2.03246143E-02-7.12390770E-06 1.12425028E-09-6.59732993E-14 2 841-3.24406877E+04-8.80387843E+01 2.17782096E+00 7.17785118E-02-5.88836046E-05 3 842 2.56759171E-08-4.61678643E-12-2.55622378E+04 2.07846231E+01 4 843IC4KETII 7/19/ 0 THERMC 4H 8O 3 0G 300.000 5000.000 1387.000 51 844 1.95143059E+01 1.82377395E-02-6.38908606E-06 1.00801571E-09-5.91440350E-14 2 845-4.46884836E+04-7.17167584E+01 1.15501614E+00 6.10622345E-02-4.49711323E-05 3 846 1.70514654E-08-2.65948602E-12-3.82747956E+04 2.69612235E+01 4 847IC4KETIT 7/19/ 0 THERMC 4H 8O 3 0G 300.000 5000.000 1388.000 51 848 2.09369850E+01 1.71090955E-02-6.01892169E-06 9.52353863E-10-5.59926176E-14 2 849-4.77819819E+04-8.27717611E+01 1.14243741E+00 6.33840797E-02-4.73084738E-05 3 850 1.77145373E-08-2.67265475E-12-4.09366796E+04 2.34844867E+01 4 851IC4H7OH 4/ 8/97 THERMC 4H 8O 1 0G 300.000 5000.000 1384.000 31 852 1.35043419E+01 1.78646968E-02-5.99304371E-06 9.18717641E-10-5.28435302E-14 2 853-2.58255688E+04-4.44645715E+01 1.69099899E+00 4.27168891E-02-2.49281695E-05 3 854 7.00961522E-09-7.23262828E-13-2.14512334E+04 1.99500833E+01 4 855IC4H6OH 8/19/95 THERMC 4H 7O 1 0G 300.000 5000.000 1390.000 31 856 1.40310926E+01 1.55317541E-02-5.32754961E-06 8.28785902E-10-4.81545257E-14 2 857-7.69378228E+03-4.76555306E+01 8.63371227E-01 4.68711282E-02-3.43580339E-05 3 858 1.33031052E-08-2.13914975E-12-3.14948305E+03 2.29075523E+01 4 859IC3H5CHO 7/19/95 THERMC 4H 6O 1 0G 300.000 5000.000 1396.000 21 860 1.36203958E+01 1.37917192E-02-4.73370118E-06 7.36655226E-10-4.20097974E-14 2 861-2.00025274E+04-4.73184531E+01 6.27183793E-01 4.66780254E-02-3.74430631E-05 3 862 1.58330542E-08-2.73952155E-12-1.57203117E+04 2.16034294E+01 4 863IC3H5CO 4/ 3/ 0 THERMC 4H 5O 1 0G 300.000 5000.000 1397.000 21 864 1.30667437E+01 1.16704244E-02-3.99106523E-06 6.19498148E-10-3.59348249E-14 2 865-3.36519344E+03-4.35803090E+01 1.85097069E+00 4.18855846E-02-3.62553731E-05 3 866 1.65690659E-08-3.05850846E-12 1.70381441E+02 1.53014433E+01 4 867TC3H6OCHO 8/25/95 THERMC 4H 7O 2 0G 300.000 5000.000 1394.00 31 868 1.70371287E+01 1.54400645E-02-5.28332886E-06 8.21085347E-10-4.76898429E-14 2 869-2.75871941E+04-6.37271230E+01 3.70830259E-01 5.38475661E-02-3.82477565E-05 3 870 1.32882237E-08-1.79228730E-12-2.18391262E+04 2.58142112E+01 4 871IC3H6CO 03/03/95 THERMC 4H 6O 1 0G 300.000 5000.000 1397.00 41 872 1.32548232E+01 1.40142787E-02-4.78910215E-06 7.42924342E-10-4.30737566E-14 2 873-2.00529779E+04-4.44810221E+01 2.28039055E+00 4.17016989E-02-3.25089661E-05 3 874 1.37243419E-08-2.40573132E-12-1.63939712E+04 1.38187714E+01 4 875IC4H7OOH 7/19/95 THERMC 4H 8O 2 0G 300.000 5000.000 1392.00 41 876 1.69234564E+01 1.78396769E-02-6.14273279E-06 9.57895028E-10-5.57438304E-14 2 877-2.00040686E+04-5.94746070E+01 2.99117402E+00 5.03349278E-02-3.56280061E-05 3 878 1.33952154E-08-2.11053409E-12-1.51095046E+04 1.54537413E+01 4 879TC3H6OHCHO 8/ 1/95 THERMC 4H 8O 2 0G 300.000 5000.000 1396.00 41 880 1.70788996E+01 1.74005554E-02-5.93008112E-06 9.18860909E-10-5.32512140E-14 2 881-5.38730427E+04-6.38638754E+01 2.10033500E-01 5.63086284E-02-3.95158669E-05 3 882 1.37780428E-08-1.89068805E-12-4.80402638E+04 2.67836070E+01 4 883TC3H6OH 8/ 9/ 4 THERMC 3H 7O 1 0G 300.000 5000.000 1392.000 31 884 1.12222277E+01 1.36444398E-02-4.51406709E-06 7.10523275E-10-4.22690392E-14 2 885-1.75350136E+04-3.18911926E+01 1.09670360E+00 3.80727565E-02-2.75022497E-05 3 886 1.07477493E-08-1.74895773E-12-1.40764487E+04 2.22475799E+01 4 887IC3H5OH 8/ 1/95 THERMC 3H 6O 1 0G 300.000 5000.000 1374.00 21 888 1.07381025E+01 1.31698194E-02-4.41529622E-06 6.77009837E-10-3.89608901E-14 2 889-2.47298321E+04-3.13634050E+01 