H2S C 0 H 2 O 0 S 1 G10.000 3000.000 716.80 1 2.85688665E+00 3.66767061E-03-1.19973443E-06 1.17406150E-10 6.23878876E-15 2 -3.80232974E+03 7.48811047E+00 4.01018842E+00-5.50845332E-04 2.98806996E-06 3 5.37948623E-10-1.64553337E-12-4.02463069E+03 1.91075248E+00 4 CH3SH C 1 H 4 O 0 S 1 G10.000 3000.000 498.42 1 1.86427995E+00 1.56568441E-02-8.17436628E-06 2.09878681E-09-2.12475766E-13 2 -4.01926308E+03 1.58213308E+01 3.94544237E+00 5.72308758E-03 1.35210643E-06 3 1.66015902E-08-2.11525215E-11-4.31079210E+03 6.38669587E+00 4 C2H5SH C 2 H 6 O 0 S 1 G10.000 3000.000 642.21 1 2.09197849E+00 2.60854862E-02-1.41123538E-05 3.74076900E-09-3.89561162E-13 2 -7.59527336E+03 1.66272800E+01 3.80113700E+00 1.54399872E-02 1.07522172E-05 3 -2.20707403E-08 9.65838033E-12-7.81480072E+03 9.13846482E+00 4 CH3C2H2SH C 3 H 6 O 0 S 1 G10.000 3000.000 1303.49 1 5.99975214E+00 2.25584441E-02-1.07912422E-05 2.51909706E-09-2.32324215E-13 2 2.68776197E+03-2.85717010E+00 3.67472270E+00 2.56126941E-02-9.61022495E-06 3 -4.86551425E-10 8.04752525E-13 3.64055017E+03 1.03057222E+01 4 CH2S C 1 H 2 O 0 S 1 G10.000 3000.000 759.56 1 2.24216581E+00 9.38284559E-03-5.18204109E-06 1.39924531E-09-1.47643564E-13 2 1.26727661E+04 1.23583687E+01 4.05806561E+00-3.95098702E-03 2.85968758E-05 3 -3.47846658E-08 1.39131273E-11 1.25056881E+04 4.81316668E+00 4 C2H4S C 2 H 4 O 0 S 1 G10.000 3000.000 574.54 1 1.68544853E+00 2.08431695E-02-1.17294069E-05 3.21964845E-09-3.45491808E-13 2 6.89587998E+03 1.76176253E+01 3.93878449E+00 5.15496804E-03 2.92298090E-05 3 -4.43081385E-08 2.03356646E-11 6.63695811E+03 7.99538694E+00 4 C2H5CHS C 3 H 6 O 0 S 1 G10.000 3000.000 428.06 1 1.35890064E+00 3.25134697E-02-1.87018192E-05 5.22463134E-09-5.68252665E-13 2 3.80967940E+03 2.16009756E+01 3.73226880E+00 2.81553393E-02-6.58729113E-05 3 1.75937337E-07-1.57064433E-10 3.44322752E+03 1.02576326E+01 4 CH3CSCH3 C 3 H 6 O 0 S 1 G10.000 3000.000 453.33 1 1.23433618E+00 3.18963317E-02-1.78700002E-05 4.87372955E-09-5.19215215E-13 2 1.21417662E+03 2.09721388E+01 3.71974466E+00 2.84692647E-02-6.77537259E-05 3 1.68266537E-07-1.40276938E-10 7.98704536E+02 8.85074893E+00 4 C2H3CHS C 3 H 4 O 0 S 1 G10.000 3000.000 566.09 1 1.10359413E+00 3.15816093E-02-2.16036449E-05 6.94066112E-09-8.43067696E-13 2 1.78270186E+04 1.96893888E+01 3.95724074E+00 2.45714035E-03 7.93123056E-05 3 -1.39866527E-07 7.63393208E-11 1.76475089E+04 8.81404737E+00 4 benzenethial C 7 H 6 O 0 S 1 G10.000 3000.000 545.46 1 -9.49650646E-01 6.17943235E-02-4.14006967E-05 1.30438585E-08-1.55933927E-12 2 2.07828510E+04 2.98927675E+01 3.90263612E+00 5.75210348E-03 1.68976410E-04 3 -3.12846363E-07 1.79322860E-10 2.05578597E+04 1.22142838E+01 4 Thiophene C 4 H 4 O 0 S 1 G10.000 3000.000 578.80 1 9.82576892E-01 3.53937861E-02-2.34054772E-05 7.31859838E-09-8.67448189E-13 2 1.22130336E+04 1.81096852E+01 4.21091213E+00-1.88430842E-02 