long CVT Temperature = (300,400,500,600,700,800,900,1000,1500,2000,2500,3000) Symmetry = (6,1) Srange=(-0.1,0.3) NAME C2H6 FORMULA C2H6 PHASE = (gas) SCALING_FACTOR 0.97 ENERGY_LEVEL = (-79.7698499,1) COORDINATES C -0.759356 0.000003 0.000000 C 0.759358 0.000000 0.000001 H -1.159325 -1.001357 -0.187636 H -1.159326 0.338175 0.961014 H -1.159333 0.663175 -0.773373 H 1.159345 1.001358 0.187600 H 1.159316 -0.663156 0.773396 H 1.159313 -0.338217 -0.961004 FREQUENCY 326.6860 846.5061 846.6226 1050.3007 1252.6109 1252.7937 1437.4477 1468.6508 1527.7376 1527.9160 1530.3262 1530.6692 3117.7315 3122.4728 3178.9439 3179.0033 3203.1121 3203.1764 NAME O.COM FORMULA O(3) PHASE = (gas) SCALING_FACTOR 0.97 ENERGY_LEVEL = (-75.0519303,3) COORDINATES O 0.000000 0.000000 0.000000 NAME TSC2.COM FORMULA C2H6O(3) PHASE = (gas) SCALING_FACTOR 0.97 ENERGY_LEVEL = (-154.8011762,3) COORDINATES C -1.329818 -0.465962 0.000001 C -0.407636 0.716790 -0.000003 H -1.181395 -1.089019 0.885678 H -2.376811 -0.136276 -0.001053 H -1.179955 -1.090188 -0.884615 H -0.413967 1.326615 -0.904735 H -0.414299 1.326880 0.904543 H 0.819252 0.248304 0.000114 O 1.896487 -0.261410 0.000010 FREQUENCY -1888.2478 124.0263 158.6877 446.0361 559.6732 834.8203 842.4836 1043.0761 1125.5356 1204.4203 1255.6429 1265.2738 1437.5438 1497.0172 1505.0658 1518.1867 3107.5129 3170.2939 3182.7732 3210.6690 3257.9957 NAME C2R.COM FORMULA C2H5(2) PHASE = (gas) SCALING_FACTOR 0.97 ENERGY_LEVEL = (-79.1100635,2) COORDINATES C 0.012218 -0.691750 0.000000 H -1.011514 -1.100047 0.000000 H 0.509767 -1.098410 0.886315 H 0.509767 -1.098410 -0.886315 C 0.012218 0.792177 0.000000 H -0.077320 1.347153 0.927926 H -0.077320 1.347153 -0.927926 FREQUENCY 133.7525 467.4982 826.6701 1004.7640 1104.7629 1223.9968 1431.1746 1493.0136 1507.2783 1511.7761 3055.7395 3143.5156 3190.0482 3231.0052 3339.7800 NAME OH.COM FORMULA HO(2) PHASE = (gas) SCALING_FACTOR 0.97 ENERGY_LEVEL = (-75.7035441,2) COORDINATES O 0.000000 0.000000 0.107730 H 0.000000 0.000000 -0.861841 FREQUENCY 3821.3431 S -1.4899 FORMULA C2H6O PHASE = (gas) SCALING_FACTOR 0.97 ENERGY_LEVEL = (-154.815753,3) COORDINATES C -1.314806E0 -5.29094E-1 7.313019E-4 C -4.843977E-1 7.355717E-1 7.380481E-4 H -2.386117E0 -3.079404E-1 -1.335668E-2 H -1.091205E0 -1.137147E0 -8.817626E-1 H -1.114753E0 -1.142758E0 8.84026E-1 H -6.669266E-1 1.350568E0 -8.857537E-1 H -6.67525E-1 1.350938E0 8.868497E-1 H 5.858426E-1 5.275993E-1 1.251459E-3 O 2.016988E0 -2.350157E-1 -8.785815E-6 HESSIAN 5.74830716E-01 -3.45964297E-02 5.44726763E-01 -2.23422879E-04 -3.22201113E-03 5.99751774E-01 -1.24857124E-01 -7.13407347E-02 -3.91017866E-04 5.63047401E-01 -7.16757746E-02 -1.91150742E-01 -7.69418031E-05 -2.51965183E-02 5.40950704E-01 -1.97717969E-04 4.37753544E-05 -8.45706257E-02 4.11343942E-04 3.85631198E-04 5.95608822E-01 -3.16621028E-01 5.92607586E-02 -3.54962983E-03 -1.69541826E-02 4.57227317E-03 -1.26011587E-04 3.43279014E-01 6.06467627E-02 -6.26308667E-02 8.77863712E-04 -3.03603382E-02 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-5.64397308E-06 -6.13661207E-04 3.12612118E-05 6.22415656E-06 1.27983258E-03 -1.27664917E-06 -4.41473716E-07 1.74502339E-04 2.54132986E-04 1.17487953E-04 1.70266841E-04 -2.43228292E-04 -1.05111266E-04 1.74570361E-04 5.66923797E-05 -1.44167660E-04 -4.33149702E-05 -6.33658564E-05 1.30352635E-04 -3.88724695E-05 2.00961033E-05 -5.97984123E-06 3.75346151E-03 -4.03709637E-05 7.27946893E-06 -4.85678499E-03 GRADIENT -1.75740602E-03 2.27518638E-03 1.78364769E-03 1.13822610E-02 -7.28088116E-03 -1.02907048E-03 1.68371555E-04 -6.71397793E-04 -1.04899577E-04 7.28856821E-04 6.81587940E-04 -5.78029539E-04 -1.94354112E-04 -1.01144839E-04 -5.48351937E-05 1.58289417E-03 -3.77880959E-04 -3.73510951E-05 1.45441970E-03 -6.79250120E-04 7.14870621E-05 8.76382067E-04 -1.33550280E-03 -7.91211543E-05 -1.42414252E-02 7.48928335E-03 2.81722946E-05 S -0.9609 FORMULA C2H6O PHASE = (gas) SCALING_FACTOR 0.97 ENERGY_LEVEL = (-154.812065,3) COORDINATES C -1.322122E0 -5.012303E-1 -1.622346E-16 C -4.37259E-1 7.217959E-1 -8.984025E-6 H -1.146389E0 -1.121837E0 8.835135E-1 H -2.379754E0 -2.181214E-1 -9.417965E-4 H -1.145049E0 -1.122807E0 -8.825606E-1 H -5.68264E-1 1.344646E0 -8.896182E-1 H -5.688321E-1 1.345087E0 8.892069E-1 H 6.188821E-1 4.39166E-1 4.641E-4 O 1.968211E0 -2.486909E-1 3.798979E-16 HESSIAN 5.66756167E-01 -3.34569420E-02 5.51291894E-01 -6.73458177E-06 2.81590305E-06 6.02223037E-01 -1.30634680E-01 -7.74035806E-02 7.13750602E-06 5.39772336E-01 -7.77320451E-02 -1.85704131E-01 1.47387691E-05 -1.93138774E-02 5.44506443E-01 1.71985468E-06 -7.23044340E-07 -8.51499993E-02 -9.63980775E-06 -1.21628971E-05 5.98849254E-01 -5.77130971E-02 2.78661483E-02 -4.05719442E-02 3.32133945E-03 -1.26235616E-02 1.92392932E-02 5.89060244E-02 2.61448181E-02 -1.36817532E-01 1.25672645E-01 6.05975161E-03 -1.57432854E-02 2.38501693E-02 -2.57965565E-02 1.48655940E-01 -3.86287772E-02 1.27536985E-01 -2.35722504E-01 2.35397651E-04 -1.77501767E-03 1.60495467E-03 4.30483601E-02 -1.39598792E-01 2.51344266E-01 -3.06606997E-01 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1.42202176E-04 -2.23070813E-04 -6.41746620E-05 -1.45681656E-04 2.19764308E-04 -6.33525045E-05 1.08036019E-06 4.13253975E-06 