thermo 298.000 1000.000 5000.000 c7h8 l 6/87c 7h 8 0 0g 200.000 6000.000 1 0.12940034e+02 0.26691287e-01-0.96838505e-05 0.15738629e-08-0.94663601e-13 2 -0.69764908e+03-0.46728785e+02 0.16152663e+01 0.21099438e-01 0.85366018e-04 3 -0.13261066e-06 0.55956604e-10 0.40756300e+04 0.20282210e+02 4 c7h8o cresol l 6/87c 7h 8o 1 0g 200.000 6000.000 1 0.15932987e+02 0.27011160e-01-0.99448722e-05 0.16296689e-08-0.98513298e-13 2 -0.23592065e+05-0.59732841e+02 0.42258267e+00 0.45551636e-01 0.32012513e-04 3 -0.81121959e-07 0.37665658e-10-0.18202621e+05 0.26032903e+02 4 c7h7 t08/90c 7h 7 0 0g 200.000 6000.000 1 0.14043980e+02 0.23493873e-01-0.85375367e-05 0.13890841e-08-0.83614420e-13 2 0.18564203e+05-0.51665589e+02 0.48111540e+00 0.38512832e-01 0.32861492e-04 3 -0.76972721e-07 0.35423068e-10 0.23307027e+05 0.23548820e+02 4 c7h7o ebg c 7h 7o 1 0g 300.000 5000.000 1389.000 1 2.08644385e+01 1.85115130e-02-6.34591221e-06 9.88320326e-10-5.75152427e-14 2 -8.39231428e+03-9.15798540e+01-3.73786936e+00 7.52967730e-02-5.47150593e-05 3 1.89060939e-08-2.46715849e-12 2.67233477e+01 4.04727046e+01 4 c7h7oh ebg c 7h 8o 1 0g 300.000 5000.000 1398.000 1 2.05745245e+01 2.05513700e-02-6.88594427e-06 1.05580886e-09-6.07715527e-14 2 -2.54145704e+04-8.69178692e+01-4.48479735e+00 8.32792049e-02-6.68674735e-05 3 2.70252364e-08-4.34410399e-12-1.72753716e+04 4.59408329e+01 4 c6h5cho l 3/86c 7h 6o 1 0g 298.150 5000.000 1 0.13650737e+02 0.25680419e-01-0.10466729e-04 0.19413430e-08-0.13483792e-12 2 -0.11019744e+05-0.47965796e+02-0.31627334e+01 0.66369245e-01-0.34816353e-04 3 -0.62999377e-08 0.85807101e-11-0.61169349e+04 0.40231735e+02 4 c6h5co therm c 7h 5o 1 0g 300.000 5000.000 1392.000 1 1.75116258e+01 1.62650511e-02-5.65051892e-06 8.86922680e-10-5.18657990e-14 2 4.67641545e+03-6.70531966e+01-1.56729686e+00 5.99817511e-02-4.29153585e-05 3 1.48666854e-08-1.98938453e-12 1.12873830e+04 3.55490009e+01 4 c6h5 l 1/91c 6. h 5. o 0. n 0. g 200.000 6000.000 1000.000 1 1.07702200e+01 1.83848597e-02-6.69985951e-06 1.09225620e-09-6.58414439e-14 2 3.52040328e+04-3.50146837e+01 7.09725032e-01 1.93299484e-02 5.94079007e-05 3 -9.85084147e-08 4.25424755e-11 3.91345677e+04 2.30299294e+01 4 ch3cho 120186c 2o 1h 4 0g 0300.00 5000.00 1000.00 1 0.05868650e+02 0.01079424e+00-0.03645530e-04 0.05412912e-08-0.02896844e-12 2 -0.02264569e+06-0.06012946e+02 0.02505695e+02 0.01336991e+00 0.04671953e-04 3 -0.01128140e-06 0.04263566e-10-0.02124589e+06 0.01335089e+03 4 ch3co t 9/92c 2h 3o 1 0g 200.000 6000.00 1000.0 1 0.59447731e+01 0.78667205e-02-0.28865882e-05 0.47270875e-09-0.28599861e-13 2 -0.37873075e+04-0.50136751e+01 0.41634257e+01-0.23261610e-03 0.34267820e-04 3 -0.44105227e-07 0.17275612e-10-0.26574529e+04 0.73468280e+01-0.12027167e+04 4 c3h6 propylene l 4/85c 3h 6 0 0g 300.000 5000.00 1000.0 1 0.67213974e 01 0.14931757e-01-0.49652353e-05 0.72510753e-09-0.38001476e-13 2 -0.92453149e 03-0.12155617e 02 0.14575157e 01 0.21142263e-01 0.40468012e-05 3 -0.16319003e-07 0.70475153e-11 0.10740208e 04 0.17399460e 02 0.24557265e 04 4 c3h5 symmetric t 9/96c 3h 5 0 0g 200.000 6000.00 1000.0 1 0.70094568d+01 0.13106629d-01-0.46533442d-05 0.74514323d-09-0.44350051d-13 2 0.16412909d+05-0.13946114d+02 0.14698036d+01 0.19034365d-01 