1.58376391E+00 3.16215366E-02-1.73664942E-05 3 890 4.18927663E-09-2.79899620E-13-2.12643496E+04 1.88313766E+01 4 891TC3H6O2CHO 8/ 2/95 THERMC 4H 7O 3 0G 300.000 5000.000 1386.00 41 892 1.85534443E+01 1.68774389E-02-5.90752965E-06 9.31518085E-10-5.46345187E-14 2 893-2.85447191E+04-6.82486667E+01 2.17883383E+00 5.41595832E-02-3.83435886E-05 3 894 1.38308104E-08-2.04190147E-12-2.27394154E+04 2.00751264E+01 4 895TC3H6O2HCO 8/ 2/95 THERMC 4H 7O 3 0G 300.000 5000.000 1387.00 51 896 2.06472678E+01 1.48526500E-02-5.25104875E-06 8.33619219E-10-4.91256069E-14 2 897-2.88719869E+04-7.95951389E+01 2.03864428E+00 5.80421003E-02-4.32123528E-05 3 898 1.58792094E-08-2.32209543E-12-2.24284673E+04 2.03680990E+01 4 899IC3H5O2HCHO 8/2/95 THERMC 4H 7O 3 0G 300.000 5000.000 1387.00 51 900 2.06288832E+01 1.48625539E-02-5.25305276E-06 8.33772951E-10-4.91277401E-14 2 901-2.27589076E+04-7.82962888E+01 2.05984770E+00 5.82331716E-02-4.37672100E-05 3 902 1.63249918E-08-2.43462051E-12-1.63496250E+04 2.13687921E+01 4 903CH2CCH2OH 9/ 8/95 THERMC 3H 5O 1 0G 300.000 5000.000 1372.00 21 904 9.70702027E+00 1.13972660E-02-3.77993962E-06 5.75209277E-10-3.29229125E-14 2 905 9.13212884E+03-2.25012933E+01 2.88422544E+00 2.42428071E-02-1.14152268E-05 3 906 1.71775334E-09 1.42177454E-13 1.17935615E+04 1.52102335E+01 4 907TC4H8CHO 9/ 7/95 THERMC 5H 9O 1 0G 300.000 5000.000 1397.00 41 908 1.79663933E+01 1.94207117E-02-6.67409451E-06 1.03969221E-09-6.04702651E-14 2 909-1.33368585E+04-6.79819424E+01-9.58078294E-01 6.42003258E-02-4.70776827E-05 3 910 1.75737698E-08-2.64896151E-12-6.86582501E+03 3.33781112E+01 4 911O2C4H8CHO 9/ 7/95 THERMC 5H 9O 3 0G 300.000 5000.000 1395.00 51 912 2.12629904E+01 2.14072282E-02-7.38342949E-06 1.15281523E-09-6.71508438E-14 2 913-3.16854524E+04-7.99828703E+01 1.91847699E+00 6.67245869E-02-4.80871046E-05 3 914 1.78588690E-08-2.71163880E-12-2.49837984E+04 2.38577867E+01 4 915O2HC4H8CO 9/ 7/95 THERMC 5H 9O 3 0G 300.000 5000.000 1394.00 61 916 2.38219630E+01 1.91411448E-02-6.67919154E-06 1.05127303E-09-6.15876805E-14 2 917-3.23093973E+04-9.42580755E+01 1.82607262E+00 6.93466111E-02-4.93125140E-05 3 918 1.69848340E-08-2.26117657E-12-2.46578311E+04 2.41167544E+01 4 919C3H5OH 9/ 8/95 THERMC 3H 6O 1 0G 300.000 5000.000 1388.00 21 920 1.02818222E+01 1.34248012E-02-4.47039448E-06 6.81924195E-10-3.90899553E-14 2 921-1.99960114E+04-2.77736680E+01 1.08899314E+00 3.28481769E-02-1.91322648E-05 3 922 5.21635136E-09-4.82394566E-13-1.66282463E+04 2.22754535E+01 4 923TIC4H7Q2-I 5/ 6/96 THERMC 4H 9O 4 0G 300.000 5000.000 1400.000 71 924 2.33848631E+01 1.87070035E-02-6.44021945E-06 1.00428123E-09-5.84468189E-14 2 925-2.61180902E+04-8.76610135E+01 4.48426361E+00 6.61225007E-02-5.27349018E-05 3 926 2.18215585E-08-3.66788946E-12-1.98906586E+04 1.26719614E+01 4 927IIC4H7Q2-I 7/15/96 THERMC 4H 9O 4 0G 300.000 5000.000 1394.000 71 928 2.30500244E+01 1.92149194E-02-6.66622576E-06 1.04495725E-09-6.10370520E-14 2 929-2.32086881E+04-8.39949885E+01 4.93055661E+00 6.05819201E-02-4.23665566E-05 3 930 1.49122008E-08-2.10978665E-12-1.68415495E+04 1.36228018E+01 4 931IIC4H7Q2-T 7/15/96 THERMC 4H 9O 4 0G 300.000 5000.000 1377.000 71 932 2.15070321E+01 2.05359839E-02-7.12383399E-06 1.11655053E-09-6.52112103E-14 2 933-2.51117508E+04-7.43379783E+01 8.16274487E+00 4.34463050E-02-1.76972456E-05 3 934 4.88790666E-10 9.03915465E-13-1.96501749E+04 2.62067299E-01 4 935! FROM MILLER 936HON HF MELIUS93H 1N 1O 1 0G 300.00 5000.00 1671.000 01 937 3.78577430E+00 2.86062728E-03-1.02423922E-06 1.64463139E-10-9.77943616E-15 2 938 2.93319701E+04 3.12193293E+00 3.33656431E+00 2.67682939E-03 5.61801303E-07 3 939-1.11362279E-09 2.84076438E-13 2.95979751E+04 5.96343188E+00 4 940HONO RUS 89H 1N 1O 2 0G 200.00 6000.00 1000. 