1.99891300E-04 3 -3.45173793E-07 1.92544978E-10 1.23741096E+04 8.91985204E+00 4 CH2OHSH C 1 H 4 O 1 S 1 G10.000 3000.000 489.13 1 6.39865932E+00 1.37343353E-02-8.30106742E-06 2.63468920E-09-3.33641573E-13 2 -2.43405743E+04-5.76817966E+00 3.87238813E+00 8.38981645E-03 8.78344531E-05 3 -2.37085757E-07 1.77743934E-10-2.37823730E+04 7.79281570E+00 4 C2H4OHSH C 2 H 6 O 1 S 1 G10.000 3000.000 465.65 1 7.19515915E+00 2.33265473E-02-1.39461119E-05 4.30352245E-09-5.29071844E-13 2 -2.97517494E+04-9.28863803E+00 3.80096413E+00 1.34905679E-02 1.43345073E-04 3 -4.00717709E-07 3.13467209E-10-2.90129082E+04 9.03137122E+00 4 C2H5CHOHSH C 3 H 8 O 1 S 1 G10.000 3000.000 377.43 1 7.39656321E+00 3.35509350E-02-1.94558612E-05 5.70222837E-09-6.63933485E-13 2 -3.27465544E+04-8.61884971E+00 3.70325221E+00 2.29758243E-02 2.20156462E-04 3 -7.66527451E-07 7.42003521E-10-3.21136403E+04 1.02917715E+01 4 propan-2-ol-2-thiol C 3 H 8 O 1 S 1 G10.000 3000.000 441.08 1 7.90654105E+00 3.34872391E-02-2.01021268E-05 6.13457121E-09-7.41307257E-13 2 -3.55827083E+04-1.27553905E+01 3.72171134E+00 1.95279127E-02 2.03898852E-04 3 -5.99236908E-07 4.93597888E-10-3.47085686E+04 9.73277851E+00 4 C2H3CHOHSH C 2 H 6 O 1 S 1 G10.000 3000.000 462.07 1 8.20781273E+00 2.79755862E-02-1.79367823E-05 5.75385935E-09-7.17598784E-13 2 -1.66770467E+04-1.36461633E+01 3.74181273E+00 1.76383439E-02 1.74679457E-04 3 -5.01634564E-07 3.97961761E-10-1.57412449E+04 1.01119409E+01 4 PhCHOHSH C 7 H 8 O 1 S 1 G10.000 3000.000 477.57 1 5.07230949E+00 6.13386870E-02-4.05439686E-05 1.28463059E-08-1.55467494E-12 2 -1.36603279E+04 1.63977166E+00 3.71737371E+00 1.87410812E-02 2.62689607E-04 3 -6.46982114E-07 4.67672280E-10-1.29157255E+04 1.36159834E+01 4 CHOHOHSH C 1 H 4 O 2 S 1 G10.000 3000.000 348.40 1 5.51836825E+00 2.11227783E-02-1.40356285E-05 4.50143493E-09-5.50869547E-13 2 -4.73910786E+04 1.68938079E+00 3.78288335E+00 1.85699868E-02 9.37299412E-05 3 -3.86884893E-07 4.13168031E-10-4.71337255E+04 1.01900419E+01 4 CH3COHOHSH C 2 H 6 O 2 S 1 G10.000 3000.000 304.68 1 6.72824842E+00 2.92312927E-02-1.83991266E-05 5.71716765E-09-6.87780496E-13 2 -5.37972038E+04-3.51112533E+00 3.65106642E+00 3.19619150E-02 1.53606372E-04 3 -7.76425924E-07 9.74043423E-10-5.34348562E+04 1.05464746E+01 4 C2H5COHOHSH C 3 H 8 O 2 S 1 G10.000 3000.000 663.62 1 6.81240545E+00 3.90039090E-02-2.28253533E-05 6.50216529E-09-7.19939908E-13 2 -5.70822776E+04-1.97352772E+00 3.25793414E+00 6.12076479E-02-7.47739064E-05 3 6.04580646E-08-2.17126526E-11-5.66276673E+04 1.35880058E+01 4 2-DHTPO C 4 H 6 O 1 S 1 G10.000 3000.000 531.94 1 2.07140893E+00 4.52057194E-02-2.96480901E-05 9.31037640E-09-1.11700269E-12 2 -1.31203490E+04 1.51298570E+01 3.88574260E+00 6.96024387E-03 1.47573394E-04 3 -2.99740588E-07 1.84991210E-10-1.29652935E+04 1.07937614E+01 4 3-DHTPO C 4 H 6 O 1 S 1 G10.000 3000.000 