0.14480425d-04 3 -0.35468652d-07 0.16647594d-10 0.18325831d+05 0.16724114d+02 0.19675772d+05 4 c3h8 propane l 4/85c 3h 8 0 0g 300.000 5000.00 1000.0 1 0.75341368e 01 0.18872239e-01-0.62718491e-05 0.91475649e-09-0.47838069e-13 2 -0.16467516e 05-0.17892349e 02 0.93355381e 00 0.26424579e-01 0.61059727e-05 3 -0.21977499e-07 0.95149253e-11-0.13958520e 05 0.19201691e 02-0.12489986e 05 4 c3h4 allene l 8/89c 3h 4 0 0g 200.000 6000.00 1000.0 1 0.63168722e+01 0.11133728e-01-0.39629378e-05 0.63564238e-09-0.37875540e-13 2 0.20117495e+05-0.10995766e+02 0.26130445e+01 0.12122575e-01 0.18539880e-04 3 -0.34525149e-07 0.15335079e-10 0.21541567e+05 0.10226139e+02 0.22962267e+05 4 c4h3 l 9/89c 4h 3 0 0g 300.000 5000.000 1000.00 1 0.84762079e+01 0.88782327e-02-0.30328412e-05 0.47358302e-09-0.27716627e-13 2 0.54756540e+05-0.17170551e+02 0.24173247e+01 0.24104782e-01-0.12813470e-04 3 -0.28606237e-08 0.39194527e-11 0.56506476e+05 0.14471107e+02 0.58181574e+05 4 c4h10 62090c 4h 10 0g 0300.00 4000.00 1500.00 1 0.01998785e+03 0.01037281e+00-0.09610818e-05-0.04623018e-08 0.08202828e-12 2 -0.02625571e+06-0.08837907e+03-0.02256618e+02 0.05881732e+00-0.04525783e-03 3 0.02037115e-06-0.04079458e-10-0.01760233e+06 0.03329595e+03 4 c4h7 2/14/95 c 4h 7 0 0g 300.000 5000.000 1392.00 1 0.90657617e+01 0.19477743e-01-0.73385554e-05 0.12863733e-08-0.85601393e-13 2 0.10187905e+05-0.24022063e+02-0.34391326e+01 0.67889035e-01-0.92118162e-04 3 0.75423011e-07-0.25411345e-10 0.13278011e+05 0.37956421e+02 0.14593283e+05 4 ic4h7 ch2=chchch3 c 4h 70 00 0g 300.00 3000.00 1000.00 1 0.5521420e+01 0.2683684e-01 -0.1286430e-04 0.3088640e-08 -0.3030856e-12 2 0.1198044e+05 -0.4495640e+01 -0.1080514e+01 0.4638686e-01 -0.3464697e-04 3 0.1401374e-07 -0.2395040e-11 0.1375538e+05 0.2933150e+02 4 c5h10 12/52c 5h 10 0 0g 300.000 5000.000 1000.00 1 0.12541454e 02 0.23941070e-01-0.77445529e-05 0.11157970e-08-0.57968116e-13 2 -0.87175352e 04-0.39854187e 02 0.17627859e 01 0.38902789e-01 0.58380774e-05 3 -0.30547188e-07 0.13839465e-10-0.48109883e 04 0.19929169e 02-0.25594116e 04 4 c6h11 2/14/95 c 6h 11 0 0g 300.000 5000.000 1388.00 1 1.73781063e+01 2.52715626e-02-8.74710351e-06 1.36884407e-09-7.98569285e-14 2 1.33730775e+03-6.77269441e+01-1.78981302e+00 6.71660911e-02-4.34180588e-05 3 1.43931014e-08-1.96953043e-12 8.35230470e+03 3.63570478e+01 4 c6h10 c 6h 10n 0o 0g 300.00 5000.00 1000.00 1 0.12656940e+02 0.28236120e-01-0.10406250e-04 0.18530920e-08-0.12592180e-12 2 0.39164010e+04-0.38104860e+02-0.94988270e+00 0.60725200e-01-0.30414580e-04 3 -0.35837280e-08 0.64369670e-11 0.79947620e+04 0.33574390e+02 4 ic3h7 i-l 9/84c 3h 7 0 0g 300.000 5000.00 1000.0 1 0.65294638e 01 0.17193288e-01-0.57153220e-05 0.83408080e-09-0.43663532e-13 2 0.77179102e 04-0.91399021e 01 0.14461584e 01 0.20988975e-01 0.77172672e-05 3 -0.18481391e-07 0.71269024e-11 0.98206094e 04 0.20108200e 02 0.11221480e 05 4 ic4h8 5/27/97 thermc 4h 8 0 0g 300.000 5000.000 1388.000 1 1.12258330e+01 1.81795798e-02-6.20348592e-06 9.61444458e-10-5.57088057e-14 2 -7.69983777e+03-3.73306704e+01 9.38433173e-01 3.90547287e-02-2.16437148e-05 3 5.87267077e-09-6.14435479e-13-3.74817891e+03 1.91442985e+01 4 ic4h9 9/19/91 thermc 4h 9 0 0g 300.000 5000.000 1393.00 1 