THERMO Eli-R1 H 15C 8O 2 0g 300.00 5000.00 1000.00 1 1.92703891E+01 4.95512610E-02-1.94275842E-05 3.48525419E-09-2.34922378E-13 2 -2.56085101E+04-7.80835072E+01-2.42696282E+00 8.36388482E-02 3.30213062E-06 3 -6.24901135E-08 3.05194306E-11-1.82242337E+04 4.06045005E+01 4 Eli-P1 H 14C 8 0 0g 300.00 5000.00 1000.00 1 1.33902030E+01 4.71344609E-02-1.83660991E-05 3.28013507E-09-2.20371473E-13 2 -1.23037177E+04-5.06612383E+01-3.62523520E+00 7.20674060E-02 3.93524162E-06 3 -5.23802414E-08 2.51280732E-11-6.37477312E+03 4.29720910E+01 4 Eli-R2 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.14938631E+01 5.53619643E-02-2.16666300E-05 3.88199811E-09-2.61425457E-13 2 -2.96318548E+04-8.89254231E+01-3.13618694E+00 9.69468986E-02-4.49249094E-06 3 -6.22176970E-08 3.15975801E-11-2.14050851E+04 4.50624291E+01 4 Eli-P2 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.60045655E+01 5.27314990E-02-2.05650678E-05 3.67528413E-09-2.47041690E-13 2 -1.64553271E+04-6.34561866E+01-3.85142285E+00 8.10569588E-02 8.69048363E-06 3 -6.54227112E-08 3.10225189E-11-9.52926260E+03 4.59231538E+01 4 Eli-R3 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.40400298E+01 6.10900579E-02-2.39339402E-05 4.29144501E-09-2.89154611E-13 2 -3.32984243E+04-1.01453631E+02-3.30904416E+00 1.05844135E-01-2.10066212E-07 3 -7.42429495E-08 3.69930541E-11-2.41009348E+04 4.76562490E+01 4 Eli-P3 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.86183581E+01 5.84512847E-02-2.28460343E-05 4.08946697E-09-2.75206497E-13 2 -1.99382392E+04-7.72334064E+01-3.79501812E+00 8.75387523E-02 1.92785699E-05 3 -8.35915299E-08 3.84913637E-11-1.19840637E+04 4.69293745E+01 4 Eli-R4 H 13C 7O 2 0g 300.00 5000.00 1000.00 1 1.66003404E+01 4.36413816E-02-1.70052366E-05 3.03722224E-09-2.04062096E-13 2 -2.37929194E+04-6.31682088E+01-2.66610828E+00 8.30783591E-02-2.56822538E-05 3 -2.47262090E-08 1.59779183E-11-1.76774833E+04 3.99950802E+01 4 Eli-P4 H 12C 7 0 0g 300.00 5000.00 1000.00 1 1.14593101E+01 4.10173606E-02-1.59999777E-05 2.85980219E-09-1.92243072E-13 2 -9.77670175E+03-4.09637331E+01-4.18660604E+00 6.56818286E-02-7.33844638E-07 3 -4.28745656E-08 2.11755790E-11-4.41955111E+03 4.46863773E+01 4 Eli-R5 H 15C 8O 2 0g 300.00 5000.00 1000.00 1 1.88143598E+01 4.98505935E-02-1.95083232E-05 3.49509461E-09-2.35359488E-13 2 -2.34036728E+04-7.44612703E+01-3.22148471E+00 8.53284474E-02 1.83080105E-06 3 -6.25609507E-08 3.09406243E-11-1.59763535E+04 4.57918704E+01 4 Eli-P5 H 14C 8 0 0g 300.00 5000.00 1000.00 1 1.33902030E+01 4.71344609E-02-1.83660991E-05 3.28013507E-09-2.20371473E-13 2 -1.23037177E+04-5.06612383E+01-3.62523520E+00 7.20674060E-02 3.93524162E-06 3 -5.23802414E-08 2.51280732E-11-6.37477312E+03 4.29720910E+01 4 Eli-R6 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.04709796E+01 5.61768713E-02-2.19406001E-05 3.92511659E-09-2.64028710E-13 2 -2.66806566E+04-8.18960203E+01-3.05484413E+00 9.54173104E-02-4.08753121E-06 3 -6.08409641E-08 3.08232382E-11-1.87908077E+04 4.62180639E+01 4 Eli-P6 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.60658957E+01 5.28232904E-02-2.06420493E-05 3.69427700E-09-2.48573817E-13 2 -1.65216256E+04-6.40340158E+01-3.53020085E+00 7.85538694E-02 1.45401905E-05 3 -7.05949592E-08 3.26183943E-11-9.55596070E+03 4.45117849E+01 4 Eli-R7 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.40201458E+01 6.14354496E-02-2.41595328E-05 4.34340664E-09-2.93219088E-13 2 -3.09803285E+04-1.01382068E+02-2.51319675E+00 9.50964313E-02 2.91323664E-05 3 -1.03813479E-07 4.73190615E-11-2.15704139E+04 4.56912878E+01 4 Eli-P7 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.86175483E+01 5.84521928E-02-2.28464298E-05 4.08954305E-09-2.75211879E-13 2 -1.99383060E+04-7.72842339E+01-3.80699411E+00 8.75946673E-02 1.91730698E-05 3 -8.35009196E-08 3.84620738E-11-1.19822105E+04 4.69303676E+01 4 Eli-R8 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.40201458E+01 6.14354496E-02-2.41595328E-05 4.34340664E-09-2.93219088E-13 2 -3.09803285E+04-1.01382068E+02-2.51319675E+00 9.50964313E-02 2.91323664E-05 3 -1.03813479E-07 4.73190615E-11-2.15704139E+04 4.56912878E+01 4 Eli-P8 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.86175483E+01 5.84521928E-02-2.28464298E-05 4.08954305E-09-2.75211879E-13 2 -1.99383060E+04-7.72842339E+01-3.80699411E+00 8.75946673E-02 1.91730698E-05 3 -8.35009196E-08 3.84620738E-11-1.19822105E+04 4.69303676E+01 4 Eli-R9 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.17939165E+01 5.53733548E-02-2.17525254E-05 3.90775096E-09-2.63665931E-13 2 -2.93882502E+04-9.09724184E+01-2.01578532E+00 8.86234808E-02 1.58665235E-05 3 -8.16589688E-08 3.81296313E-11-2.10709507E+04 4.03147067E+01 4 Eli-P9 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.52439104E+01 5.33805042E-02-2.07958916E-05 3.71335927E-09-2.49433410E-13 2 -1.68896430E+04-5.89700005E+01-2.34058046E+00 7.60082945E-02 1.11257168E-05 3 -6.24774296E-08 2.88708331E-11-1.05714770E+04 3.86517536E+01 4 Eli-R10 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.40310892E+01 6.10929088E-02-2.39334683E-05 4.29115475E-09-2.89124883E-13 2 -3.32929881E+04-1.01389869E+02-3.32415019E+00 1.05983415E-01-5.86690020E-07 3 -7.38676600E-08 3.68643823E-11-2.40999744E+04 4.77217361E+01 4 Eli-P10 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.73435941E+01 5.93458513E-02-2.31045327E-05 4.12361237E-09-2.76892878E-13 2 -2.05669565E+04-6.89600167E+01-2.76712637E+00 8.82339384E-02 4.29643154E-06 3 -6.21555713E-08 