1 !BURCAT 941 0.57919018E+01 0.36515212E-02-0.12928936E-05 0.20688716E-09-0.12315254E-13 2 !H298 =-18.74 KCAL/MOL 942-0.11565589E+05-0.40558233E+01 0.32141709E+01 0.81276869E-02 0.16602559E-05 3 !S298 = 60.72 CAL/MOL/K 943-0.95285182E-08 0.48715058E-11-0.10753237E+05 0.98219504E+01-0.94355439E+04 4 ! 944HONO2 T 8/03H 1N 1O 3 0G 200.00 6000.00 1000. 1 !BURCAT 945 8.03098942E+00 4.46958589E-03-1.72459491E-06 2.91556153E-10-1.80102702E-14 2 !H298 =-134.112+/-0.18 KJ/MOL [ATCT(BURCAT)] 946-1.92821685E+04-1.62616720E+01 1.69329154E+00 1.90167702E-02-8.25176697E-06 3 !S298 = 63.76 CAL/MOL/K 947-6.06113827E-09 4.65236978E-12-1.73882411E+04 1.71839655E+01 4 ! 948HNO ATCT/AH 1N 1O 1 0G 200.00 6000.00 1000. 1 !BURCAT 949 3.16598124E+00 2.99958892E-03-3.94376786E-07-3.85344089E-11 7.07602668E-15 2 !H298 = 106.842+/-0.125 KJ/MOL [ATCT(BURCAT)] 950 1.17654289E+04 7.64513642E+00 4.53525574E+00-5.68543377E-03 1.85198540E-05 3 !S298 = 52.80 CAL/MOL/K 951-1.71881225E-08 5.55818157E-12 1.16110981E+04 1.74318356E+00 4 ! 952HNO2 103190H 1N 1O 2 G 0300.00 4000.00 1500.00 1 !RAS/GLA08A 953 6.47963000E+00 1.99527400E-03-1.74038700E-07-9.69587200E-11 1.70148000E-14 2 !H298 = -9.80 KCAL/MOL [RAS/GLA08A] 954-7.80950291E+03-1.06771518E+01 1.93483800E+00 1.01003600E-02-4.96461600E-06 3 !S298 = 56.73 CAL/MOL/K [SANDIA] 955 8.70112000E-10-2.32413500E-15-5.91571591E+03 1.47282082E+01 4 ! 956H2NN DBOZ00M93/JBPM3 96 N 2H 2 0 0G 300.000 5000.000 1695.000 1 957 3.13531032E+00 5.68632569E-03-1.93983467E-06 3.01290501E-10-1.74978144E-14 2 958 3.33678346E+04 7.04815840E+00 2.88544262E+00 4.69495999E-03 7.01983230E-07 3 959-1.53359038E-09 3.79345858E-13 3.36030690E+04 8.95096779E+00 4 960H2NO 102290H 2N 1O 1 G 0300.00 4000.00 1500.00 1 961 0.05673346E+02 0.02298837E-01-0.01774446E-05-0.01103482E-08 0.01859762E-12 2 962 0.05569325E+05-0.06153540E+02 0.02530590E+02 0.08596035E-01-0.05471030E-04 3 963 0.02276249E-07-0.04648073E-11 0.06868030E+05 0.01126651E+03 4 964N 120186N 1 G 0300.00 5000.00 1000.00 1 965 0.02450268E+02 0.01066146E-02-0.07465337E-06 0.01879652E-09-0.01025984E-13 2 966 0.05611604E+06 0.04448758E+02 0.02503071E+02-0.02180018E-03 0.05420529E-06 3 967-0.05647560E-09 0.02099904E-12 0.05609890E+06 0.04167566E+02 4 968NH N 1H 1 0 0G 200.00 6000.00 1000.0 1 969 0.27836929E+01 0.13298429E-02-0.42478047E-06 0.78348504E-10-0.55044470E-14 2 970 0.42134514E+05 0.57407798E+01 0.34929084E+01 0.31179197E-03-0.14890484E-05 3 971 0.24816442E-08-0.10356967E-11 0.41894294E+05 0.18483277E+01 0.42940822E+05 4 972NH2 121686N 1H 2 G 0300.00 5000.00 1000.00 1 973 0.02961311E+02 0.02932699E-01-0.09063600E-05 0.01617257E-08-0.01204200E-12 2 974 0.02191977E+06 0.05777878E+02 0.03432493E+02 0.03299540E-01-0.06613600E-04 3 975 0.08590947E-07-0.03572047E-10 0.02177228E+06 0.03090111E+02 4 976NH3 121386N 1H 3 G 0300.00 5000.00 1000.00 1 977 0.02461904E+02 0.06059166E-01-0.02004977E-04 0.03136003E-08-0.01938317E-12 2 978-0.06493270E+05 0.07472097E+02 0.02204352E+02 0.01011476E+00-0.01465265E-03 3 979 0.01447235E-06-0.05328509E-10-0.06525488E+05 0.08127138E+02 4 980NNH T 1/06N 2.H 1. 0. 0.G 200.000 6000.000 1000. 1 ! BURCAT 2010 *PW* CHANGE HF=59.7 KCAL/MOLE 981 3.42744423E+00 3.23295234E-03-1.17296299E-06 1.90508356E-10-1.14491506E-14 2 982 2.88067740E+04 6.39209233E+00 4.25474632E+00-3.45098298E-03 1.37788699E-05 3 983-1.33263744E-08 4.41023397E-12 2.88323793E+04 3.28551762E+00 3.02815661E+04 4 984!NNH T 1/06N 2.H 1. 0. 0.G 200.000 6000.000 1000. 1 ! BURCAT 2010 (HF=60.17) 985! 