1.22753162e+01 1.95174006e-02-6.68773001e-06 1.03935193e-09-6.03374502e-14 2 1.69244882e+03-4.08932742e+01-1.00837472e+00 5.01087003e-02-3.41941210e-05 3 1.26025783e-08-1.97552053e-12 6.42407431e+03 3.07281021e+01 4 ic4h10 9/19/91 thermc 4h 10 0 0g 300.000 5000.000 1389.00 1 1.25733114e+01 2.18926418e-02-7.52538350e-06 1.17205495e-09-6.81446681e-14 2 -2.31696746e+04-4.68044254e+01-1.01277508e+00 5.04683181e-02-3.00502072e-05 3 9.15435582e-09-1.15326683e-12-1.80495698e+04 2.74256872e+01 4 nc3h7 n-l 9/84c 3h 7 0 0g 300.000 5000.00 1000.0 1 0.77026987e 01 0.16044203e-01-0.52833220e-05 0.76298590e-09-0.39392284e-13 2 0.82984336e 04-0.15480180e 02 0.10515518e 01 0.25991980e-01 0.23800540e-05 3 -0.19609569e-07 0.93732470e-11 0.10631863e 05 0.21122559e 02 0.12087447e 05 4 ic8h18 4/85c 8.h 18. 0. 0.g 300.000 5000.00 1000.00 1 0.23503891e 02 0.39657507e-01-0.13128325e-04 0.19592787e-08-0.10658157e-12 2 -0.36518059e 05-0.95243149e 02 0.18952761e 01 0.69645584e-01 0.14661359e-04 3 -0.60905563e-07 0.26589383e-10-0.28789637e 05 0.24422028e 02-0.25107010e 05 4 ic8h16 12/52c 8.h 16. 0. 0.g 300.000 5000.00 1000.00 1 0.20831284e 02 0.38294513e-01-0.12417870e-04 0.17957589e-08-0.93705913e-13 2 -0.20133141e 05-0.79240051e 02 0.26075478e 01 0.64282537e-01 0.92502323e-05 3 -0.51046708e-07 0.23316557e-10-0.13597527e 05 0.21584656e 02-0.99738727e 04 4 ic7h15 10/83c 7h 15 0 0g 200.000 5000.00 1000.00 1 0.12660566e+02 0.47893065e-01-0.19735835e-04 0.37298693e-08-0.26299814e-12 2 -0.64258434e+04-0.34510489e+02 0.10280414e+02 0.70155356e-03 0.15955135e-03 3 -0.20959318e-06 0.83344532e-10-0.36030731e+04-0.10315257e+02 0.52799263e+03 4 ic6h13 10/83c 6h 13 0 0g 300.000 5000.00 1000.00 1 0.12759770e 02 0.37134279e-01-0.14256110e-04 0.25052556e-08-0.16459707e-12 2 -0.35693750e 04-0.36999527e 02 0.23062353e 01 0.50200045e-01 0.79387773e-05 3 -0.41260655e-07 0.18794369e-10 0.10269711e 03 0.20896637e 02 0.30188548e 04 4 c6h12 2/14/95 c 6.h 12.o 0. 0.g 300.000 5000.000 1 1.78337529e+01 2.67377658e-02-9.10036773e-06 1.40819768e-09-8.15124244e-14 2 -1.42062860e+04-6.83818851e+01-1.35275205e+00 6.98655426e-02-4.59408022e-05 3 1.56967343e-08-2.21296175e-12-7.34368617e+03 3.53120691e+01 4 pc4h8 6/83c 4h 8 0 0g 300.000 5000.00 1000.0 1 0.20535841e+01 0.34350507e-01-0.15883197e-04 0.33089662e-08-0.25361045e-12 2 -0.21397231e+04 0.15556360e+02 0.11811380e+01 0.30853380e-01 0.50865247e-05 3 -0.24654888e-07 0.11110193e-10-0.17904004e+04 0.21075639e+02-0.06494670e+03 4 sc4h8 6/83c 4h 8 0 0g 300.000 5000.00 1000.0 1 0.20535841e+01 0.34350507e-01-0.15883197e-04 0.33089662e-08-0.25361045e-12 2 -0.21397231e+04 0.15556360e+02 0.11811380e+01 0.30853380e-01 0.50865247e-05 3 -0.24654888e-07 0.11110193e-10-0.17904004e+04 0.21075639e+02-0.06494670e+03 4 ic7h13 2/10/95 c 7h 13 0 0g 300.000 5000.000 1392.000 1 2.06977799e+01 2.93585249e-02-9.99754351e-06 1.54773305e-09-8.96230815e-14 2 -1.23454647e+03-8.35627043e+01-2.01707658e+00 8.08915559e-02-5.43383904e-05 3 1.88066108e-08-2.66059253e-12 6.81102828e+03 3.89797235e+01 4 pc4h9 1/14/95 thermc 4h 9 0 0g 300.000 5000.000 1395.00 1 1.21510082e+01 1.94310717e-02-6.61577950e-06 1.02375136e-09-5.92529707e-14 2 3.17231942e+03-3.93425822e+01-4.37779725e-01 