2.97067612E-11-1.35000723E+04 4.19215674E+01 4 Eli-R11 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.38885610E+01 6.12594706E-02-2.40074384E-05 4.30552847E-09-2.90147654E-13 2 -3.32763232E+04-1.00004032E+02-2.68715291E+00 1.02082739E-01 6.91963222E-06 3 -7.99701107E-08 3.86868193E-11-2.41917314E+04 4.55826509E+01 4 Eli-P11 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.73435941E+01 5.93458513E-02-2.31045327E-05 4.12361237E-09-2.76892878E-13 2 -2.05669565E+04-6.89600167E+01-2.76712637E+00 8.82339384E-02 4.29643154E-06 3 -6.21555713E-08 2.97067612E-11-1.35000723E+04 4.19215674E+01 4 Eli-R12 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.38918972E+01 6.12639125E-02-2.40113201E-05 4.30650101E-09-2.90226836E-13 2 -3.32816408E+04-1.00265604E+02-2.69303815E+00 1.02004701E-01 7.20387286E-06 3 -8.02668737E-08 3.87879389E-11-2.41884771E+04 4.53970903E+01 4 Eli-P12 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.73142524E+01 5.93481763E-02-2.30989201E-05 4.12182045E-09-2.76735354E-13 2 -2.03085556E+04-6.91904206E+01-3.08063208E+00 8.97486893E-02 1.35045660E-06 3 -5.96285544E-08 2.89014423E-11-1.32008822E+04 4.29759960E+01 4 Eli-R13 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.44758064E+01 6.10039164E-02-2.39915269E-05 4.31350096E-09-2.91217618E-13 2 -3.32273455E+04-1.04309185E+02-2.30342708E+00 9.72245050E-02 2.23763576E-05 3 -9.65511513E-08 4.46385539E-11-2.38295864E+04 4.36053594E+01 4 Eli-P13 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.73147221E+01 5.93476494E-02-2.30986905E-05 4.12177629E-09-2.76732230E-13 2 -2.03085153E+04-6.91302779E+01-3.07352930E+00 8.97153746E-02 1.41349847E-06 3 -5.96828062E-08 2.89190039E-11-1.32019778E+04 4.30053814E+01 4 Eli-R14 H 15C 8O 2 0g 300.00 5000.00 1000.00 1 1.91005549E+01 4.92596339E-02-1.91890961E-05 3.42673145E-09-2.30210904E-13 2 -2.72945138E+04-7.73246808E+01-3.36271417E+00 9.45717534E-02-2.62411916E-05 3 -3.30780996E-08 2.03803358E-11-2.01657682E+04 4.30358167E+01 4 Eli-P14 H 14C 8 0 0g 300.00 5000.00 1000.00 1 1.34025489E+01 4.71544596E-02-1.83808743E-05 3.28350667E-09-2.20628177E-13 2 -1.36754816E+04-4.99830211E+01-2.88142615E+00 6.99794659E-02 5.57593996E-06 3 -5.22277649E-08 2.46988957E-11-7.92729472E+03 3.99353294E+01 4 Eli-R15 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.15574984E+01 5.55183286E-02-2.17784084E-05 3.90766188E-09-2.63400831E-13 2 -3.11611474E+04-8.99493223E+01-3.25059280E+00 1.01055267E-01-1.67109707E-05 3 -4.89612189E-08 2.66940826E-11-2.30243574E+04 4.41846065E+01 4 Eli-P15 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.59298276E+01 5.27550283E-02-2.05600246E-05 3.67245551E-09-2.46753151E-13 2 -1.72801117E+04-6.23431626E+01-3.60991321E+00 8.18941965E-02 3.90409902E-06 3 -5.94087055E-08 2.86670566E-11-1.05126731E+04 4.50174144E+01 4 Eli-R16 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.41966654E+01 6.12177358E-02-2.40518135E-05 4.32049254E-09-2.91472977E-13 2 -3.50693767E+04-1.04028093E+02-3.18870400E+00 1.07764823E-01-6.74341519E-06 3 -6.65313521E-08 3.39628870E-11-2.59092322E+04 4.49426509E+01 4 Eli-P16 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.85504820E+01 5.83584707E-02-2.27653218E-05 4.06926128E-09-2.73561765E-13 2 -2.11453996E+04-7.55895508E+01-3.74498282E+00 9.01627904E-02 1.03136724E-05 3 -7.39436115E-08 3.50370898E-11-1.33772603E+04 4.72070909E+01 4 Eli-R17 H 13C 7O 2 0g 300.00 5000.00 1000.00 1 1.66504050E+01 4.38812586E-02-1.71792843E-05 3.07870277E-09-2.07362142E-13 2 -1.97603178E+04-6.41142584E+01-3.21635807E+00 7.66854977E-02-2.17483169E-07 3 -5.43120185E-08 2.71971498E-11-1.31140941E+04 4.40770209E+01 4 Eli-P17 H 12C 7 0 0g 300.00 5000.00 1000.00 1 1.14593101E+01 4.10173606E-02-1.59999777E-05 2.85980219E-09-1.92243072E-13 2 -9.77670175E+03-4.09637331E+01-4.18660604E+00 6.56818286E-02-7.33844638E-07 3 -4.28745656E-08 2.11755790E-11-4.41955111E+03 4.46863773E+01 4 Eli-R18 H 15C 8O 2 0g 300.00 5000.00 1000.00 1 1.92714882E+01 4.95500280E-02-1.94270469E-05 3.48515083E-09-2.34915065E-13 2 -2.56084142E+04-7.77630706E+01-2.41015644E+00 8.35598390E-02 3.45185790E-06 3 -6.26190907E-08 3.05612105E-11-1.82268219E+04 4.08521324E+01 4 Eli-P18 H 14C 8 0 0g 300.00 5000.00 1000.00 1 1.34025489E+01 4.71544596E-02-1.83808743E-05 3.28350667E-09-2.20628177E-13 2 -1.36754816E+04-4.99830211E+01-2.88142615E+00 6.99794659E-02 5.57593996E-06 3 -5.22277649E-08 2.46988957E-11-7.92729472E+03 3.99353294E+01 4 Eli-R19 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.17888353E+01 5.53790433E-02-2.17550010E-05 3.90822685E-09-2.63699583E-13 2 -2.93885851E+04-9.08358185E+01-2.08225899E+00 8.89254865E-02 1.53066900E-05 3 -8.11839465E-08 3.79774097E-11-2.10604709E+04 4.07376090E+01 4 Eli-P19 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.59298276E+01 5.27550283E-02-2.05600246E-05 3.67245551E-09-2.46753151E-13 2 -1.72801117E+04-6.23431626E+01-3.60991321E+00 8.18941965E-02 3.90409902E-06 3 -5.94087055E-08 2.86670566E-11-1.05126731E+04 4.50174144E+01 4 Eli-R20 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.44810248E+01 6.09980725E-02-2.39889831E-05 4.31301190E-09-2.91183033E-13 2 -3.32269838E+04-1.03935801E+02-2.23327840E+00 9.69037180E-02 2.29735889E-05 3 -9.70594409E-08 4.48017940E-11-2.38405975E+04 4.36762944E+01 4 Eli-P20 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.85504820E+01 5.83584707E-02-2.27653218E-05 4.06926128E-09-2.73561765E-13 2 -2.11453996E+04-7.55895508E+01-3.74498282E+00 