3.42744423E+00 3.23295234E-03-1.17296299E-06 1.90508356E-10-1.14491506E-14 2 986! 2.90433115E+04 6.39209233E+00 4.25474632E+00-3.45098298E-03 1.37788699E-05 3 987!-1.33263744E-08 4.41023397E-12 2.90689168E+04 3.28551762E+00 3.02815661E+04 4 988NO RUS 89N 1O 1 0 0G 200.00 6000.00 1000. 1 ! 989 3.26071234E+00 1.19101135E-03-4.29122646E-07 6.94481463E-11-4.03295681E-15 2 !H298 = 91.097+/-0.085 KJ/MOL [ATCT(RUS/PIN06)] 990 9.89456954E+03 6.36900469E+00 4.21859896E+00-4.63988124E-03 1.10443049E-05 3 !S298 = 50.36 CAL/MOL/K [BURCAT] 991-9.34055507E-09 2.80554874E-12 9.81823786E+03 2.28060952E+00 4 !CP [BURCAT] 992NO2 L 7/88N 1O 2 0 0G 200.00 6000.00 1000. 1 ! 993 4.88475400E+00 2.17239550E-03-8.28069090E-07 1.57475100E-10-1.05108950E-14 2 !H298 = 34.025+/-0.085 KJ/MOL [ATCT(RUS/PIN06)] 994 2.29397777E+03-1.17416951E-01 3.94403120E+00-1.58542900E-03 1.66578120E-05 3 !S298 = 57.40 CAL/MOL/K [BURCAT] 995-2.04754260E-08 7.83505640E-12 2.87409757E+03 6.31199190E+00 4 !CP [BURCAT] 996NO3 ATCT/AN 1O 3 0 0G 200.00 6000.00 1000. 1 !BURCAT 997 7.48347702E+00 2.57772064E-03-1.00945831E-06 1.72314063E-10-1.07154008E-14 2 !H298 = 17.83 KCAL/MOL 998 6.12990474E+03-1.41618136E+01 2.17359330E+00 1.04902685E-02 1.10472669E-05 3 !S298 = 60.37 CAL/MOL/K 999-2.81561867E-08 1.36583960E-11 7.81290905E+03 1.46022090E+01 8.97563416E+03 4 ! 1000N2 BUR0302 G 8/02N 2. 0. 0. 0.G 200.00 6000.00 1000. 1 1001 2.95257637E+00 1.39690040E-03-4.92631603E-07 7.86010195E-11-4.60755204E-15 2 1002-9.23948688E+02 5.87188762E+00 3.53100528E+00-1.23660988E-04-5.02999433E-07 3 1003 2.43530612E-09-1.40881235E-12-1.04697628E+03 2.96747038E+00 0.00000000E+00 4 1004N2H2 121286N 2H 2 G 0300.00 5000.00 1000.00 1 1005 0.03371185E+02 0.06039968E-01-0.02303854E-04 0.04062789E-08-0.02713144E-12 2 1006 0.02418172E+06 0.04980585E+02 0.01617999E+02 0.01306312E+00-0.01715712E-03 3 1007 0.01605608E-06-0.06093639E-10 0.02467526E+06 0.01379467E+03 4 1008N2H3 120186N 2H 3 G 0300.00 5000.00 1000.00 1 1009 0.04441846E+02 0.07214271E-01-0.02495684E-04 0.03920565E-08-0.02298950E-12 2 1010 0.01664221E+06-0.04275205E+01 0.03174204E+02 0.04715907E-01 0.01334867E-03 3 1011-0.01919685E-06 0.07487564E-10 0.01727270E+06 0.07557224E+02 4 1012N2H4 121286N 2H 4 G 0300.00 5000.00 1000.00 1 1013 0.04977317E+02 0.09595519E-01-0.03547639E-04 0.06124299E-08-0.04029795E-12 2 1014 0.09341219E+05-0.02962990E+02 0.06442606E+00 0.02749730E+00-0.02899451E-03 3 1015 0.01745240E-06-0.04422282E-10 0.01045192E+06 0.02127789E+03 4 1016N2O 121286N 2O 1 G 0300.00 5000.00 1000.00 1 1017 0.04718977E+02 0.02873714E-01-0.01197496E-04 0.02250552E-08-0.01575337E-12 2 1018 0.08165811E+05-0.01657250E+02 0.02543058E+02 0.09492193E-01-0.09792775E-04 3 1019 0.06263845E-07-0.01901826E-10 0.08765100E+05 0.09511222E+02 4 1020N2O3 L 4/90N 2O 3 0 0G 200.00 6000.00 1000. 1 !BURCAT 1021 9.08583845E+00 3.37756330E-03-1.31583890E-06 2.30762329E-10-1.47151267E-14 2 !H298 = 86.090+/-0.18 KJ/MOL [ATCT(BURCAT)] 1022 7.20075967E+03-1.55361722E+01 5.81083964E+00 1.43330962E-02-1.96208597E-05 3 !S298 = 75.22 CAL/MOL/K 1023 1.73060735E-08-6.46553954E-12 8.12100274E+03 1.20463136E+00 4 ! 1024N2O4 ATCT AN 2O 4 0 0G 200.00 6000.00 1000. 1 !BURCAT 1025 1.15752932E+01 4.01615532E-03-1.57178022E-06 2.68273657E-10-1.66921538E-14 2 !H298 = 10.785+/-0.17 KJ/MOL [ATCT(BURCAT)] 1026-2.96184070E+03-3.19488531E+01 3.02002271E+00 2.95904359E-02-3.01342572E-05 3 !S298 = 72.76 CAL/MOL/K 1027 1.42360526E-08-2.44100411E-12-6.79967151E+02 1.18059714E+01 4 ! 