4.78972364e-02-3.14023159e-05 3 1.09786472e-08-1.62010664e-12 7.68945248e+03 2.86852732e+01 4 sc4h9 1/14/95 thermc 4h 9 0 0g 300.000 5000.000 1373.00 1 1.18293992e+01 1.94203812e-02-6.55835141e-06 1.00989031e-09-5.82693176e-14 2 1.79315973e+03-3.68210535e+01 7.70280143e-01 3.86280904e-02-1.57100260e-05 3 7.16860109e-10 7.00801289e-13 6.28812837e+03 2.49106489e+01 4 tc4h9 9/19/91 thermc 4h 9 0 0g 300.000 5000.000 1381.00 1 9.94382112e+00 2.16693078e-02-7.47001405e-06 1.16578454e-09-6.78791834e-14 2 -4.06100251e+02-2.98153785e+01-2.73729204e+00 4.55390345e-02-2.26390939e-05 3 4.56951052e-09-1.55321795e-13 4.65498223e+03 4.04683378e+01 4 ac8h17 c 8h 17o 0 0g 0300.00 5000.00 1000.00 1 1.65781e+01 4.79568e-02 -1.58330e-05 2.45887e-09 -1.47904e-13 2 -1.13886e+04 -5.77977e+01 -2.45792e+00 1.00416e-01 -5.52412e-05 3 8.18171e-10 7.48841e-12 -6.56307e+03 3.95814e+01 4 bc8h17 c 8h 17o 0 0g 0300.00 5000.00 1000.00 1 1.62241e+01 4.79657e-02 -1.57712e-05 2.44271e-09 -1.46688e-13 2 -1.16619e+04 -5.66316e+01 -2.80712e+00 1.03796e-01 -6.59900e-05 3 1.23120e-08 3.42374e-12 -6.98775e+03 3.99281e+01 4 cc8h17 c 8h 17o 0 0g 0300.00 5000.00 1000.00 1 1.54473e+01 4.88291e-02 -1.61009e-05 2.49663e-09 -1.49924e-13 2 -1.33788e+04 -5.27801e+01 -8.35087e-01 9.07781e-02 -3.96894e-05 3 -1.04780e-08 1.07794e-11 -9.15033e+03 3.11321e+01 4 dc8h17 c 8h 17o 0 0g 0300.00 5000.00 1000.00 1 1.65979e+01 4.79226e-02 -1.58133e-05 2.45430e-09 -1.47533e-13 2 -1.27049e+04 -5.83133e+01 -2.57455e+00 1.01220e-01 -5.71585e-05 3 2.71860e-09 6.82038e-12 -7.85889e+03 3.96706e+01 4 ac7h14 12/52c 7h 14 0 0g 298.150 5000.00 1000.00 1 0.13952881e+02 0.41712158e-01-0.16157950e-04 0.29187538e-08-0.19958112e-12 2 -0.14853311e+05-0.43649205e+02 0.19140427e+01 0.58601697e-01 0.16939333e-05 3 -0.38140418e-07 0.18157007e-10-0.10616395e+05 0.22793909e+02-0.74928962e+04 4 cc7h14 12/52c 7h 14 0 0g 298.150 5000.00 1000.00 1 0.13952881e+02 0.41712158e-01-0.16157950e-04 0.29187538e-08-0.19958112e-12 2 -0.14853311e+05-0.43649205e+02 0.19140427e+01 0.58601697e-01 0.16939333e-05 3 -0.38140418e-07 0.18157007e-10-0.10616395e+05 0.22793909e+02-0.74928962e+04 4 neoc5h11 8/ 8/95 thermc 5h 11 0 0g 300.000 5000.000 1396.00 1 1.66238394e+01 2.27037884e-02-7.71624835e-06 1.19289853e-09-6.90060600e-14 2 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120186n 1 g 0300.00 5000.00 1000.00 1 0.02450268E+02 0.10661458E-03-0.07465337E-06 0.01879652E-09-0.10259839E-14 2 0.05611604E+06 0.04448758E+02 0.02503071E+02-0.02180018E-03 0.05420529E-06 3 -0.05647560E-09 0.02099904E-12 0.05609890E+06 0.04167566E+02 4 no 121286n 1o 1 g 0300.00 5000.00 1000.00 1 0.03245435E+02 0.12691383E-02-0.05015890E-05 0.09169283E-09-0.06275419E-13 2 0.09800840E+05 0.06417293E+02 0.03376541E+02 0.12530634E-02-0.03302750E-04 3 0.05217810E-07-0.02446262E-10 0.09817961E+05 0.05829590E+02 4 no2 121286n 1o 2 g 0300.00 5000.00 1000.00 1 0.04682859E+02 0.02462429E-01-0.10422585E-05 0.01976902E-08-0.13917168E-13 2 0.02261292E+05 0.09885985E+01 0.02670600E+02 0.07838500E-01-0.08063864E-04 3 0.06161714E-07-0.02320150E-10 0.02896290E+05 0.11612071E+02 4 n2o 121286n 2o 1 g 0300.00 5000.00 1000.00 1 0.04718977E+02 0.02873713E-01-0.11974958E-05 0.02250551E-08-0.15753370E-13 