9.01627904E-02 1.03136724E-05 3 -7.39436115E-08 3.50370898E-11-1.33772603E+04 4.72070909E+01 4 Eli-R21 H 13C 7O 2 0g 300.00 5000.00 1000.00 1 1.64877879E+01 4.37575347E-02-1.70532586E-05 3.04614368E-09-2.04678068E-13 2 -2.37687591E+04-6.39703878E+01-2.90382607E+00 8.39123408E-02-2.73861762E-05 3 -2.30388415E-08 1.53613138E-11-1.76316126E+04 3.97620315E+01 4 Eli-P21 H 12C 7 0 0g 300.00 5000.00 1000.00 1 1.13673290E+01 4.11748165E-02-1.60787195E-05 2.87588263E-09-1.93414908E-13 2 -1.07301292E+04-3.94932843E+01-2.15380448E+00 5.62840326E-02 1.54675410E-05 3 -5.53038720E-08 2.47695727E-11-5.75475981E+03 3.61439404E+01 4 Eli-R22 H 15C 8O 2 0g 300.00 5000.00 1000.00 1 1.91005549E+01 4.92596339E-02-1.91890961E-05 3.42673145E-09-2.30210904E-13 2 -2.72945138E+04-7.73246808E+01-3.36271417E+00 9.45717534E-02-2.62411916E-05 3 -3.30780996E-08 2.03803358E-11-2.01657682E+04 4.30358167E+01 4 Eli-P22 H 14C 8 0 0g 300.00 5000.00 1000.00 1 1.41370800E+01 4.60477578E-02-1.79665294E-05 3.21182518E-09-2.15931906E-13 2 -1.41913760E+04-5.29026756E+01-2.72750703E+00 6.95083924E-02 8.19780361E-06 3 -5.63795411E-08 2.65237560E-11-8.26002849E+03 4.01922597E+01 4 Eli-R23 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.15505572E+01 5.55267454E-02-2.17820941E-05 3.90836184E-09-2.63449544E-13 2 -3.11584886E+04-8.99078073E+01-3.24727844E+00 1.01055675E-01-1.67656746E-05 3 -4.88736881E-08 2.66559272E-11-2.30250333E+04 4.41693755E+01 4 Eli-P23 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.67045494E+01 5.20183441E-02-2.03992160E-05 3.65969550E-09-2.46671853E-13 2 -1.79745949E+04-6.62449933E+01-2.30493023E+00 7.40299282E-02 2.22873235E-05 3 -7.68917048E-08 3.45095918E-11-1.10502420E+04 3.98299689E+01 4 Eli-R24 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.41962351E+01 6.12166099E-02-2.40508960E-05 4.32026253E-09-2.91454100E-13 2 -3.50658361E+04-1.03114257E+02-3.10536945E+00 1.07414015E-01-6.16080939E-06 3 -6.69825665E-08 3.40981938E-11-2.59228112E+04 4.54532198E+01 4 Eli-P24 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.93427805E+01 5.77098083E-02-2.26675230E-05 4.07139746E-09-2.74658778E-13 2 -2.18078172E+04-7.98850193E+01-2.25429042E+00 8.07199848E-02 3.23872530E-05 3 -9.46452031E-08 4.18554286E-11-1.38562639E+04 4.10874382E+01 4 Eli-R25 H 13C 7O 2 0g 300.00 5000.00 1000.00 1 1.61917109E+01 4.41173744E-02-1.72154033E-05 3.07785007E-09-2.06940923E-13 2 -2.18827892E+04-6.17352195E+01-2.50629614E+00 7.89489409E-02-1.50854236E-05 3 -3.49257623E-08 1.94441837E-11-1.57699378E+04 3.92485623E+01 4 Eli-P25 H 12C 7 0 0g 300.00 5000.00 1000.00 1 1.16401872E+01 4.03067097E-02-1.57027620E-05 2.80404902E-09-1.88363722E-13 2 -9.74569920E+03-4.07876174E+01-3.06629591E+00 6.33324884E-02-1.15333316E-06 3 -4.01713577E-08 1.98382812E-11-4.69031948E+03 3.97869082E+01 4 Eli-R26 H 13C 7O 2 0g 300.00 5000.00 1000.00 1 1.62060543E+01 4.41186072E-02-1.72197113E-05 3.07908602E-09-2.07046017E-13 2 -2.21455182E+04-6.16603264E+01-2.49956919E+00 7.89721118E-02-1.51545932E-05 3 -3.48313726E-08 1.94012789E-11-1.60291704E+04 3.93661571E+01 4 Eli-P26 H 12C 7 0 0g 300.00 5000.00 1000.00 1 1.17424803E+01 4.02075980E-02-1.56635562E-05 2.79699199E-09-1.87887647E-13 2 -9.78812974E+03-4.14348148E+01-3.33658377E+00 6.47556181E-02-3.40497556E-06 3 -3.86784954E-08 1.94804066E-11-4.66093684E+03 4.09262628E+01 4 Eli-R27 H 13C 7O 2 0g 300.00 5000.00 1000.00 1 1.62023169E+01 4.41223163E-02-1.72212040E-05 3.07935808E-09-2.07064542E-13 2 -2.21442706E+04-6.16367856E+01-2.48985055E+00 7.89158159E-02-1.50568942E-05 3 -3.49034347E-08 1.94209393E-11-1.60302950E+04 3.93263445E+01 4 Eli-P27 H 12C 7 0 0g 300.00 5000.00 1000.00 1 1.17624762E+01 4.02059066E-02-1.56672916E-05 2.79818926E-09-1.87992937E-13 2 -1.00280425E+04-4.15190085E+01-3.14246052E+00 6.39087724E-02-1.88389796E-06 3 -3.98982376E-08 1.98473717E-11-4.92889795E+03 4.00371432E+01 4 Eli-R28 H 13C 7O 2 0g 300.00 5000.00 1000.00 1 1.61764579E+01 4.41470620E-02-1.72309076E-05 3.08109377E-09-2.07181089E-13 2 -2.21201659E+04-6.15904514E+01-2.50230106E+00 7.90173845E-02-1.54527302E-05 3 -3.44029952E-08 1.92178258E-11-1.60133797E+04 3.92808079E+01 4 Eli-P28 H 12C 7 0 0g 300.00 5000.00 1000.00 1 1.17369406E+01 4.02302488E-02-1.56768057E-05 2.79988656E-09-1.88106669E-13 2 -1.00183158E+04-4.13569664E+01-3.08207378E+00 6.36115734E-02-1.46415190E-06 3 -4.01308644E-08 1.98878354E-11-4.93695197E+03 3.97805198E+01 4 Eli-R29 H 15C 8O 2 0g 300.00 5000.00 1000.00 1 1.91081584E+01 4.94759599E-02-1.93359933E-05 3.46102721E-09-2.32912229E-13 2 -2.56083986E+04-7.70943643E+01-2.53082352E+00 8.51731238E-02-1.28512908E-06 3 -5.81084928E-08 2.91294796E-11-1.83497386E+04 4.08008724E+01 4 Eli-P29 H 14C 8 0 0g 300.00 5000.00 1000.00 1 1.41932501E+01 4.59653284E-02-1.79273322E-05 3.20402097E-09-2.15371823E-13 2 -1.33595625E+04-5.38631274E+01-3.00527583E+00 7.04929553E-02 7.18198814E-06 3 -5.61586397E-08 2.66181962E-11-7.35198723E+03 4.08994666E+01 4 Eli-R30 H 15C 8O 2 0g 300.00 5000.00 1000.00 1 1.91104398E+01 4.94870565E-02-1.93437814E-05 3.46284241E-09-2.33054312E-13 2 -2.58225154E+04-7.70494997E+01-2.52208778E+00 8.51391853E-02-1.24378387E-06 3 -5.80967172E-08 2.91086157E-11-1.85625620E+04 4.08234244E+01 4 Eli-P30 H 14C 8 0 0g 300.00 5000.00 1000.00 1 1.42723720E+01 4.58726630E-02-1.78862751E-05 3.19606606E-09-2.14807279E-13 2 -1.33814264E+04-5.43438948E+01-3.32019360E+00 7.23905418E-02 3.60070055E-06 3 -5.32985439E-08 