1028NH2OH JWB/SAND88 N 1H 3O 1 0G 300.000 5000.000 1412.000 11 1029 5.12276969E+00 5.73428233E-03-1.86277359E-06 2.78938290E-10-1.57685159E-14 2 1030-7.42648110E+03-3.34064363E+00 1.59842441E+00 1.54722273E-02-1.24132635E-05 3 1031 5.50996715E-09-1.00114333E-12-6.34935610E+03 1.50585859E+01 4 1032HNOH 102290H 2N 1O 1 G 0300.00 4000.00 1500.00 1 1033 0.06396134E+02 0.01821067E-01-0.01870891E-05-0.07844471E-09 0.14448555E-13 2 1034 0.07859615E+05-0.10404785E+02 0.02125274E+02 0.10662818E-01-0.07602588E-04 3 1035 0.03081641E-07-0.05726498E-11 0.09553544E+05 0.13096718E+02 4 1036O L 1/90O 1 G 200.000 3500.000 1000.000 1 1037 2.56942078E+00-8.59741137E-05 4.19484589E-08-1.00177799E-11 1.22833691E-15 2 1038 2.92175791E+04 4.78433864E+00 3.16826710E+00-3.27931884E-03 6.64306396E-06 3 1039-6.12806624E-09 2.11265971E-12 2.91222592E+04 2.05193346E+00 4 1040O2 TPIS89O 2 G 200.000 3500.000 1000.000 1 1041 3.28253784E+00 1.48308754E-03-7.57966669E-07 2.09470555E-10-2.16717794E-14 2 1042-1.08845772E+03 5.45323129E+00 3.78245636E+00-2.99673416E-03 9.84730201E-06 3 1043-9.68129509E-09 3.24372837E-12-1.06394356E+03 3.65767573E+00 4 1044H L 7/88H 1 G 200.000 3500.000 1000.000 1 1045 2.50000001E+00-2.30842973E-11 1.61561948E-14-4.73515235E-18 4.98197357E-22 2 1046 2.54736599E+04-4.46682914E-01 2.50000000E+00 7.05332819E-13-1.99591964E-15 3 1047 2.30081632E-18-9.27732332E-22 2.54736599E+04-4.46682853E-01 4 1048H2 TPIS78H 2 G 200.000 3500.000 1000.000 1 1049 3.33727920E+00-4.94024731E-05 4.99456778E-07-1.79566394E-10 2.00255376E-14 2 1050-9.50158922E+02-3.20502331E+00 2.34433112E+00 7.98052075E-03-1.94781510E-05 3 1051 2.01572094E-08-7.37611761E-12-9.17935173E+02 6.83010238E-01 4 1052OH RUS 78O 1H 1 G 200.000 3500.000 1000.000 1 1053 3.09288767E+00 5.48429716E-04 1.26505228E-07-8.79461556E-11 1.17412376E-14 2 1054 3.85865700E+03 4.47669610E+00 3.99201543E+00-2.40131752E-03 4.61793841E-06 3 1055-3.88113333E-09 1.36411470E-12 3.61508056E+03-1.03925458E-01 4 1056H2O L 8/89H 2O 1 G 200.000 3500.000 1000.000 1 1057 3.03399249E+00 2.17691804E-03-1.64072518E-07-9.70419870E-11 1.68200992E-14 2 1058-3.00042971E+04 4.96677010E+00 4.19864056E+00-2.03643410E-03 6.52040211E-06 3 1059-5.48797062E-09 1.77197817E-12-3.02937267E+04-8.49032208E-01 4 1060HO2 L 5/89H 1O 2 G 200.000 3500.000 1000.000 1 1061 4.01721090E+00 2.23982013E-03-6.33658150E-07 1.14246370E-10-1.07908535E-14 2 1062 1.11856713E+02 3.78510215E+00 4.30179801E+00-4.74912051E-03 2.11582891E-05 3 1063-2.42763894E-08 9.29225124E-12 2.94808040E+02 3.71666245E+00 4 1064H2O2 L 7/88H 2O 2 G 200.000 3500.000 1000.000 1 1065 4.16500285E+00 4.90831694E-03-1.90139225E-06 3.71185986E-10-2.87908305E-14 2 1066-1.78617877E+04 2.91615662E+00 4.27611269E+00-5.42822417E-04 1.67335701E-05 3 1067-2.15770813E-08 8.62454363E-12-1.77025821E+04 3.43505074E+00 4 1068C L11/88C 1 G 200.000 3500.000 1000.000 1 1069 2.49266888E+00 4.79889284E-05-7.24335020E-08 3.74291029E-11-4.87277893E-15 2 1070 8.54512953E+04 4.80150373E+00 2.55423955E+00-3.21537724E-04 7.33792245E-07 3 1071-7.32234889E-10 2.66521446E-13 8.54438832E+04 4.53130848E+00 4 1072CH TPIS79C 1H 1 G 200.000 3500.000 1000.000 1 1073 2.87846473E+00 9.70913681E-04 1.44445655E-07-1.30687849E-10 1.76079383E-14 2 1074 7.10124364E+04 5.48497999E+00 3.48981665E+00 3.23835541E-04-1.68899065E-06 3 1075 3.16217327E-09-1.40609067E-12 7.07972934E+04 2.08401108E+00 4 1076CH2 L S/93C 1H 2 G 200.000 3500.000 1000.000 1 1077 2.87410113E+00 3.65639292E-03-1.40894597E-06 2.60179549E-10-1.87727567E-14 2 1078 4.62636040E+04 6.17119324E+00 3.76267867E+00 9.68872143E-04 2.79489841E-06 3 1079-3.85091153E-09 1.68741719E-12 4.60040401E+04 1.56253185E+00 4 1080CH2(S) L S/93C 1H 2 G 200.000 3500.000 1000.000 1 1081 2.29203842E+00 4.65588637E-03-2.01191947E-06 4.17906000E-10-3.39716365E-14 2 1082 