2 0.08165811E+05-0.16572504E+01 0.02543057E+02 0.09492193E-01-0.09792775E-04 3 0.06263844E-07-0.01901825E-10 0.08765100E+05 0.09511222E+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 oh rus 78o 1h 1 00 00g 200.000 3500.000 1000.000 1 3.09288767e+00 5.48429716e-04 1.26505228e-07-8.79461556e-11 1.17412376e-14 2 3.85865700e+03 4.47669610e+00 3.99201543e+00-2.40131752e-03 4.61793841e-06 3 -3.88113333e-09 1.36411470e-12 3.61508056e+03-1.03925458e-01 8.81310600e+03 4 o l 1/90o 1 00 00 00g 200.000 3500.000 1000.000 1 2.56942078e+00-8.59741137e-05 4.19484589e-08-1.00177799e-11 1.22833691e-15 2 2.92175791e+04 4.78433864e+00 3.16826710e+00-3.27931884e-03 6.64306396e-06 3 -6.12806624e-09 2.11265971e-12 2.91222592e+04 2.05193346e+00 6.72540300e+03 4 o2 tpis89o 2 00 00 00g 200.000 3500.000 1000.000 1 3.28253784e+00 1.48308754e-03-7.57966669e-07 2.09470555e-10-2.16717794e-14 2 -1.08845772e+03 5.45323129e+00 3.78245636e+00-2.99673416e-03 9.84730201e-06 3 -9.68129509e-09 3.24372837e-12-1.06394356e+03 3.65767573e+00 8.68010400e+03 4 co tpis79c 1o 1 00 00g 200.000 3500.000 1000.000 1 2.71518561e+00 2.06252743e-03-9.98825771e-07 2.30053008e-10-2.03647716e-14 2 -1.41518724e+04 7.81868772e+00 3.57953347e+00-6.10353680e-04 1.01681433e-06 3 9.07005884e-10-9.04424499e-13-1.43440860e+04 3.50840928e+00 8.67100000e+03 4 co2 l 7/88c 1o 2 00 00g 200.000 3500.000 1000.000 1 3.85746029e+00 4.41437026e-03-2.21481404e-06 5.23490188e-10-4.72084164e-14 2 -4.87591660e+04 2.27163806e+00 2.35677352e+00 8.98459677e-03-7.12356269e-06 3 2.45919022e-09-1.43699548e-13-4.83719697e+04 9.90105222e+00 9.36546900e+03 4 ch2o l 8/88h 2c 1o 1 00g 200.000 3500.000 1000.000 1 1.76069008e+00 9.20000082e-03-4.42258813e-06 1.00641212e-09-8.83855640e-14 2 -1.39958323e+04 1.36563230e+01 4.79372315e+00-9.90833369e-03 3.73220008e-05 3 -3.79285261e-08 1.31772652e-11-1.43089567e+04 6.02812900e-01 1.00197170e+04 4 ch4 l 8/88c 1h 4 00 00g 200.000 3500.000 1000.000 1 7.48514950e-02 1.33909467e-02-5.73285809e-06 1.22292535e-09-1.01815230e-13 2 -9.46834459e+03 1.84373180e+01 5.14987613e+00-1.36709788e-02 4.91800599e-05 3 -4.84743026e-08 1.66693956e-11-1.02466476e+04-4.64130376e+00 1.00161980e+04 4 ch3 l11/89c 1h 3 00 00g 200.000 3500.000 1000.000 1 2.28571772e+00 7.23990037e-03-2.98714348e-06 5.95684644e-10-4.67154394e-14 2 1.67755843e+04 8.48007179e+00 3.67359040e+00 2.01095175e-03 5.73021856e-06 3 -6.87117425e-09 2.54385734e-12 1.64449988e+04 1.60456433e+00 1.03663400e+04 4 ch3o 121686c 1h 3o 1 g 0300.00 3000.00 1000.00 1 0.03770799e+02 0.07871497e-01-0.02656384e-04 0.03944431e-08-0.02112616e-12 2 0.12783252e+03 0.02929575e+02 0.02106204e+02 0.07216595e-01 0.05338472e-04 3 -0.07377636e-07 0.02075610e-10 0.09786011e+04 0.13152177e+02 4 ch2co l 5/90c 2h 2o 1 00g 200.000 3500.000 1000.000 1 4.51129732e+00 9.00359745e-03-4.16939635e-06 9.23345882e-10-7.94838201e-14 2 -7.55105311e+03 6.32247205e-01 2.13583630e+00 1.81188721e-02-1.73947474e-05 3 9.34397568e-09-2.01457615e-12-7.04291804e+03 1.22156480e+01 1.17977430e+04 4 ch2 l s/93c 1h 2 00 00g 200.000 3500.000 1000.000 1 2.87410113e+00 3.65639292e-03-1.40894597e-06 2.60179549e-10-1.87727567e-14 2 4.62636040e+04 6.17119324e+00 3.76267867e+00 9.68872143e-04 