2.57772706E-11-7.31607045E+03 4.22160651E+01 4 Eli-R31 H 15C 8O 2 0g 300.00 5000.00 1000.00 1 1.91104398E+01 4.94870565E-02-1.93437814E-05 3.46284241E-09-2.33054312E-13 2 -2.58225154E+04-7.70494997E+01-2.52208778E+00 8.51391853E-02-1.24378387E-06 3 -5.80967172E-08 2.91086157E-11-1.85625620E+04 4.08234244E+01 4 Eli-P31 H 14C 8 0 0g 300.00 5000.00 1000.00 1 1.42662468E+01 4.58951349E-02-1.78993474E-05 3.19892386E-09-2.15023892E-13 2 -1.35500323E+04-5.45592953E+01-3.14333393E+00 7.14919202E-02 5.28639428E-06 3 -5.46745752E-08 2.61951504E-11-7.51233214E+03 4.11633885E+01 4 Eli-R32 H 15C 8O 2 0g 300.00 5000.00 1000.00 1 1.91205015E+01 4.94767803E-02-1.93395586E-05 3.46206083E-09-2.33000481E-13 2 -2.58150731E+04-7.65365346E+01-2.58021461E+00 8.55269351E-02-2.07656134E-06 3 -5.73361391E-08 2.88544166E-11-1.85464184E+04 4.16376872E+01 4 Eli-P32 H 14C 8 0 0g 300.00 5000.00 1000.00 1 1.42708514E+01 4.58899712E-02-1.78970978E-05 3.19849112E-09-2.14993278E-13 2 -1.35496473E+04-5.41821286E+01-3.07468445E+00 7.11708615E-02 5.89281616E-06 3 -5.51957893E-08 2.63637206E-11-7.52294298E+03 4.12434230E+01 4 Eli-R33 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.13047824E+01 5.56585644E-02-2.18133355E-05 3.91201574E-09-2.63623294E-13 2 -2.92829565E+04-8.77330132E+01-2.18068313E+00 9.17375154E-02 4.85634771E-06 3 -6.92927602E-08 3.35643513E-11-2.12310353E+04 4.09819932E+01 4 Eli-P33 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.68203448E+01 5.18634993E-02-2.03273872E-05 3.64551006E-09-2.45656345E-13 2 -1.72173510E+04-6.76840735E+01-2.98710614E+00 7.72673351E-02 1.70390793E-05 3 -7.32446243E-08 3.35760352E-11-1.01460159E+04 4.21843032E+01 4 Eli-R34 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.13101163E+01 5.56669082E-02-2.18200699E-05 3.91364388E-09-2.63752821E-13 2 -2.94929924E+04-8.74104798E+01-2.21494707E+00 9.19653089E-02 4.34762837E-06 3 -6.87832296E-08 3.33781997E-11-2.14336816E+04 4.14867560E+01 4 Eli-P34 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.50974326E+01 5.45935464E-02-2.13066135E-05 3.80950169E-09-2.56136523E-13 2 -1.67081940E+04-5.86867617E+01-2.66834828E+00 7.30528888E-02 2.48631578E-05 3 -7.80104572E-08 3.45925901E-11-1.01139239E+04 4.10073387E+01 4 Eli-R35 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.13101163E+01 5.56669082E-02-2.18200699E-05 3.91364388E-09-2.63752821E-13 2 -2.94929924E+04-8.74104798E+01-2.21494707E+00 9.19653089E-02 4.34762837E-06 3 -6.87832296E-08 3.33781997E-11-2.14336816E+04 4.14867560E+01 4 Eli-P35 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.68235655E+01 5.18764421E-02-2.03365535E-05 3.64764667E-09-2.45823390E-13 2 -1.73938047E+04-6.76345898E+01-2.84565715E+00 7.65915331E-02 1.82838832E-05 3 -7.42467024E-08 3.38765001E-11-1.03434436E+04 4.16002137E+01 4 Eli-R36 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.13053830E+01 5.56733071E-02-2.18231451E-05 3.91427129E-09-2.63798945E-13 2 -2.94616027E+04-8.89708891E+01-2.45418523E+00 9.31507861E-02 2.06466686E-06 3 -6.68055897E-08 3.27361880E-11-2.13632299E+04 4.10085907E+01 4 Eli-P36 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.68235655E+01 5.18764421E-02-2.03365535E-05 3.64764667E-09-2.45823390E-13 2 -1.73938047E+04-6.76345898E+01-2.84565715E+00 7.65915331E-02 1.82838832E-05 3 -7.42467024E-08 3.38765001E-11-1.03434436E+04 4.16002137E+01 4 Eli-R37 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.44372916E+01 6.09850882E-02-2.39683623E-05 4.30729274E-09-2.90697352E-13 2 -3.33723179E+04-1.04480352E+02-2.42914144E+00 9.83752494E-02 1.95389500E-05 3 -9.39577830E-08 4.38185771E-11-2.40041066E+04 4.36362354E+01 4 Eli-P37 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.94521173E+01 5.75582875E-02-2.25962884E-05 4.05723400E-09-2.73640820E-13 2 -2.10439142E+04-8.11840423E+01-2.94995790E+00 8.39871898E-02 2.71056204E-05 3 -9.09837132E-08 4.09208605E-11-1.29440407E+04 4.36157979E+01 4 Eli-R38 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.39430617E+01 6.13724634E-02-2.40963200E-05 4.32707092E-09-2.91870410E-13 2 -3.33300696E+04-1.01587825E+02-2.02990421E+00 9.79196726E-02 1.58861257E-05 3 -8.77484062E-08 4.11008237E-11-2.42626051E+04 4.15786811E+01 4 Eli-P38 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.94521173E+01 5.75582875E-02-2.25962884E-05 4.05723400E-09-2.73640820E-13 2 -2.10439142E+04-8.11840423E+01-2.94995790E+00 8.39871898E-02 2.71056204E-05 3 -9.09837132E-08 4.09208605E-11-1.29440407E+04 4.36157979E+01 4 Eli-R39 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.38468127E+01 6.14614799E-02-2.41304321E-05 4.33307599E-09-2.92269065E-13 2 -3.32993754E+04-1.01155767E+02-1.98700958E+00 9.75433353E-02 1.63438317E-05 3 -8.78772618E-08 4.10693567E-11-2.42624154E+04 4.13217014E+01 4 Eli-P39 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.94650207E+01 5.75623597E-02-2.26020511E-05 4.05876841E-09-2.73767643E-13 2 -2.12323549E+04-8.12003050E+01-2.77700567E+00 8.31941223E-02 2.85653939E-05 3 -9.21730395E-08 4.12830636E-11-1.31572743E+04 4.28646393E+01 4 Eli-R40 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.38351155E+01 6.14697722E-02-2.41329946E-05 4.33345555E-09-2.92290999E-13 2 -3.32565974E+04-1.01151443E+02-2.01695740E+00 9.76355133E-02 1.61854946E-05 3 -8.77420662E-08 4.10246289E-11-2.42161669E+04 4.14123356E+01 4 Eli-P40 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.94650207E+01 5.75623597E-02-2.26020511E-05 4.05876841E-09-2.73767643E-13 2 -2.50468343E+04-8.12003050E+01-2.77700567E+00 8.31941223E-02 2.85653939E-05 3 -9.21730395E-08 4.12830636E-11-1.69717537E+04 4.28646393E+01 4 Sci-R1 H 15C 8O 2 0g 300.00 5000.00 1000.00 1 2.15667233E+01 4.67703277E-02-1.83148094E-05 3.28388598E-09-2.21303494E-13 2 -1.74555421E+04-8.88079199E+01-8.36380490E-01 8.27671041E-02 3.50783893E-06 3 -6.36915808E-08 3.12429968E-11-9.90829083E+03 3.34571695E+01 4 Sci-P1 H 14C 8 0 0g 300.00 5000.00 1000.00 1 1.41013421E+01 4.68322836E-02-1.83504861E-05 3.29044004E-09-2.21706991E-13 2 -1.26695711E+04-5.53357070E+01-3.74918415E+00 6.97535278E-02 1.51373158E-05 3 -6.57049801E-08 3.01197549E-11-6.29500234E+03 4.36794397E+01 4 Sci-R2 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.40089011E+01 5.22887265E-02-2.04189032E-05 3.65410655E-09-2.45915783E-13 2 -2.13039483E+04-1.00471014E+02-2.05886794E+00 9.61655181E-02 4.27062537E-07 3 -7.10017701E-08 3.56531006E-11-1.26767238E+04 4.11644222E+01 4 Sci-P2 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.67342919E+01 5.21714495E-02-2.03842466E-05 3.64798634E-09-2.45460452E-13 2 -1.67804730E+04-6.75612289E+01-4.22827079E+00 8.09874435E-02 1.48604421E-05 3 -7.47250593E-08 3.49274200E-11-9.45198023E+03 4.80920937E+01 4 Sci-R3 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.66191866E+01 5.81898923E-02-2.28174816E-05 4.09507423E-09-2.76155487E-13 2 -2.50098359E+04-1.13824327E+02-1.83415036E+00 1.01536446E-01 1.32683868E-05 3 -9.07455067E-08 4.34686302E-11-1.53404918E+04 4.19603574E+01 4 Sci-P3 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.93158429E+01 5.80854807E-02-2.27841175E-05 4.08872772E-09-2.75663205E-13 2 -2.02649762E+04-8.17533046E+01-4.06210497E+00 8.66114294E-02 2.71348590E-05 3 -9.39285033E-08 4.25577339E-11-1.18941420E+04 4.81640419E+01 4 Sci-R4 H 13C 7O 2 0g 300.00 5000.00 1000.00 1 1.84664425E+01 4.09442419E-02-1.58376445E-05 2.81502327E-09-1.88507670E-13 2 -1.49534746E+04-7.28412946E+01-2.55627579E+00 8.98898501E-02-4.16982838E-05 3 -1.18027666E-08 1.22885524E-11-8.65091756E+03 3.80846693E+01 4 Sci-P4 H 12C 7 0 0g 300.00 5000.00 1000.00 1 1.14502360E+01 4.10302966E-02-1.60061847E-05 2.86105503E-09-1.92334142E-13 2 -9.77594040E+03-4.09433293E+01-4.19838927E+00 6.56692122E-02-6.55380134E-07 3 -4.29580560E-08 2.12037495E-11-4.41601884E+03 4.47298649E+01 4 Sci-R5 H 15C 8O 2 0g 300.00 5000.00 1000.00 1 2.01175554E+01 4.79352176E-02-1.87117379E-05 3.34731335E-09-2.25192466E-13 2 -1.65823635E+04-7.88683832E+01-2.17362121E-01 7.73076939E-02 1.09086861E-05 3 -6.75434394E-08 3.19126992E-11-9.54592969E+03 3.29727642E+01 4 Sci-P5 H 14C 8 0 0g 300.00 5000.00 1000.00 1 1.30912799E+01 4.74538750E-02-1.85010211E-05 3.30555563E-09-2.22143720E-13 2 -1.22251315E+04-4.89005604E+01-2.92412636E+00 6.62176860E-02 1.69412715E-05 3 -6.42743502E-08 2.90739678E-11-6.40206124E+03 4.04091943E+01 4 Sci-R6 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.32731216E+01 5.29683803E-02-2.06757561E-05 3.69855255E-09-2.48817184E-13 2 -2.07212247E+04-9.48615155E+01-2.14942103E+00 9.81563016E-02-8.73891803E-06 3 -5.94370145E-08 3.10799909E-11-1.23909202E+04 4.27629647E+01 4 Sci-P6 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.62312320E+01 5.24694381E-02-2.04496256E-05 3.65298408E-09-2.45461846E-13 2 -1.65162381E+04-6.48379808E+01-4.65825582E+00 8.60209343E-02-6.62883439E-07 3 -5.80082809E-08 2.88649299E-11-9.44040209E+03 4.92502167E+01 4 Sci-R7 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.52371364E+01 5.92931309E-02-2.31913213E-05 4.15454274E-09-2.79788151E-13 2 -2.39846898E+04-1.05284713E+02-8.35224521E-01 9.44640347E-02 2.34974422E-05 3 -9.68110097E-08 4.47816796E-11-1.48745248E+04 3.86399199E+01 4 Sci-P7 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.82840202E+01 5.87353836E-02-2.29486230E-05 4.10678149E-09-2.76321443E-13 2 -1.98315734E+04-7.51872858E+01-3.17514198E+00 8.19602524E-02 3.20143772E-05 3 -9.56258248E-08 4.26131199E-11-1.19916253E+04 4.48137160E+01 4 Sci-R8 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.30721256E+01 5.28455050E-02-2.05418547E-05 3.66368139E-09-2.45938623E-13 2 -2.23157471E+04-9.55851422E+01-2.49556748E+00 1.05688961E-01-3.20550919E-05 3 -3.44658881E-08 2.20170406E-11-1.42879799E+04 4.10446782E+01 4 Sci-P8 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.53264321E+01 5.33016657E-02-2.07650326E-05 3.70784851E-09-2.49063882E-13 2 -1.69217607E+04-5.94271896E+01-2.54395934E+00 7.69683692E-02 9.84256627E-06 3 Sci-R9 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.44655870E+01 5.22020170E-02-2.04747879E-05 3.67506403E-09-2.47844378E-13 2 -2.31255831E+04-1.02677914E+02-1.71872621E+00 9.71729069E-02-3.57523546E-06 3 -6.58790657E-08 3.35136533E-11-1.44622370E+04 3.94743597E+01 4 Sci-P9 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.61651997E+01 5.29233430E-02-2.07310849E-05 3.71625404E-09-2.50336579E-13 2 -1.73496176E+04-6.46552498E+01-2.95520941E+00 7.64835077E-02 1.76728156E-05 3 -7.24420247E-08 3.29564092E-11-1.04496088E+04 4.17015498E+01 4 Sci-R10 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.59703759E+01 5.81422119E-02-2.26143908E-05 4.03503374E-09-2.70950037E-13 2 -2.65779910E+04-1.09520151E+02-3.32740201E+00 1.19102342E-01-3.60455002E-05 3 -4.03511332E-08 2.57707194E-11-1.74346924E+04 4.68546237E+01 4 Sci-P10 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.69432988E+01 6.13796540E-02-2.39654597E-05 4.28613270E-09-2.88241445E-13 2 -2.07218865E+04-6.83263628E+01-2.52165773E+00 