575.88 1 2.61701413E+00 4.51253893E-02-3.05249099E-05 9.90943072E-09-1.22470302E-12 2 -1.29591023E+04 1.16483467E+01 3.87508496E+00 7.25976084E-03 1.43970820E-04 3 -2.79921063E-07 1.62722190E-10-1.26210106E+04 1.04666310E+01 4 CHOSH C 1 H 2 O 1 S 1 G10.000 3000.000 378.64 1 3.38745238E+00 1.37917782E-02-8.74160800E-06 2.60915841E-09-2.99829094E-13 2 -1.70443158E+04 9.39126114E+00 3.96662538E+00 2.49442945E-03 5.65299573E-05 3 -1.48437257E-07 1.23280815E-10-1.70510513E+04 7.64979334E+00 4 CHOHS C 1 H 2 O 1 S 1 G10.000 3000.000 660.92 1 1.71372286E+00 1.74228441E-02-1.12062179E-05 3.31618443E-09-3.72592354E-13 2 -1.56726820E+04 1.67986908E+01 4.04884185E+00-3.80168402E-03 5.30596829E-05 3 -7.77436927E-08 3.64302051E-11-1.58264505E+04 7.67193536E+00 4 CH3COSH C 2 H 4 O 1 S 1 G10.000 3000.000 393.84 1 3.31364013E+00 2.49207898E-02-1.56243043E-05 4.70299635E-09-5.46617452E-13 2 -2.37168531E+04 1.12292133E+01 3.91962061E+00 5.94794092E-03 1.05457407E-04 3 -2.82897395E-07 2.34474086E-10-2.36651738E+04 1.01324479E+01 4 CH3COHS C 2 H 4 O 1 S 1 G10.000 3000.000 759.27 1 1.50583617E+00 2.78145247E-02-1.66379206E-05 4.68030238E-09-5.06287288E-13 2 -2.21389852E+04 1.94789878E+01 3.87746964E+00 9.81428616E-03 2.98005265E-05 3 -4.56452184E-08 1.92088433E-11-2.23404211E+04 9.73549501E+00 4 C2H5COSH C 3 H 6 O 1 S 1 G10.000 3000.000 840.52 1 4.53266618E+00 3.20002257E-02-1.81661407E-05 4.96235671E-09-5.27295877E-13 2 -2.70316429E+04 7.07476472E+00 3.45535891E+00 3.96768742E-02-3.64163612E-05 3 2.30469126E-08-6.97978680E-12-2.69406106E+04 1.15491987E+01 4 C2H5COHS C 3 H 6 O 1 S 1 G10.000 3000.000 1080.17 1 5.37087202E+00 2.96789094E-02-1.56482479E-05 3.94683527E-09-3.87969227E-13 2 -2.66434852E+04 9.38461048E-01 3.78237336E+00 2.38390478E-02 8.73962534E-06 3 -2.11516677E-08 7.74617928E-12-2.56164524E+04 1.18900734E+01 4 COSHOH C 1 H 2 O 2 S 1 G10.000 3000.000 525.98 1 3.35810906E+00 2.26479454E-02-1.68419246E-05 5.53865716E-09-6.72482837E-13 2 -4.69190627E+04 9.73720055E+00 3.93069770E+00 4.29280930E-03 7.54313015E-05 3 -1.62023082E-07 1.03024322E-10-4.67856301E+04 9.18368885E+00 4 CSOHOH C 1 H 2 O 2 S 1 G10.000 3000.000 635.34 1 4.02173108E+00 2.29797057E-02-1.84597255E-05 6.53909205E-09-8.47376264E-13 2 -4.45699023E+04 4.38052286E+00 3.92355597E+00 4.19506675E-03 7.16981071E-05 3 -1.36130935E-07 7.42055542E-11-4.41658226E+04 7.89147211E+00 4 COS C 1 H 0 O 1 S 1 G10.000 3000.000 591.44 1 3.48914526E+00 6.84415846E-03-5.00345840E-06 1.68678536E-09-2.12569587E-13 2 -1.89218936E+04 6.08716177E+00 3.47654013E+00 1.34764644E-03 2.30928894E-05 3 -4.59397461E-08 2.66637273E-11-1.88227759E+04 6.96667882E+00 4 CH3SCH2OH C 2 H 6 O 1 S 1 G10.000 3000.000 526.85 1 6.91416389E+00 2.53289501E-02-1.65548222E-05 5.46775499E-09-6.99240288E-13 2 -2.68540169E+04-8.18602670E+00 3.82401106E+00 1.10054505E-02 1.31804807E-04 3 -3.18394319E-07 