2.79489841e-06 3 -3.85091153e-09 1.68741719e-12 4.60040401e+04 1.56253185e+00 1.00274170e+04 4 ch tpis79c 1h 1 00 00g 200.000 3500.000 1000.000 1 2.87846473e+00 9.70913681e-04 1.44445655e-07-1.30687849e-10 1.76079383e-14 2 7.10124364e+04 5.48497999e+00 3.48981665e+00 3.23835541e-04-1.68899065e-06 3 3.16217327e-09-1.40609067e-12 7.07972934e+04 2.08401108e+00 8.62500000e+03 4 ch3oh l 8/88c 1h 4o 1 00g 200.000 3500.000 1000.000 1 1.78970791e+00 1.40938292e-02-6.36500835e-06 1.38171085e-09-1.17060220e-13 2 -2.53748747e+04 1.45023623e+01 5.71539582e+00-1.52309129e-02 6.52441155e-05 3 -7.10806889e-08 2.61352698e-11-2.56427656e+04-1.50409823e+00 1.14352770e+04 4 ch2oh gunl93c 1h 3o 1 00g 200.000 3500.000 1000.0 1 3.69266569e+00 8.64576797e-03-3.75101120e-06 7.87234636e-10-6.48554201e-14 2 -3.24250627e+03 5.81043215e+00 3.86388918e+00 5.59672304e-03 5.93271791e-06 3 -1.04532012e-08 4.36967278e-12-3.19391367e+03 5.47302243e+00 1.18339080e+04 4 c2h6 l 8/88c 2h 6 00 00g 200.000 3500.000 1000.000 1 1.07188150e+00 2.16852677e-02-1.00256067e-05 2.21412001e-09-1.90002890e-13 2 -1.14263932e+04 1.51156107e+01 4.29142492e+00-5.50154270e-03 5.99438288e-05 3 -7.08466285e-08 2.68685771e-11-1.15222055e+04 2.66682316e+00 1.18915940e+04 4 c2h5 l12/92c 2h 5 00 00g 200.000 3500.000 1000.000 1 1.95465642e+00 1.73972722e-02-7.98206668e-06 1.75217689e-09-1.49641576e-13 2 1.28575200e+04 1.34624343e+01 4.30646568e+00-4.18658892e-03 4.97142807e-05 3 -5.99126606e-08 2.30509004e-11 1.28416265e+04 4.70720924e+00 1.21852440e+04 4 c2h4 l 1/91c 2h 4 00 00g 200.000 3500.000 1000.000 1 2.03611116e+00 1.46454151e-02-6.71077915e-06 1.47222923e-09-1.25706061e-13 2 4.93988614e+03 1.03053693e+01 3.95920148e+00-7.57052247e-03 5.70990292e-05 3 -6.91588753e-08 2.69884373e-11 5.08977593e+03 4.09733096e+00 1.05186890e+04 4 c2h3 l 2/92c 2h 3 00 00g 200.000 3500.000 1000.000 1 3.01672400e+00 1.03302292e-02-4.68082349e-06 1.01763288e-09-8.62607041e-14 2 3.46128739e+04 7.78732378e+00 3.21246645e+00 1.51479162e-03 2.59209412e-05 3 -3.57657847e-08 1.47150873e-11 3.48598468e+04 8.51054025e+00 1.05750490e+04 4 c2h2 l 1/91c 2h 2 00 00g 200.000 3500.000 1000.000 1 4.14756964e+00 5.96166664e-03-2.37294852e-06 4.67412171e-10-3.61235213e-14 2 2.59359992e+04-1.23028121e+00 8.08681094e-01 2.33615629e-02-3.55171815e-05 3 2.80152437e-08-8.50072974e-12 2.64289807e+04 1.39397051e+01 1.00058390e+04 4 c2h l 1/91c 2h 1 00 00g 200.000 3500.000 1000.000 1 3.16780652e+00 4.75221902e-03-1.83787077e-06 3.04190252e-10-1.77232770e-14 2 6.71210650e+04 6.63589475e+00 2.88965733e+00 1.34099611e-02-2.84769501e-05 3 2.94791045e-08-1.09331511e-11 6.68393932e+04 6.22296438e+00 1.04544720e+04 4 c4h2 p 1/93c 4h 2 0 0g 300.000 3000.000 1 0.86637708e+01 0.67247189e-02-0.23593397e-05 0.37506380e-09-0.22230940e-13 2 0.53252275e+05-0.21093503e+02-0.39201030e+00 0.51937565e-01-0.91737340e-04 3 0.80471986e-07-0.26898218e-10 0.54845266e+05 0.20957794e+02 4 c4h p 1/93c 4h 1 0 0g 300.000 3000.000 1 0.77697593e+01 0.49829976e-02-0.17628546e-05 0.28144284e-09-0.16689869e-13 2 0.94345900e+05-0.14165274e+02 0.13186295e+01 0.38582956e-01-0.71385623e-04 3 0.65356359e-07-0.22617666e-10 0.95456106e+05 0.15567583e+02 4 c4h6 hw /94c 4h 6 0 0g 300.000 