7.95189132E-02 3.29194487E-05 3 -9.18877191E-08 4.02050433E-11-1.33852941E+04 4.14355578E+01 4 Sci-R11 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.58489556E+01 5.88403141E-02-2.30483300E-05 4.13322968E-09-2.78561524E-13 2 -2.65926227E+04-1.09658803E+02-2.11937932E+00 1.03274712E-01 6.00630706E-06 3 -8.16648124E-08 3.98801160E-11-1.71516317E+04 4.30860051E+01 4 Sci-P11 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.74191178E+01 5.92696618E-02-2.30735185E-05 4.11791317E-09-2.76502486E-13 2 -2.05898876E+04-6.95608483E+01-2.92976183E+00 8.92768899E-02 2.39441742E-06 3 -6.06938134E-08 2.92919922E-11-1.34838422E+04 4.24279657E+01 4 Sci-R12 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.57743323E+01 5.83316405E-02-2.26901030E-05 4.04884219E-09-2.71893286E-13 2 -2.57737317E+04-1.08722151E+02-2.41777962E+00 1.13921688E-01-2.65541438E-05 3 -4.78101020E-08 2.79392129E-11-1.68059620E+04 4.25498428E+01 4 Sci-P12 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.79703850E+01 5.88368909E-02-2.29313375E-05 4.09614262E-09-2.75226184E-13 2 -2.06002471E+04-7.28703465E+01-3.19135505E+00 8.82817899E-02 9.96957263E-06 3 -7.08789923E-08 3.34003195E-11-1.31589095E+04 4.39397781E+01 4 Sci-R13 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.58455178E+01 5.89320745E-02-2.31048082E-05 4.14562236E-09-2.79494812E-13 2 -2.64121164E+04-1.08409863E+02-6.48345768E-01 9.82337696E-02 1.23132934E-05 3 -8.48353142E-08 4.03556754E-11-1.73000403E+04 3.70423915E+01 4 Sci-P13 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.75361880E+01 5.96294031E-02-2.33428196E-05 4.18240962E-09-2.81635680E-13 2 -2.05755865E+04-7.05955860E+01-1.86912960E+00 7.76954782E-02 3.30142364E-05 3 -9.08828901E-08 3.96451877E-11-1.32496494E+04 3.88638931E+01 4 Sci-R14 H 15C 8O 2 0g 300.00 5000.00 1000.00 1 2.01145900E+01 4.74357628E-02-1.83775516E-05 3.26976434E-09-2.19106007E-13 2 -2.01299103E+04-7.96082954E+01-1.88659496E+00 9.44526635E-02-3.31374110E-05 3 Sci-P14 H 14C 8 0 0g 300.00 5000.00 1000.00 1 1.27423693E+01 4.78559746E-02-1.86764784E-05 3.33913818E-09-2.24504503E-13 2 -1.35572005E+04-4.66338763E+01-2.65916171E+00 6.38339657E-02 2.12042616E-05 3 -6.72403189E-08 2.98028505E-11-7.83136283E+03 3.98185016E+01 4 Sci-R15 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.29765099E+01 5.25853980E-02-2.03420055E-05 3.61527331E-09-2.42058682E-13 2 -2.37032376E+04-9.32843694E+01-2.60001305E+00 1.12569830E-01-5.37307157E-05 3 -1.17124285E-08 1.39654041E-11-1.60325992E+04 4.16189521E+01 4 Sci-P15 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.56656598E+01 5.29410969E-02-2.06140141E-05 3.67962196E-09-2.47109278E-13 2 -1.71480813E+04-6.05862835E+01-3.77415930E+00 8.41850566E-02-3.62961849E-06 3 -5.10057210E-08 2.55452756E-11-1.05140136E+04 4.57013234E+01 4 Sci-R16 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.61282862E+01 5.79023546E-02-2.24963225E-05 4.01086595E-09-2.69177630E-13 2 -2.78288895E+04-1.10347947E+02-2.92880014E+00 1.19140246E-01-3.82511973E-05 3 -3.74212809E-08 2.46247767E-11-1.87989925E+04 4.45512186E+01 4 Sci-P16 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.82970913E+01 5.85295681E-02-2.28121881E-05 4.07499553E-09-2.73814008E-13 2 -2.10166899E+04-7.38949434E+01-3.91863176E+00 9.24659466E-02 2.88439670E-06 3 -6.57425892E-08 3.20117141E-11-1.33769221E+04 4.79349938E+01 4 Sci-R17 H 13C 7O 2 0g 300.00 5000.00 1000.00 1 1.84768776E+01 4.16465346E-02-1.63052791E-05 2.92302526E-09-1.96952598E-13 2 -1.44976468E+04-7.20911734E+01-2.07009286E+00 7.82426287E-02-7.42280369E-06 3 -4.67453003E-08 2.44549260E-11-7.75309600E+03 3.91618181E+01 4 Sci-P17 H 12C 7 0 0g 300.00 5000.00 1000.00 1 1.14502360E+01 4.10302966E-02-1.60061847E-05 2.86105503E-09-1.92334142E-13 2 -9.77594040E+03-4.09433293E+01-4.19838927E+00 6.56692122E-02-6.55380134E-07 3 -4.29580560E-08 2.12037495E-11-4.41601884E+03 4.47298649E+01 4 Sci-R18 H 15C 8O 2 0g 300.00 5000.00 1000.00 1 2.10366876E+01 4.68767969E-02-1.82468106E-05 3.25768449E-09-2.18852047E-13 2 -1.96358722E+04-8.52443147E+01-2.33658671E+00 9.28470103E-02-2.05740947E-05 3 -4.11211131E-08 2.37991367E-11-1.22132213E+04 4.01556290E+01 4 Sci-P18 H 14C 8 0 0g 300.00 5000.00 1000.00 1 1.32401448E+01 4.73181907E-02-1.84474921E-05 3.29574404E-09-2.21466208E-13 2 -1.36243443E+04-4.89628509E+01-2.38696586E+00 6.69580946E-02 1.12337269E-05 3 -5.67628688E-08 2.60488465E-11-7.98206917E+03 3.79188575E+01 4 Sci-R19 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.29863134E+01 5.33961857E-02-2.08826740E-05 3.74032286E-09-2.51847706E-13 2 -2.32788264E+04-9.53117308E+01-1.44123497E+00 9.57425472E-02-7.54141634E-06 3 -5.75699459E-08 2.96896212E-11-1.51702715E+04 3.73166548E+01 4 Sci-P19 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.58358098E+01 5.32455966E-02-2.08589743E-05 3.73928979E-09-2.51890079E-13 2 -1.73460288E+04-6.22567964E+01-2.62119525E+00 7.50388972E-02 1.83099352E-05 3 -7.12227755E-08 3.20952280E-11-1.06082134E+04 4.07177805E+01 4 Sci-R20 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.64471812E+01 5.79173877E-02-2.25910314E-05 4.03927753E-09-2.71655125E-13 2 -2.73431787E+04-1.12604053E+02-2.96679858E+00 1.11464960E-01-1.12176647E-05 3 -6.77702295E-08 3.59191749E-11-1.78209508E+04 4.61859073E+01 4 Sci-P20 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.86475785E+01 5.83393855E-02-2.27783357E-05 4.07423618E-09-2.74027221E-13 2 -2.12082659E+04-7.64909158E+01-3.58450223E+00 