5.09259997E+04 8.62650169E+00 4.19860411E+00-2.36661419E-03 8.23296220E-06 3 1083-6.68815981E-09 1.94314737E-12 5.04968163E+04-7.69118967E-01 4 1084CH3 L11/89C 1H 3 G 200.000 3500.000 1000.000 1 1085 2.28571772E+00 7.23990037E-03-2.98714348E-06 5.95684644E-10-4.67154394E-14 2 1086 1.67755843E+04 8.48007179E+00 3.67359040E+00 2.01095175E-03 5.73021856E-06 3 1087-6.87117425E-09 2.54385734E-12 1.64449988E+04 1.60456433E+00 4 1088CH4 L 8/88C 1H 4 G 200.000 3500.000 1000.000 1 1089 7.48514950E-02 1.33909467E-02-5.73285809E-06 1.22292535E-09-1.01815230E-13 2 1090-9.46834459E+03 1.84373180E+01 5.14987613E+00-1.36709788E-02 4.91800599E-05 3 1091-4.84743026E-08 1.66693956E-11-1.02466476E+04-4.64130376E+00 4 1092CO TPIS79C 1O 1 G 200.000 3500.000 1000.000 1 1093 2.71518561E+00 2.06252743E-03-9.98825771E-07 2.30053008E-10-2.03647716E-14 2 1094-1.41518724E+04 7.81868772E+00 3.57953347E+00-6.10353680E-04 1.01681433E-06 3 1095 9.07005884E-10-9.04424499E-13-1.43440860E+04 3.50840928E+00 4 1096CO2 L 7/88C 1O 2 G 200.000 3500.000 1000.000 1 1097 3.85746029E+00 4.41437026E-03-2.21481404E-06 5.23490188E-10-4.72084164E-14 2 1098-4.87591660E+04 2.27163806E+00 2.35677352E+00 8.98459677E-03-7.12356269E-06 3 1099 2.45919022E-09-1.43699548E-13-4.83719697E+04 9.90105222E+00 4 1100HCO L12/89H 1C 1O 1 G 200.000 3500.000 1000.000 1 1101 2.77217438E+00 4.95695526E-03-2.48445613E-06 5.89161778E-10-5.33508711E-14 2 1102 4.01191815E+03 9.79834492E+00 4.22118584E+00-3.24392532E-03 1.37799446E-05 3 1103-1.33144093E-08 4.33768865E-12 3.83956496E+03 3.39437243E+00 4 1104CH2O L 8/88H 2C 1O 1 G 200.000 3500.000 1000.000 1 1105 1.76069008E+00 9.20000082E-03-4.42258813E-06 1.00641212E-09-8.83855640E-14 2 1106-1.39958323E+04 1.36563230E+01 4.79372315E+00-9.90833369E-03 3.73220008E-05 3 1107-3.79285261E-08 1.31772652E-11-1.43089567E+04 6.02812900E-01 4 1108CH2OH GUNL93C 1H 3O 1 G 200.000 3500.000 1000.000 1 1109 3.69266569E+00 8.64576797E-03-3.75101120E-06 7.87234636E-10-6.48554201E-14 2 1110-3.24250627E+03 5.81043215E+00 3.86388918E+00 5.59672304E-03 5.93271791E-06 3 1111-1.04532012E-08 4.36967278E-12-3.19391367E+03 5.47302243E+00 4 1112CH3O 121686C 1H 3O 1 G 300.00 3000.00 1000.000 1 1113 0.03770799E+02 0.07871497E-01-0.02656384E-04 0.03944431E-08-0.02112616E-12 2 1114 0.12783252E+03 0.02929575E+02 0.02106204E+02 0.07216595E-01 0.05338472E-04 3 1115-0.07377636E-07 0.02075610E-10 0.09786011E+04 0.13152177E+02 4 1116CH3OH L 8/88C 1H 4O 1 G 200.000 3500.000 1000.000 1 1117 1.78970791E+00 1.40938292E-02-6.36500835E-06 1.38171085E-09-1.17060220E-13 2 1118-2.53748747E+04 1.45023623E+01 5.71539582E+00-1.52309129E-02 6.52441155E-05 3 1119-7.10806889E-08 2.61352698E-11-2.56427656E+04-1.50409823E+00 4 1120C2H L 1/91C 2H 1 G 200.000 3500.000 1000.000 1 1121 3.16780652E+00 4.75221902E-03-1.83787077E-06 3.04190252E-10-1.77232770E-14 2 1122 6.71210650E+04 6.63589475E+00 2.88965733E+00 1.34099611E-02-2.84769501E-05 3 1123 2.94791045E-08-1.09331511E-11 6.68393932E+04 6.22296438E+00 4 1124C2H2 L 1/91C 2H 2 G 200.000 3500.000 1000.000 1 1125 4.14756964E+00 5.96166664E-03-2.37294852E-06 4.67412171E-10-3.61235213E-14 2 1126 2.59359992E+04-1.23028121E+00 8.08681094E-01 2.33615629E-02-3.55171815E-05 3 1127 2.80152437E-08-8.50072974E-12 2.64289807E+04 1.39397051E+01 4 1128C2H3 L 2/92C 2H 3 G 200.000 3500.000 1000.000 1 1129 3.01672400E+00 1.03302292E-02-4.68082349E-06 1.01763288E-09-8.62607041E-14 2 1130 3.46128739E+04 7.78732378E+00 3.21246645E+00 1.51479162E-03 2.59209412E-05 3 1131-3.57657847E-08 1.47150873E-11 3.48598468E+04 8.51054025E+00 4 1132C2H4 L 1/91C 2H 4 G 200.000 3500.000 1000.000 1 1133 2.03611116E+00 