3000.000 1 0.88673134e+01 0.14918670e-01-0.31548716e-05-0.41841330e-09 0.15761258e-12 2 0.91338516e+04-0.23328171e+02 0.11284465e+00 0.34369022e-01-0.11107392e-04 3 -0.92106660e-08 0.62065179e-11 0.11802270e+05 0.23089996e+02 4 c3h2 121686c 3h 2 g 0300.00 5000.00 1000.00 1 0.06530853e+02 0.05870316e-01-0.01720777e-04 0.02127498e-08-0.08291910e-13 2 0.05115214e+06-0.01122728e+03 0.02691077e+02 0.01480366e+00-0.03250551e-04 3 -0.08644363e-07 0.05284878e-10 0.05219072e+06 0.08757391e+02 4 c6h5o l12/84c 6h 5o 1 0g 300.000 5000.000 1 0.13833984e 02 0.17618403e-01-0.60696257e-05 0.91988173e-09-0.50449181e-13 2 -0.69212549e 03-0.50392990e 02-0.18219433e 01 0.48122510e-01-0.46792302e-05 3 -0.34018594e-07 0.18649637e-10 0.42429180e 04 0.33526199e 02 0.57367379e 04 4 c6h5oh l 4/84c 6h 6o 1 0g 300.000 5000.000 1 0.14912073e 02 0.18378135e-01-0.61983128e-05 0.91983221e-09-0.49209565e-13 2 -0.18375199e 05-0.55924103e 02-0.16956539e 01 0.52271299e-01-0.72024050e-05 3 -0.35859603e-07 0.20449073e-10-0.13284121e 05 0.32542160e 02-0.11594207e 05 4 c6h6 kee387c 6h 6 g 0300.00 5000.00 1000.00 1 0.12910740e+02 0.01723296e+00-0.05024210e-04 0.05893497e-08-0.01947521e-12 2 0.03664511e+05-0.05002699e+03-0.03138012e+02 0.04723103e+00-0.02962207e-04 3 -0.03262819e-06 0.01718691e-09 0.08890031e+05 0.03657573e+03 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 h2ccch 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 ch2(s) adjnbrc 1h 2 0 0g 300.000 5000.000 1359.000 1 3.09627180e+00 2.80839185e-03-7.13614526e-07 8.42136298e-11-3.84640828e-15 2 5.05739697e+04 4.31392269e+00 3.32340701e+00 2.28062579e-03-2.48156016e-07 3 -1.02065386e-10 2.48826619e-14 5.04954469e+04 3.09401497e+00 4 c2o 121286c 2o 1 g 0300.00 5000.00 1000.00 1 0.04849809e+02 0.02947585e-01-0.01090729e-04 0.01792562e-08-0.01115758e-12 2 0.03282055e+06-0.06453226e+01 0.03368851e+02 0.08241803e-01-0.08765145e-04 3 0.05569262e-07-0.01540009e-10 0.03317081e+06 0.06713314e+02 4 hcoh mar94 c 1h 2o 1 0g 300. 5000. 1398. 1 9.18749272e 00 1.52011152e-03-6.27603516e-07 1.09727989e-10-6.89655128e-15 2 7.81364593e 03-2.73434214e 01-2.82157421e 00 3.57331702e-02-3.80861580e-05 3 1.86205951e-08-3.45957838e-12 1.12956672e 04 3.48487757e 01 4 ch2hco 110393o 1h 3c 2 g 0300.00 5000.00 1000.00 1 0.05975670e+02 0.08130591e-01-0.02743624e-04 0.04070304e-08-0.02176017e-12 2 0.04903218e+04-0.05045251e+02 0.03409062e+02 0.01073857e+00 0.01891492e-04 3 -0.07158583e-07 0.02867385e-10 0.01521477e+05 0.09558290e+02 4 ac3h5 mar97c 3h 5 g 300.00 5000.00 1378.00 1 9.75762472e 00 1.00615154e-02-3.40608453e-06 5.25696641e-10-3.03917313e-14 2 1.52845733e 04-2.86237172e 01 9.73013819e-01 2.81818597e-02-1.62938809e-05 3 3.96194325e-09-2.25704537e-13 1.85230753e 04 1.93201408e 01 4 pc3h5 82489c 3h 5 g 0300.00 4000.00 1000.00 1 0.09209764e+02 0.07871413e-01-0.07724523e-05-0.04497357e-08 0.08377272e-12 2 0.02853967e+06-0.02232370e+03 0.03161863e+02 0.01518100e+00 0.02722659e-04 3 -0.05177112e-07 0.05435286e-12 0.03095548e+06 0.01197973e+03 4 sc3h5 82489c 3h 5 g 0300.00 4000.00 1000.00 1 0.09101018e+02 0.07964168e-01-0.07884945e-05-0.04562036e-08 0.08529212e-12 2 0.02670680e+06-0.02150559e+03 0.03385811e+02 0.01404534e+00 0.03204127e-04 3 -0.03824120e-07-0.09053742e-11 0.02909066e+06 0.01126649e+03 4 ch2chcho mar94 c 3h 4o 1 0g 300.00 5000. 