8.86133126E-02 1.45117674E-05 3 -7.80912963E-08 3.64444544E-11-1.33857949E+04 4.63245283E+01 4 Sci-R21 H 13C 7O 2 0g 300.00 5000.00 1000.00 1 1.89956535E+01 4.10477296E-02-1.60404373E-05 2.87162754E-09-1.93296181E-13 2 -1.49589082E+04-7.48822199E+01-9.62034754E-01 7.85325071E-02-1.37475715E-05 3 -3.83948333E-08 2.11696483E-11-8.49305469E+03 3.27291661E+01 4 Sci-P21 H 12C 7 0 0g 300.00 5000.00 1000.00 1 1.15838953E+01 4.03632218E-02-1.57256741E-05 2.80824617E-09-1.88650525E-13 2 -9.73201521E+03-4.04342874E+01-2.88854693E+00 6.22976723E-02 7.18062981E-07 3 -4.16242131E-08 2.02578698E-11-4.71620423E+03 3.90483785E+01 4 Sci-R22 H 13C 7O 2 0g 300.00 5000.00 1000.00 1 1.91716601E+01 4.06194334E-02-1.58052309E-05 2.82129444E-09-1.89521114E-13 2 -1.52029520E+04-7.58749687E+01-1.71200267E+00 8.26837138E-02-2.10519002E-05 3 -3.33317811E-08 1.99500331E-11-8.62033816E+03 3.59257201E+01 4 Sci-P22 H 12C 7 0 0g 300.00 5000.00 1000.00 1 1.16641878E+01 4.02834385E-02-1.56935395E-05 2.80238570E-09-1.88251311E-13 2 -9.75919427E+03-4.09398999E+01-3.13630891E+00 6.37207535E-02-1.81552243E-06 3 -3.96882515E-08 1.97075876E-11-4.68678294E+03 4.00793461E+01 4 Sci-R23 H 13C 7O 2 0g 300.00 5000.00 1000.00 1 1.91861801E+01 4.06582701E-02-1.58345865E-05 2.82832464E-09-1.90079924E-13 2 -1.53567250E+04-7.61786724E+01-1.60971928E+00 8.19696280E-02-1.94700463E-05 3 -3.46620885E-08 2.03400076E-11-8.76648535E+03 3.53109522E+01 4 Sci-P23 H 12C 7 0 0g 300.00 5000.00 1000.00 1 1.16821077E+01 4.02873163E-02-1.57003888E-05 2.80425448E-09-1.88407184E-13 2 -1.00044243E+04-4.10300480E+01-2.95106057E+00 6.29060397E-02-3.51436929E-07 3 -4.08524310E-08 2.00536638E-11-4.95815361E+03 3.92185086E+01 4 Sci-R24 H 13C 7O 2 0g 300.00 5000.00 1000.00 1 1.92492931E+01 4.05522346E-02-1.57806564E-05 2.81711125E-09-1.89250170E-13 2 -1.54208649E+04-7.65640263E+01-1.86641865E+00 8.36406719E-02-2.27483294E-05 3 -3.20344539E-08 1.95777521E-11-8.79546351E+03 3.63352647E+01 4 Sci-P24 H 12C 7 0 0g 300.00 5000.00 1000.00 1 1.17403752E+01 4.02308886E-02-1.56780757E-05 2.80023923E-09-1.88136367E-13 2 -1.00257759E+04-4.13987326E+01-3.10455371E+00 6.37113879E-02-1.61946319E-06 3 -4.00173719E-08 1.98554034E-11-4.93855568E+03 3.98659813E+01 4 Sci-R25 H 15C 8O 2 0g 300.00 5000.00 1000.00 1 2.16099866E+01 4.69840463E-02-1.84638591E-05 3.31848507E-09-2.24003738E-13 2 -1.86578561E+04-8.90150580E+01-6.23201562E-01 8.31915788E-02 4.37323581E-07 3 -5.90759806E-08 2.91956431E-11-1.11491557E+04 3.23094960E+01 4 Sci-P25 H 14C 8 0 0g 300.00 5000.00 1000.00 1 1.42130430E+01 4.60455468E-02-1.79857082E-05 3.21788538E-09-2.16470789E-13 2 -1.34048153E+04-5.41004749E+01-2.75290131E+00 6.86583634E-02 1.12726719E-05 3 -5.96815208E-08 2.76855625E-11-7.38541393E+03 3.98070085E+01 4 Sci-R26 H 15C 8O 2 0g 300.00 5000.00 1000.00 1 2.17755986E+01 4.62164412E-02-1.80020525E-05 3.21583927E-09-2.16141761E-13 2 -1.87782261E+04-8.87723788E+01-1.78091066E+00 9.07330379E-02-1.44332541E-05 3 -4.79542106E-08 2.63351550E-11-1.12198117E+04 3.80292195E+01 4 Sci-P26 H 14C 8 0 0g 300.00 5000.00 1000.00 1 1.42714881E+01 4.58845728E-02-1.78938940E-05 3.19779899E-09-2.14941641E-13 2 -1.33936365E+04-5.43394713E+01-3.27365239E+00 7.21033880E-02 4.19224283E-06 3 -5.37937281E-08 2.59263797E-11-7.33156369E+03 4.20206382E+01 4 Sci-R27 H 15C 8O 2 0g 300.00 5000.00 1000.00 1 2.17603869E+01 4.62603538E-02-1.80270279E-05 3.22127371E-09-2.16553464E-13 2 -1.88600413E+04-8.93786656E+01-1.76004488E+00 9.05574181E-02-1.41263615E-05 3 -4.81037209E-08 2.63407631E-11-1.13011522E+04 3.72773092E+01 4 Sci-P27 H 14C 8 0 0g 300.00 5000.00 1000.00 1 1.42419903E+01 4.59101364E-02-1.79028628E-05 3.19923953E-09-2.15029290E-13 2 -1.35547882E+04-5.45156208E+01-3.27563150E+00 7.22617353E-02 3.59654837E-06 3 -5.31163056E-08 2.56767137E-11-7.51009694E+03 4.16520839E+01 4 Sci-R28 H 15C 8O 2 0g 300.00 5000.00 1000.00 1 2.16715995E+01 4.63167481E-02-1.80414979E-05 3.22290035E-09-2.16615864E-13 2 -1.88597605E+04-8.81820753E+01-1.46604693E+00 8.90734569E-02-1.16956596E-05 3 -4.98963494E-08 2.68475793E-11-1.13812650E+04 3.66189506E+01 4 Sci-P28 H 14C 8 0 0g 300.00 5000.00 1000.00 1 1.41532137E+01 4.60081874E-02-1.79449888E-05 3.20725339E-09-2.15591314E-13 2 -1.35287152E+04-5.39687723E+01-2.94182800E+00 7.02539945E-02 7.37508107E-06 3 -5.61408090E-08 2.65708513E-11-7.54819271E+03 4.02623342E+01 4 Sci-R29 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.43702823E+01 5.23580550E-02-2.05545988E-05 3.69179816E-09-2.49091911E-13 2 -2.25012816E+04-1.03210360E+02-9.73454598E-01 9.26604280E-02 5.18085882E-06 3 -7.29394636E-08 3.55800758E-11-1.39342504E+04 3.52275683E+01 4 Sci-P29 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.69297223E+01 5.17592805E-02-2.02882797E-05 3.63888258E-09-2.45234436E-13 2 -1.72840608E+04-6.83501445E+01-2.85070972E+00 7.60998673E-02 2.02109300E-05 3 -7.64739697E-08 3.47027828E-11-1.01720612E+04 4.16209959E+01 4 Sci-R30 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.43345884E+01 5.21920101E-02-2.04359933E-05 3.66385847E-09-2.46888484E-13 2 -2.26281348E+04-1.02228710E+02-1.51351886E+00 9.59597764E-02-1.63651309E-06 3 -6.73888826E-08 3.39815484E-11-1.40510576E+04 3.82376081E+01 4 Sci-P30 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.68318578E+01 5.18571818E-02-2.03262330E-05 3.64547587E-09-2.45662646E-13 2 -1.72374859E+04-6.77392651E+01-2.96813373E+00 7.71656582E-02 1.72717701E-05 3 -7.34540739E-08 3.36417486E-11-1.01639206E+04 