1.46454151E-02-6.71077915E-06 1.47222923E-09-1.25706061E-13 2 1134 4.93988614E+03 1.03053693E+01 3.95920148E+00-7.57052247E-03 5.70990292E-05 3 1135-6.91588753E-08 2.69884373E-11 5.08977593E+03 4.09733096E+00 4 1136C2H5 L12/92C 2H 5 G 200.000 3500.000 1000.000 1 1137 1.95465642E+00 1.73972722E-02-7.98206668E-06 1.75217689E-09-1.49641576E-13 2 1138 1.28575200E+04 1.34624343E+01 4.30646568E+00-4.18658892E-03 4.97142807E-05 3 1139-5.99126606E-08 2.30509004E-11 1.28416265E+04 4.70720924E+00 4 1140C2H6 L 8/88C 2H 6 G 200.000 3500.000 1000.000 1 1141 1.07188150E+00 2.16852677E-02-1.00256067E-05 2.21412001E-09-1.90002890E-13 2 1142-1.14263932E+04 1.51156107E+01 4.29142492E+00-5.50154270E-03 5.99438288E-05 3 1143-7.08466285E-08 2.68685771E-11-1.15222055E+04 2.66682316E+00 4 1144CH2CO L 5/90C 2H 2O 1 G 200.000 3500.000 1000.000 1 1145 4.51129732E+00 9.00359745E-03-4.16939635E-06 9.23345882E-10-7.94838201E-14 2 1146-7.55105311E+03 6.32247205E-01 2.13583630E+00 1.81188721E-02-1.73947474E-05 3 1147 9.34397568E-09-2.01457615E-12-7.04291804E+03 1.22156480E+01 4 1148HCCO SRIC91H 1C 2O 1 G 300.00 4000.00 1000.000 1 1149 0.56282058E+01 0.40853401E-02-0.15934547E-05 0.28626052E-09-0.19407832E-13 2 1150 0.19327215E+05-0.39302595E+01 0.22517214E+01 0.17655021E-01-0.23729101E-04 3 1151 0.17275759E-07-0.50664811E-11 0.20059449E+05 0.12490417E+02 4 1152HCCOH SRI91C 2O 1H 2 G 300.000 5000.000 1000.000 1 1153 0.59238291E+01 0.67923600E-02-0.25658564E-05 0.44987841E-09-0.29940101E-13 2 1154 0.72646260E+04-0.76017742E+01 0.12423733E+01 0.31072201E-01-0.50866864E-04 3 1155 0.43137131E-07-0.14014594E-10 0.80316143E+04 0.13874319E+02 4 1156H2CN 41687H 2C 1N 1 G 300.00 4000.000 1000.000 1 1157 0.52097030E+01 0.29692911E-02-0.28555891E-06-0.16355500E-09 0.30432589E-13 2 1158 0.27677109E+05-0.44444780E+01 0.28516610E+01 0.56952331E-02 0.10711400E-05 3 1159-0.16226120E-08-0.23511081E-12 0.28637820E+05 0.89927511E+01 4 1160HCN GRI/98H 1C 1N 1 G 200.000 6000.000 1000.000 1 1161 0.38022392E+01 0.31464228E-02-0.10632185E-05 0.16619757E-09-0.97997570E-14 2 1162 0.14407292E+05 0.15754601E+01 0.22589886E+01 0.10051170E-01-0.13351763E-04 3 1163 0.10092349E-07-0.30089028E-11 0.14712633E+05 0.89164419E+01 4 1164HNO AND93 H 1N 1O 1 G 200.000 6000.000 1000.000 1 1165 0.29792509E+01 0.34944059E-02-0.78549778E-06 0.57479594E-10-0.19335916E-15 2 1166 0.11750582E+05 0.86063728E+01 0.45334916E+01-0.56696171E-02 0.18473207E-04 3 1167-0.17137094E-07 0.55454573E-11 0.11548297E+05 0.17498417E+01 4 1168N L 6/88N 1 G 200.000 6000.000 1000.000 1 1169 0.24159429E+01 0.17489065E-03-0.11902369E-06 0.30226245E-10-0.20360982E-14 2 1170 0.56133773E+05 0.46496096E+01 0.25000000E+01 0.00000000E+00 0.00000000E+00 3 1171 0.00000000E+00 0.00000000E+00 0.56104637E+05 0.41939087E+01 4 1172NNH T07/93N 2H 1 G 200.000 6000.000 1000.000 1 1173 0.37667544E+01 0.28915082E-02-0.10416620E-05 0.16842594E-09-0.10091896E-13 2 1174 0.28650697E+05 0.44705067E+01 0.43446927E+01-0.48497072E-02 0.20059459E-04 3 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0.56662560E-02-0.17278676E-05 0.23867161E-09-0.12578786E-13 2 1190-0.65446958E+04 0.65662928E+01 0.42860274E+01-0.46605230E-02 0.21718513E-04 3 1191-0.22808887E-07 0.82638046E-11-0.67417285E+04-0.62537277E+00 4 1192NO RUS 78N 1O 1 G 200.000 6000.000 1000.000 1 1193 0.32606056E+01 0.11911043E-02-0.42917048E-06 0.69457669E-10-0.40336099E-14 2 1194 0.99209746E+04 0.63693027E+01 0.42184763E+01-0.46389760E-02 0.11041022E-04 3 1195-0.93361354E-08 0.28035770E-11 0.98446230E+04 0.22808464E+01 4 1196NO2 L 7/88N 1O 2 G 200.000 6000.000 1000.000 1 1197 0.48847542E+01 0.21723956E-02-0.82806906E-06 