1389. 1 9.95950056e 00 9.86563039e-03-3.42048051e-06 5.35978370e-10-3.13001966e-14 2 -1.27456196e 04-2.82995864e 01 5.80467878e-01 3.16384674e-02-2.27932718e-05 3 8.42301579e-09-1.27327985e-12-9.47146816e 03 2.21264233e 01 4 pc3h4 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 ac3h4 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 ch2chco mar94 c 3h 3o 1 0g 300.00 5000. 1391. 1 9.48105566e 00 7.77714755e-03-2.71155669e-06 4.26495971e-10-2.49722495e-14 2 3.20858016e 03-2.42916680e 01 7.83370450e-01 2.90353899e-02-2.28846927e-05 3 9.25645234e-09-1.52213238e-12 6.13409525e 03 2.20858902e 01 4 ch3chco 11/12/97 c 3h 4o 1 0g 300.000 5000.000 1400.000 11 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 1.71552067e+01 4 chocho therm c 2h 2o 2 0g 300. 5000. 1396. 1 9.75438561e 00 4.97645947e-03-1.74410483e-06 2.75586994e-10-1.61969892e-14 2 -2.95832896e 04-2.48038370e 01 1.88105121e 00 2.36386368e-02-1.83443295e-05 3 6.84842963e-09-9.92733674e-13-2.69280190e 04 1.72994753e 01 4 c2h5oh bur94c 2h 6o 1 0g 300.000 5000.000 1000.000 1 0.65624365e 01 0.15204222e-01-0.53896795e-05 0.86225011e-09-0.51289787e-13 2 -0.31525621e 05-0.94730202e 01 0.48586957e 01-0.37401726e-02 0.69555378e-04 3 -0.88654796e-07 0.35168835e-10-0.29996132e 05 0.48018545e 01 4 c2h4oh mar96c 2h 5o 1 0g 300.000 5000.000 1405.000 1 8.75544496e 00 9.49453147e-03-3.08803575e-06 4.63537621e-10-2.62730044e-14 2 -8.09602047e 03-2.03271929e 01 7.76157606e-01 2.91002514e-02-2.13980569e-05 3 8.16833894e-09-1.25591600e-12-5.46808396e 03 2.21060185e 01 4 ch3choh mar96c 2h 5o 1 0g 300.000 5000.000 1524.000 1 7.95432747e 00 1.05008170e-02-3.50631590e-06 5.36174608e-10-3.07978459e-14 2 -8.62199768e 03-1.90411129e 01 2.10026806e 00 1.92626679e-02-5.17437436e-06 3 -1.96190582e-09 9.36397060e-13-6.12873036e 03 1.40909302e 01 4 ch3ch2o mar96c 2h 5o 1 g 0300.00 5000.00 1405.00 1 8.31182392e 00 1.03426319e-02-3.39186089e-06 5.12212617e-10-2.91601713e-14 2 -6.13097954e 03-2.13985581e 01-2.71296378e-01 2.98839812e-02-1.97090548e-05 3 6.37339893e-09-7.77965054e-13-3.16397196e 03 2.47706003e 01 4 ch2chch2o WJP 11/18/04c 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 6.39142592e+03-2.94665611e+01 1.19822582e+00 3.05579837e-02-1.80630276e-05 3 4.86150033e-09-4.19854562e-13 9.70799566e+03 1.98555652e+01 4 hcooh 103190c 1h 2o 2 g 0300.00 4000.00 1500.00 1 0.07959698e+02 0.03024532e-01-0.03434242e-05-0.01326767e-08 0.02520240e-12 2 -0.05027445e+06-0.01872208e+03 0.09326031e+01 0.01891002e+00-0.01554964e-03 3 0.07290031e-07-0.01483695e-10-0.04760071e+06 0.01950653e+03 4 hoc2h4o2 c 2h 5o 3 0g 300.000 5000. 1395.00 1 9.22339915e 00 1.41346358e-02-4.75283025e-06 7.28795964e-10-4.18969629e-14 2 -2.35984031e 04-1.53847386e 01 3.58811609e 00 2.99414161e-02-2.35156549e-05 3 1.12635525e-08-2.28663686e-12-2.17409435e 04 1.42166729e 01 4 ch3hco 120186c 2o 1h 4 g 0300.00 5000.00 1000.00 1 0.05868650e+02 0.01079424e+00-0.03645530e-04 0.05412912e-08-0.02896844e-12 2 -0.02264569e+06-0.06012946e+02 0.02505695e+02 0.01336991e+00 0.04671953e-04 3 -0.01128140e-06 0.04263566e-10-0.02124589e+06 0.01335089e+03 4 end