4.21105238E+01 4 Sci-R31 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.43648544E+01 5.21353819E-02-2.04070021E-05 3.65787321E-09-2.46449544E-13 2 -2.27246295E+04-1.02440940E+02-1.45905933E+00 9.57150918E-02-1.10328173E-06 3 -6.79345973E-08 3.41817350E-11-1.41507299E+04 3.79242668E+01 4 Sci-P31 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.68392035E+01 5.17944197E-02-2.02870939E-05 3.63668031E-09-2.44985781E-13 2 -1.74034672E+04-6.77389304E+01-2.99214578E+00 7.74578171E-02 1.65805772E-05 3 -7.29246537E-08 3.35117775E-11-1.03407650E+04 4.21912403E+01 4 Sci-R32 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.43796243E+01 5.20842342E-02-2.03770435E-05 3.65126839E-09-2.45945329E-13 2 -2.27545926E+04-1.01838724E+02-1.52717350E+00 9.62713434E-02-2.31365712E-06 3 -6.69341013E-08 3.38915245E-11-1.41815238E+04 3.88489823E+01 4 Sci-P32 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.51099188E+01 5.46040919E-02-2.13164813E-05 3.81196234E-09-2.56334710E-13 2 -1.69028204E+04-5.87175040E+01-2.50960978E+00 7.23281434E-02 2.61900771E-05 3 Sci-R33 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.69910639E+01 5.80848444E-02-2.28415552E-05 4.10742291E-09-2.77370241E-13 2 -2.63503007E+04-1.16443428E+02-8.29116019E-01 9.88630732E-02 1.61319563E-05 3 -9.13113345E-08 4.30894157E-11-1.67730472E+04 3.63784324E+01 4 Sci-P33 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.95446838E+01 5.74933313E-02-2.25785571E-05 4.05516295E-09-2.73559867E-13 2 -2.11183715E+04-8.17921468E+01-2.77199051E+00 8.25917647E-02 3.06336069E-05 3 -9.43990356E-08 4.20687468E-11-1.29851944E+04 4.28436655E+01 4 Sci-R34 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.69520438E+01 5.78924256E-02-2.27049736E-05 4.07533205E-09-2.74843379E-13 2 -2.64657740E+04-1.16633805E+02-1.57726969E+00 1.03158252E-01 7.50232968E-06 3 -8.43376473E-08 4.10770521E-11-1.68486118E+04 3.91517262E+01 4 Sci-P34 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.94682449E+01 5.75408219E-02-2.25889259E-05 4.05585505E-09-2.73545295E-13 2 -2.10736809E+04-8.12786934E+01-2.95289167E+00 8.40406824E-02 2.70236489E-05 3 -9.09425621E-08 4.09159253E-11-1.29700601E+04 4.36136242E+01 4 Sci-R35 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.70004379E+01 5.78190290E-02-2.26695098E-05 4.06819703E-09-2.74327442E-13 2 -2.65654490E+04-1.16562437E+02-1.45173961E+00 1.02642552E-01 8.52294157E-06 3 -8.52983239E-08 4.14116141E-11-1.69609836E+04 3.88744380E+01 4 Sci-P35 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.94904742E+01 5.74619270E-02-2.25429161E-05 4.04575824E-09-2.72777390E-13 2 -2.12453768E+04-8.12477437E+01-2.85635429E+00 8.38189886E-02 2.72592237E-05 3 -9.11880661E-08 4.10319635E-11-1.31718191E+04 4.32292279E+01 4 Sci-R36 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.69809393E+01 5.78459598E-02-2.26817595E-05 4.07055414E-09-2.74492150E-13 2 -2.66125531E+04-1.16062003E+02-1.58546930E+00 1.03504905E-01 6.56329776E-06 3 -8.34311879E-08 4.07726179E-11-1.70008549E+04 3.98403523E+01 4 Sci-P36 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.94729472E+01 5.75162828E-02-2.25738805E-05 4.05247519E-09-2.73284550E-13 2 -2.12456327E+04-8.11853958E+01-2.82759889E+00 8.36298381E-02 2.75728228E-05 3 -9.13324061E-08 4.10346144E-11-1.31744645E+04 4.30924876E+01 4 Sci-R37 H 13C 7O 2 0g 300.00 5000.00 1000.00 1 1.95437110E+01 4.01576123E-02-1.55953690E-05 2.78008846E-09-1.86573641E-13 2 -1.67096004E+04-7.86717233E+01-2.52756701E+00 9.02575349E-02-3.86395555E-05 3 -1.69015208E-08 1.44314907E-11-1.00374326E+04 3.80866925E+01 4 Sci-P37 H 12C 7 0 0g 300.00 5000.00 1000.00 1 1.15791283E+01 4.04167557E-02-1.57588254E-05 2.81562072E-09-1.89213028E-13 2 -1.06996203E+04-4.00886900E+01-2.32868315E+00 5.99466535E-02 4.49229856E-06 3 -4.42866530E-08 2.09591102E-11-5.78833308E+03 3.67088313E+01 4 Sci-R38 H 15C 8O 2 0g 300.00 5000.00 1000.00 1 2.21442920E+01 4.57202992E-02-1.77686403E-05 3.16914553E-09-2.12763454E-13 2 -2.04186601E+04-9.17028739E+01-2.44684703E+00 9.78394633E-02-3.14566352E-05 3 -3.19136393E-08 2.09412572E-11-1.28160034E+04 3.92596002E+01 4 Sci-P38 H 14C 8 0 0g 300.00 5000.00 1000.00 1 1.41151114E+01 4.60612737E-02-1.79696921E-05 3.21211040E-09-2.15936984E-13 2 -1.41824401E+04-5.35031924E+01-2.83569234E+00 7.01147206E-02 6.88742418E-06 3 -5.51854775E-08 2.61305901E-11-8.24531496E+03 3.99485158E+01 4 Sci-R39 H 17C 9O 2 0g 300.00 5000.00 1000.00 1 2.45355656E+01 5.20569851E-02-2.03925519E-05 3.65676829E-09-2.46427258E-13 2 -2.42456162E+04-1.04756113E+02-2.26297593E+00 1.03660370E-01-2.06052898E-05 3 -4.88370449E-08 2.75485551E-11-1.56511051E+04 3.93686322E+01 4 Sci-P39 H 16C 9 0 0g 300.00 5000.00 1000.00 1 1.49692460E+01 5.47668474E-02-2.13874144E-05 3.82550775E-09-2.57284704E-13 2 -1.74687432E+04-5.78412758E+01-1.99663741E+00 6.98093585E-02 3.01365944E-05 3 -8.16593359E-08 3.55179845E-11-1.10200014E+04 3.80567762E+01 4 Sci-R40 H 19C 10O 2 0g 300.00 5000.00 1000.00 1 2.70976687E+01 5.78348129E-02-2.26981968E-05 4.07557477E-09-2.74911641E-13 2 -2.81494258E+04-1.17501154E+02-1.91548290E+00 1.08355556E-01-6.33486204E-06 3 -7.02875817E-08 3.60984868E-11-1.85776852E+04 3.98553759E+01 4 Sci-P40 H 18C 10 0 0g 300.00 5000.00 1000.00 1 1.91587704E+01 5.80737873E-02-2.28551676E-05 4.11014688E-09-2.77497015E-13 2 -2.17542521E+04-7.88093571E+01-2.26131241E+00 8.09539348E-02 3.10662550E-05 3 -9.26629110E-08 4.09930089E-11-1.38513563E+04 4.12036607E+01 4 END