0.15747510E-09-0.10510895E-13 2 1198 0.23164983E+04-0.11741695E+00 0.39440312E+01-0.15854290E-02 0.16657812E-04 3 1199-0.20475426E-07 0.78350564E-11 0.28966179E+04 0.63119917E+01 4 1200HCNO BDEA94H 1N 1C 1O 1G 300.000 5000.000 1382.000 1 1201 6.59860456E+00 3.02778626E-03-1.07704346E-06 1.71666528E-10-1.01439391E-14 2 1202 1.79661339E+04-1.03306599E+01 2.64727989E+00 1.27505342E-02-1.04794236E-05 3 1203 4.41432836E-09-7.57521466E-13 1.92990252E+04 1.07332972E+01 4 1204HOCN BDEA94H 1N 1C 1O 1G 300.000 5000.000 1368.000 1 1205 5.89784885E+00 3.16789393E-03-1.11801064E-06 1.77243144E-10-1.04339177E-14 2 1206-3.70653331E+03-6.18167825E+00 3.78604952E+00 6.88667922E-03-3.21487864E-06 3 1207 5.17195767E-10 1.19360788E-14-2.82698400E+03 5.63292162E+00 4 1208HNCO BDEA94H 1N 1C 1O 1G 300.000 5000.000 1478.000 1 1209 6.22395134E+00 3.17864004E-03-1.09378755E-06 1.70735163E-10-9.95021955E-15 2 1210-1.66599344E+04-8.38224741E+00 3.63096317E+00 7.30282357E-03-2.28050003E-06 3 1211-6.61271298E-10 3.62235752E-13-1.55873636E+04 6.19457727E+00 4 1212NCO EA 93 N 1C 1O 1 G 200.000 6000.000 1000.000 1 1213 0.51521845E+01 0.23051761E-02-0.88033153E-06 0.14789098E-09-0.90977996E-14 2 1214 0.14004123E+05-0.25442660E+01 0.28269308E+01 0.88051688E-02-0.83866134E-05 3 1215 0.48016964E-08-0.13313595E-11 0.14682477E+05 0.95504646E+01 4 1216CN HBH92 C 1N 1 G 200.000 6000.000 1000.000 1 1217 0.37459805E+01 0.43450775E-04 0.29705984E-06-0.68651806E-10 0.44134173E-14 2 1218 0.51536188E+05 0.27867601E+01 0.36129351E+01-0.95551327E-03 0.21442977E-05 3 1219-0.31516323E-09-0.46430356E-12 0.51708340E+05 0.39804995E+01 4 1220HCNN SRI/94C 1N 2H 1 G 300.000 5000.000 1000.000 1 1221 0.58946362E+01 0.39895959E-02-0.15982380E-05 0.29249395E-09-0.20094686E-13 2 1222 0.53452941E+05-0.51030502E+01 0.25243194E+01 0.15960619E-01-0.18816354E-04 3 1223 0.12125540E-07-0.32357378E-11 0.54261984E+05 0.11675870E+02 4 1224N2 121286N 2 G 300.000 5000.000 1000.000 1 1225 0.02926640E+02 0.14879768E-02-0.05684760E-05 0.10097038E-09-0.06753351E-13 2 1226-0.09227977E+04 0.05980528E+02 0.03298677E+02 0.14082404E-02-0.03963222E-04 3 1227 0.05641515E-07-0.02444854E-10-0.10208999E+04 0.03950372E+02 4 1228AR 120186AR 1 G 300.000 5000.000 1000.000 1 1229 0.02500000E+02 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 2 1230-0.07453750E+04 0.04366000E+02 0.02500000E+02 0.00000000E+00 0.00000000E+00 3 1231 0.00000000E+00 0.00000000E+00-0.07453750E+04 0.04366000E+02 4 1232C3H8 L 4/85C 3H 8 G 300.000 5000.000 1000.000 1 1233 0.75341368E+01 0.18872239E-01-0.62718491E-05 0.91475649E-09-0.47838069E-13 2 1234-0.16467516E+05-0.17892349E+02 0.93355381E+00 0.26424579E-01 0.61059727E-05 3 1235-0.21977499E-07 0.95149253E-11-0.13958520E+05 0.19201691E+02 4 1236C3H7 L 9/84C 3H 7 G 300.000 5000.000 1000.000 1 1237 0.77026987E+01 0.16044203E-01-0.52833220E-05 0.76298590E-09-0.39392284E-13 2 1238 0.82984336E+04-0.15480180E+02 0.10515518E+01 0.25991980E-01 0.23800540E-05 3 1239-0.19609569E-07 0.93732470E-11 0.10631863E+05 0.21122559E+02 4 1240CH3CHO L 8/88C 2H 4O 1 G 200.000 6000.000 1000.000 1 1241 0.54041108E+01 0.11723059E-01-0.42263137E-05 0.68372451E-09-0.40984863E-13 2 1242-0.22593122E+05-0.34807917E+01 0.47294595E+01-0.31932858E-02 0.47534921E-04 3 1243-0.57458611E-07 0.21931112E-10-0.21572878E+05 0.41030159E+01 4 1244CH2CHO SAND86O 1H 3C 2 G 300.000 5000.000 1000.000 1 1245 0.05975670E+02 0.08130591E-01-0.02743624E-04 0.04070304E-08-0.02176017E-12 2 1246 0.04903218E+04-0.05045251E+02 0.03409062E+02 0.10738574E-01 0.01891492E-04 3 1247-0.07158583E-07 0.02867385E-10 0.15214766E+04 0.09558290E+02 4 1248END 1249 1250 1251 1252 1253