2.17576501E-10-2.60040157E+04 9.71858660E+00 4 CH3OCH2SH C 2 H 6 O 1 S 1 G10.000 3000.000 357.30 1 5.47329228E+00 2.56584187E-02-1.46727559E-05 4.20555636E-09-4.78554423E-13 2 -2.23615386E+04 4.84919704E-01 3.81980189E+00 1.43514923E-02 1.57974547E-04 3 -5.51490886E-07 5.51759054E-10-2.20530465E+04 9.42380768E+00 4 CH3SCH2OCH3 C 3 H 8 O 1 S 1 G10.000 3000.000 625.39 1 3.99498945E+00 3.89087098E-02-2.20587879E-05 6.12988425E-09-6.66403766E-13 2 -2.43868762E+04 8.60940600E+00 3.46542749E+00 4.47840721E-02-4.21190303E-05 3 3.38762278E-08-1.43012798E-11-2.43692994E+04 1.05266351E+01 4 HCOSCH3 C 2 H 4 O 1 S 1 G10.000 3000.000 275.04 1 2.63953642E+00 2.42379915E-02-1.36950098E-05 3.69480457E-09-3.87504323E-13 2 -1.85468674E+04 1.41444335E+01 3.93182576E+00 5.44368178E-03 8.88050842E-05 3 -2.44755555E-07 2.25444903E-10-1.86179532E+04 9.57802898E+00 4 HCSOCH3 C 2 H 4 O 1 S 1 G10.000 3000.000 876.30 1 2.13313864E+00 2.46623305E-02-1.38219987E-05 3.70748491E-09-3.86406271E-13 2 -1.15004649E+04 1.63369562E+01 3.91221025E+00 8.86600271E-03 2.63557534E-05 3 -3.68541899E-08 1.40370699E-11-1.15175645E+04 9.67039136E+00 4 CH3COSCH3 C 3 H 6 O 1 S 1 G10.000 3000.000 1170.20 1 9.15079466E+00 2.24278328E-02-1.05902361E-05 2.37176607E-09-2.05518940E-13 2 -2.93468087E+04-2.01520053E+01 3.99124738E+00 2.36352221E-02 8.92141786E-06 3 -2.07416548E-08 7.29554828E-12-2.70143963E+04 1.03571025E+01 4 CH3CSOCH3 C 3 H 6 O 1 S 1 G10.000 3000.000 549.25 1 2.25103461E-01 4.04379658E-02-2.36920567E-05 6.55934518E-09-7.01068105E-13 2 -1.98910834E+04 2.78382890E+01 3.59932953E+00 3.48312666E-02-6.01776811E-05 3 1.13714929E-07-7.80908680E-11-2.05478324E+04 1.09770761E+01 4 C2H5SCOCH3 C 4 H 8 O 1 S 1 G10.000 3000.000 406.00 1 7.43858789E-01 5.28272079E-02-3.27763045E-05 9.66007194E-09-1.09279234E-12 2 -3.00619034E+04 2.67911349E+01 3.41027699E+00 6.15389214E-02-1.94203188E-04 3 4.86942695E-07-4.25657043E-10-3.05667355E+04 1.27800318E+01 4 SH C 0 H 1 O 0 S 1 G10.000 3000.000 737.36 1 3.13019367E+00 6.94983601E-04 1.44924133E-07-1.58839540E-10 2.65172882E-14 2 1.62022877E+04 5.10110574E+00 3.49626925E+00 3.28134134E-04-2.40235371E-06 3 5.12201309E-09-2.77355533E-12 1.61042887E+04 3.14808782E+00 4 CH3SJ C 1 H 3 O 0 S 1 G10.000 3000.000 741.81 1 1.69799326E+00 1.16434334E-02-6.00267356E-06 1.52746961E-09-1.53737409E-13 2 1.34250335E+04 1.58608594E+01 4.05229417E+00-3.55395902E-03 2.97879185E-05 3 -3.51852668E-08 1.37515618E-11 1.31445987E+04 5.66995297E+00 4 CH3CHJSH C 2 H 5 O 0 S 1 G10.000 3000.000 438.47 1 2.54526054E+00 2.29734770E-02-1.29866566E-05 3.57355358E-09-3.83760160E-13 2 1.35795837E+04 1.60361364E+01 3.74178997E+00 2.65923182E-02-7.50879697E-05 3 1.73592256E-07-1.40424964E-10 1.33349383E+04 9.65684361E+00 4 C2H4CHS C 3 H 5 O 0 S 1 G10.000 3000.000 962.93 1 3.53875844E+00 2.48877267E-02-1.32628184E-05 3.43678927E-09-3.48950953E-13 2 1.67717482E+04 9.53546434E+00 3.80741477E+00 1.74132957E-02 8.28533965E-06 3 -1.83391960E-08 7.08501436E-12 1.70147946E+04 9.78017795E+00 4 C2H5CJS C 3 H 5 O 0 S 1 G10.000 3000.000 403.38 1 2.02768264E+00 2.75719655E-02-1.54689108E-05 4.17662674E-09-4.37699429E-13 2 2.38441849E+04 1.99185775E+01 3.56160906E+00 4.87718338E-02-2.29697879E-04 3 5.82001526E-07-4.97235507E-10 2.34242054E+04 1.02390566E+01 4 CH2OHSJ C 1 H 3 O 1 S 1 G10.000 3000.000 578.68 1 2.73702974E+00 1.79391672E-02-1.18513086E-05 3.79298065E-09-4.64438307E-13 2 -5.60502382E+03 1.36489641E+01 3.96701987E+00 1.88946711E-03 4.93157258E-05 3 -8.92137633E-08 4.94536405E-11-5.62100461E+03 9.47969945E+00 4 CH3CHOHSJ C 2 H 5 O 1 S 1 G10.000 3000.000 407.06 1 3.13167095E+00 2.84222938E-02-1.79968082E-05 5.52619476E-09-6.52684103E-13 2 -1.06605439E+04 1.22194915E+01 3.90309507E+00 7.16661107E-03 1.10723023E-04 3 -2.87819731E-07 2.30198362E-10-1.06100509E+04 1.05828177E+01 4 CH3CJOHSH C 2 H 5 O 1 S 1 G10.000 3000.000 298.11 1 5.09971831E+00 2.58833826E-02-1.67621693E-05 5.23528969E-09-6.27451070E-13 2 -9.04593243E+03 3.39721622E+00 3.78782287E+00 1.93091331E-02 1.37965308E-04 3 -6.12816872E-07 7.45805573E-10-8.86028069E+03 9.94046336E+00 4 C2H5CHOHSJ C 3 H 7 O 1 S 1 G10.000 3000.000 109.21 1 3.19374890E+00 3.93435735E-02-2.41392135E-05 7.14365992E-09-8.14995369E-13 2 -1.40882743E+04 1.24318789E+01 3.88692983E+00 1.39543503E-02 3.24586113E-04 3 -2.12165725E-06 4.87242583E-09-1.41034146E+04 1.06227271E+01 4 C2H5CJOHSH C 3 H 7 O 1 S 1 G10.000 3000.000 407.31 1 5.55911757E+00 3.66074864E-02-2.40050252E-05 7.64508619E-09-9.30913364E-13 2 -1.23624500E+04 2.04352579E+00 3.74950099E+00 1.88606807E-02 1.72156269E-04 3 -5.27522693E-07 4.58959219E-10-1.19204143E+04 1.27652142E+01 4 CCJCOHSH C 3 H 7 O 1 S 1 G10.000 3000.000 353.96 1 6.49972167E+00 3.40830074E-02-2.16988445E-05 6.79211656E-09-8.20492267E-13 2 -8.93490731E+03-1.93067082E+00 3.68964598E+00 2.55343066E-02 1.85331949E-04 3 -7.04844335E-07 7.29024860E-10-8.48349627E+03 1.22743845E+01 4 CHOSJ C 1 H 1 O 1 S 1 G10.000 3000.000 372.36 1 3.28870521E+00 9.57679847E-03-6.03880302E-06 1.81004976E-09-2.07951209E-13 2 2.59553327E+03 1.09585894E+01 3.97245106E+00 2.23173320E-03 2.35500334E-05 3 -5.11657590E-08 3.53599773E-11 2.54461382E+03 8.33538573E+00 4 CH3COSJ C 2 H 3 O 1 S 1 G10.000 3000.000 790.78 1 3.53941497E+00 1.90515543E-02-1.08881489E-05 3.00612369E-09-3.22512193E-13 2 -4.89207138E+03 1.10812231E+01 3.87394801E+00 1.18860972E-02 1.30858928E-05 3 -2.59579347E-08 1.16014398E-11-4.77384987E+03 1.06278585E+01 4 C2H5COSJ C 3 H 5 O 1 S 1 G10.000 3000.000 454.84 1 3.15739608E+00 3.04228778E-02-1.74971509E-05 4.87574726E-09-5.28726305E-13 2 -7.81189526E+03 1.52553603E+01 3.51451265E+00 4.77207663E-02-1.41946843E-04 3 2.86078868E-07-2.09392667E-10-8.05579547E+03 1.14897652E+01 4