4.59183333E-03 -1.12110102E-05 5.42186674E-07 -6.56978562E-03 GRADIENT 2.18628790E-03 8.62518852E-04 1.65209290E-06 1.16118648E-02 -7.47219159E-03 -4.37667476E-06 -9.39296488E-05 2.01051751E-06 3.03029709E-06 3.19033602E-04 5.91523983E-04 -1.65441862E-06 -9.32567524E-05 -4.14219684E-07 -1.64438012E-06 2.30496980E-03 -5.38252951E-04 -1.14168359E-04 2.31460056E-03 -5.43243415E-04 1.19329862E-04 6.46294636E-04 -2.47782273E-03 -8.75938060E-06 -1.91958649E-02 9.57587155E-03 6.59096143E-06 S -0.7224 FORMULA C2H6O PHASE = (gas) SCALING_FACTOR 0.97 ENERGY_LEVEL = (-154.810043,3) COORDINATES C -1.324563E0 -4.884665E-1 4.487558E-18 C -4.182369E-1 7.167182E-1 -6.267902E-6 H -1.157844E0 -1.111315E0 8.8363E-1 H -2.377861E0 -1.893672E-1 -9.663847E-4 H -1.156492E0 -1.112319E0 -8.826622E-1 H -5.212096E-1 1.341286E0 -8.917454E-1 H -5.216388E-1 1.341651E0 8.914267E-1 H 6.299591E-1 3.944619E-1 3.489076E-4 O 1.945236E0 -2.542386E-1 3.34246E-17 HESSIAN 5.66387381E-01 -3.23334992E-02 5.51535405E-01 -9.45911339E-06 7.75464821E-07 6.02176727E-01 -1.32673153E-01 -8.01299323E-02 6.84353869E-06 5.22157261E-01 -8.01991288E-02 -1.83234709E-01 6.87107675E-06 -1.38645618E-02 5.46180033E-01 4.70013586E-06 -1.51192890E-06 -8.51980295E-02 -1.63919538E-05 -2.32499777E-07 6.01410389E-01 -5.68058167E-02 2.68396230E-02 -3.88995316E-02 3.02282545E-03 -1.30533440E-02 1.98507544E-02 5.82168760E-02 2.49930446E-02 -1.37555868E-01 1.26242701E-01 5.67539427E-03 -1.57135330E-02 2.36983929E-02 -2.44117180E-02 1.49369497E-01 -3.67617525E-02 1.28108385E-01 -2.35856932E-01 2.04461860E-04 -1.70877252E-03 1.50309465E-03 4.10028443E-02 -1.40272732E-01 2.51456705E-01 -3.04015597E-01 7.66098028E-02 -2.36515807E-04 -1.93196152E-02 5.58719486E-03 -1.52137034E-05 -4.05652515E-03 1.17047979E-03 5.60781978E-05 3.31089373E-01 7.70717980E-02 -7.20515094E-02 7.04745695E-05 -2.80238615E-02 7.98952477E-03 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-7.04474299E-04 -1.02785144E-03 3.67547848E-03 -7.02243926E-04 1.02824829E-03 1.41269915E-02 1.69907964E-03 1.59358971E-05 3.00292463E-02 -2.95347343E-03 5.48540855E-04 -5.22550727E-06 2.74292397E-02 -6.57787529E-03 2.93216146E-06 1.90324656E-04 -6.30604780E-05 -1.53650598E-04 2.00398094E-05 -5.47378873E-04 1.84056155E-06 1.91852535E-04 -6.18613650E-05 1.56225177E-04 -1.81190594E-03 3.44595077E-04 2.48362879E-04 -1.81027224E-03 3.44398842E-04 -2.49742742E-04 -4.02653299E-03 5.64258257E-03 -1.07103086E-06 -1.72292721E-02 3.70058661E-04 -3.25525807E-06 -4.99871863E-07 -7.72942579E-04 1.38888623E-05 -4.56603568E-06 2.90310183E-03 -3.28818054E-04 -1.32097467E-04 1.94995436E-04 -1.31014283E-07 -3.84469535E-07 1.98278131E-04 3.29884357E-04 1.33868579E-04 1.93766553E-04 2.03960602E-04 -2.70432808E-04 -7.02489237E-05 -2.06446724E-04 2.69062520E-04 -7.00188308E-05 -1.95689947E-06 4.72045457E-06 4.78145404E-03 -7.12587097E-06 3.29098642E-07 -7.35838565E-03 GRADIENT 3.12593278E-03 7.06086926E-04 -7.48292147E-08 1.18441329E-02 -7.52465564E-03 -2.18469074E-06 8.75663990E-06 2.45219569E-05 1.93070562E-05 3.89454451E-04 5.31654661E-04 -1.94845491E-06 1.09245732E-05 2.23706398E-05 -1.65919274E-05 2.80053730E-03 -6.42786369E-04 -1.88690603E-04 2.80877945E-03 -6.46608391E-04 1.92839580E-04 6.09614965E-04 -2.93643284E-03 -7.03563924E-06 -2.15981331E-02 1.04658491E-02 4.37950859E-06 S -0.5117 FORMULA C2H6O PHASE = (gas) SCALING_FACTOR 0.97 ENERGY_LEVEL = (-154.808082,3) COORDINATES C -1.326098E0 -4.776548E-1 1.783321E-6 C -4.034652E-1 7.132653E-1 -3.854697E-6 H -1.167048E0 -1.101674E0 8.841186E-1 H -2.375645E0 -1.651857E-1 -9.900624E-4 H -1.165677E0 -1.102713E0 -8.831335E-1 H -4.760842E-1 1.336998E0 -8.949397E-1 H -4.764221E-1 1.337312E0 8.946824E-1 H 6.389798E-1 3.545752E-1 2.609755E-4 O 1.92491E0 -2.59122E-1 1.707972E-6 HESSIAN 5.65356244E-01 -3.12788579E-02 5.51236142E-01 -1.07486498E-05 -2.87565363E-06 6.02778400E-01 -1.33806868E-01 -8.26051619E-02 7.82365517E-06 4.99221467E-01 -8.24992928E-02 -1.81054239E-01 5.53790114E-06 -3.91255246E-03 5.46291092E-01 5.28670738E-06 -1.96843520E-06 -8.53174155E-02 -2.54814524E-05 9.16123793E-06 6.05204901E-01 -5.59918289E-02 2.59442392E-02 -3.75262193E-02 2.70152824E-03 -1.33845355E-02 2.04157516E-02 5.76603041E-02 2.39847507E-02 -1.38075605E-01 1.26711662E-01 5.34287798E-03 -1.56400539E-02 2.35886258E-02 -2.32180201E-02 1.49815220E-01 -3.52148751E-02 1.28570444E-01 -2.36266448E-01 1.94164164E-04 -1.64677574E-03 1.40287975E-03 3.93169781E-02 -1.40823952E-01 2.51783978E-01 -3.01520324E-01 7.96162930E-02 -2.41573167E-04 -1.96592433E-02 5.67014030E-03 -1.55767567E-05 -3.84317195E-03 1.16216174E-03 4.78817877E-05 3.28688998E-01 7.95891332E-02 -7.38806079E-02 7.52127960E-05 -2.73034057E-02 8.19216571E-03 -2.51167533E-05 1.72868022E-02 -5.89176528E-03 -1.41312681E-03 -8.34692690E-02 7.85111542E-02 -2.45083350E-04 7.61585687E-05 -4.93334208E-02 2.22533843E-06 -6.37591852E-07 -1.02402365E-03 -2.67942746E-02 7.48743259E-03 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-8.94137557E-04 -4.11653456E-04 3.64328623E-03 -8.97610801E-04 4.14951486E-04 1.03812426E-03 -3.19992877E-03 -7.68760555E-06 -2.34618984E-02 1.10862555E-02 3.41308863E-06 S -0.4029 FORMULA C2H6O PHASE = (gas) SCALING_FACTOR 0.97 ENERGY_LEVEL = (-154.806937,3) COORDINATES C -1.326845E0 -4.724669E-1 2.880824E-6 C -3.982368E-1 7.12401E-1 -2.892066E-6 H -1.17202E0 -1.096507E0 8.846689E-1 H -2.37454E0 -1.527756E-1 -1.005202E-3 H -1.170639E0 -1.097566E0 -8.836732E-1 H -4.505846E-1 1.333539E0 -8.978919E-1 H -4.508958E-1 1.333838E0 8.976592E-1 H 6.529152E-1 3.327028E-1 2.161844E-4 O 1.914532E0 -2.616046E-1 3.261629E-6 HESSIAN 5.62783345E-01 -3.05054153E-02 5.51380617E-01 -1.30920086E-05 -3.73868631E-06 6.03956540E-01 -1.33188492E-01 -8.41149483E-02 9.46096928E-06 4.63218700E-01 -8.44120511E-02 -1.80377241E-01 5.04370776E-06 1.30589327E-02 5.44055145E-01 6.03994825E-06 -2.11203113E-06 -8.55839584E-02 -3.77732628E-05 1.58563368E-05 6.10613663E-01 -5.54419521E-02 2.54483279E-02 -3.68386901E-02 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6.24392138E-04 -1.77960303E-04 -9.78252060E-03 9.11701250E-03 1.23024616E-07 -1.81268679E-02 -2.14044816E-04 -3.04761266E-06 -2.70732510E-08 -7.81398128E-04 1.17472028E-05 -5.51694094E-06 3.91657702E-03 -3.55999034E-04 -1.37006514E-04 1.91855505E-04 -1.39502705E-07 -3.49383413E-07 1.86693521E-04 3.57273171E-04 1.38676696E-04 1.90978501E-04 3.10962134E-04 -3.55726176E-04 -4.09580742E-05 -3.13069029E-04 3.54850738E-04 -4.06121438E-05 -3.01860159E-06 5.56861222E-06 4.15990603E-03 -4.70872607E-06 -4.69957626E-07 -7.78304224E-03 GRADIENT 4.78881204E-03 -5.02724825E-04 2.18223469E-06 4.43528727E-03 -4.58444150E-03 2.49539900E-07 4.61401124E-07 1.04113593E-04 1.14579833E-04 4.96008753E-04 6.44997111E-04 -2.83010573E-06 3.47285595E-06 1.00873155E-04 -1.12967928E-04 4.17496586E-03 -1.13258974E-03 -6.61859212E-04 4.17810858E-03 -1.13471607E-03 6.65800276E-04 5.42634197E-03 -4.50670267E-03 -7.93083159E-06 -2.35034587E-02 1.10111909E-02 2.77619423E-06 S -0.3381 FORMULA C2H6O PHASE = (gas) SCALING_FACTOR 0.97 ENERGY_LEVEL = (-154.806132,3) COORDINATES C -1.327318E0 -4.704117E-1 3.17931E-6 C -3.977208E-1 7.126043E-1 -2.255136E-6 H -1.174351E0 -1.094284E0 8.849404E-1 H -2.37442E0 -1.475905E-1 -1.011879E-3 H -1.172964E0 -1.095352E0 -8.839397E-1 H -4.396187E-1 1.331741E0 -8.995545E-1 H -4.399227E-1 1.332035E0 8.993306E-1 H 6.716922E-1 3.193851E-1 1.978251E-4 O 1.909977E0 -2.623862E-1 3.959729E-6 HESSIAN 5.59605402E-01 -3.00055819E-02 5.51826228E-01 -1.60813337E-05 -3.10959170E-06 6.04855430E-01 -1.31550142E-01 -8.48827754E-02 1.13767125E-05 4.21145109E-01 -8.60468980E-02 -1.80460139E-01 4.78859148E-06 3.16682731E-02 5.40736244E-01 6.62441245E-06 -2.26123377E-06 -8.58485992E-02 -4.87321267E-05 2.27511624E-05 6.15677755E-01 -5.50912276E-02 2.52445410E-02 -3.65926807E-02 2.32870362E-03 -1.35622636E-02 2.08861476E-02 5.71326466E-02 2.31361697E-02 -1.38555891E-01 1.27212547E-01 5.15294125E-03 -1.54470265E-02 2.35397144E-02 -2.22845841E-02 1.50105708E-01 -3.41172651E-02 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-7.61485175E-04 2.23932432E-02 -9.40815545E-03 -7.51965384E-04 3.58618114E-05 -2.23783041E-05 3.91523662E-02 7.52245528E-03 -9.16726282E-04 2.51672796E-06 -8.52497817E-02 2.84062670E-02 -7.16376694E-06 1.29897075E-04 2.81285895E-04 -7.44537691E-05 1.29227523E-04 1.53359983E-03 -1.02109762E-06 1.33545608E-04 2.82171656E-04 7.47274584E-05 5.43514887E-03 -1.55314555E-03 -1.18532298E-03 5.43244839E-03 -1.55088845E-03 1.18594929E-03 3.64604348E-02 -9.59026855E-03 8.68387824E-06 3.00066242E-02 -3.98123430E-03 8.00321875E-04 -6.82061639E-06 3.96791970E-02 -1.16378317E-02 3.61357473E-06 2.70792477E-04 -1.46240452E-05 -2.16247161E-04 4.27214008E-05 -6.92245859E-04 2.44858240E-06 2.72565583E-04 -1.29914087E-05 2.19287922E-04 -2.55182795E-03 7.37038774E-04 1.84144451E-04 -2.55003930E-03 7.36810349E-04 -1.86142842E-04 -1.42898794E-02 1.03796866E-02 6.20239709E-07 -1.68922955E-02 -2.96164616E-04 -3.14123373E-06 2.72515864E-08 -8.12465835E-04 1.22448108E-05 -5.83514189E-06 4.21879374E-03 -3.80040822E-04 -1.45706905E-04 1.98376195E-04 -1.56236278E-07 -3.60336603E-07 1.91541430E-04 3.81396941E-04 1.47446580E-04 1.97486611E-04 3.52293239E-04 -3.91515873E-04 -2.71349354E-05 -3.54517329E-04 3.90695770E-04 -2.68334397E-05 -4.16363008E-06 6.15280438E-06 3.25485633E-03 -3.91573999E-06 -9.04150121E-07 -7.19462009E-03 GRADIENT 4.71485341E-03 -6.91346235E-04 1.70620944E-06 -2.09785333E-03 -1.91171778E-03 5.81051244E-07 -2.46108816E-05 1.16133494E-04 1.11303083E-04 4.16121105E-04 6.41212667E-04 -2.88715103E-06 -2.16606871E-05 1.13050607E-04 -1.09287243E-04 4.09178232E-03 -1.16077893E-03 -7.31639324E-04 4.09355982E-03 -1.16271588E-03 7.34989950E-04 1.10848357E-02 -6.36022712E-03 -7.09065337E-06 -2.22570274E-02 1.04163892E-02 2.32407798E-06 S -0.2177 FORMULA C2H6O PHASE = (gas) SCALING_FACTOR 0.97 ENERGY_LEVEL = (-154.803887,3) COORDINATES C -1.328252E0 -4.680799E-1 4.023351E-6 C -4.000899E-1 7.138461E-1 -2.038294E-6 H -1.177535E0 -1.091619E0 8.852701E-1 H -2.374996E0 -1.415908E-1 -1.021891E-3 H -1.176141E0 -1.0927E0 -8.842631E-1 H -4.267139E-1 1.329346E0 -9.019071E-1 H -4.270158E-1 1.329633E0 9.01695E-1 H 7.212531E-1 2.93391E-1 1.768687E-4 O 1.9039E0 -2.626322E-1 4.769496E-6 HESSIAN 5.51303216E-01 -2.92079859E-02 5.52682021E-01 -2.12975415E-05 -5.90746607E-06 6.06229891E-01 -1.26810795E-01 -8.57265790E-02 1.60972788E-05 3.30771404E-01 -8.94677756E-02 -1.80973951E-01 5.08041783E-06 7.01569852E-02 5.30551821E-01 7.96228893E-06 -2.05276266E-06 -8.64244771E-02 -6.76494554E-05 3.16994498E-05 6.23377422E-01 -5.44071925E-02 2.49992826E-02 -3.63789328E-02 2.02678156E-03 -1.35910891E-02 2.11563971E-02 5.68121567E-02 2.27796389E-02 -1.38983533E-01 1.27488410E-01 5.05419713E-03 -1.52197601E-02 2.35541720E-02 -2.19183967E-02 1.50315082E-01 -3.38031430E-02 1.29255926E-01 -2.38168414E-01 4.56177255E-04 -1.42422552E-03 1.35159120E-03 3.76965608E-02 -1.41780491E-01 2.53344991E-01 -2.95941308E-01 8.26654282E-02 -2.46383088E-04 -2.05111611E-02 4.44616612E-03 -1.61881917E-05 -3.69352098E-03 1.20001235E-03 7.47253395E-05 3.23486504E-01 8.02661940E-02 -7.47032998E-02 8.02500820E-05 -2.56852112E-02 7.34721222E-03 -2.58075459E-05 1.72945131E-02 -6.01378472E-03 -1.35623902E-03 -8.58707730E-02 7.95416399E-02 -2.48218217E-04 8.33677340E-05 -4.83927342E-02 -6.90972792E-07 -1.18347874E-06 -1.24083172E-03 -2.65443596E-02 7.79435904E-03 7.24244317E-04 2.70833711E-04 -9.00651309E-05 4.65937885E-02 -5.45058222E-02 2.52493212E-02 3.66401991E-02 2.05043684E-03 -1.36195225E-02 -2.11419265E-02 -2.55913093E-05 -3.55710230E-03 -4.77602898E-03 -3.73637367E-03 1.73256522E-02 2.65155544E-02 5.69294525E-02 2.30222188E-02 -1.39299187E-01 -1.27571697E-01 5.08279704E-03 -1.52390730E-02 -2.35302613E-02 -3.57544357E-03 1.20325518E-02 1.55331609E-02 1.21276344E-03 -6.02149646E-03 -7.78508748E-03 -2.21872354E-02 1.50656827E-01 3.40655233E-02 -1.29329944E-01 -2.37742668E-01 -4.67424700E-04 1.41852197E-03 1.34639842E-03 4.81086165E-03 -1.55782409E-02 -2.01074558E-02 -8.33631359E-05 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6.47785228E-04 7.43429210E-04 1.00800060E-03 -6.05600478E-06 -2.40886552E-03 -4.15682639E-03 5.36254467E-04 6.16807517E-04 -1.66727030E-03 -2.88225086E-03 4.13295419E-02 4.55866139E-03 -1.15126416E-02 -2.04706870E-02 -2.58469376E-03 -1.39324120E-01 -1.33185908E-01 9.07693016E-04 6.20183502E-04 1.65676283E-04 -2.32579344E-04 8.06788368E-04 1.55986613E-04 -4.25506141E-03 -3.51458951E-03 3.01075497E-04 -1.67048257E-03 1.22064038E-02 1.57589083E-02 -3.65990944E-04 1.47246794E-01 6.05621477E-04 2.22182923E-03 2.58496197E-03 9.07268353E-03 -1.31838636E-01 -2.50577777E-01 -6.75692413E-04 -4.56290214E-04 9.45676004E-04 -3.36266284E-04 -1.06305343E-04 2.42681584E-04 4.01603684E-04 7.84841121E-04 1.74464200E-03 2.88725396E-03 -1.57692155E-02 -1.75511895E-02 -1.14291544E-02 1.45054345E-01 2.63194141E-01 -3.53629418E-02 8.24528624E-03 -1.97796569E-05 -9.04938607E-03 -1.81020067E-04 -5.31284315E-07 1.03489874E-03 -2.31957895E-04 2.47765614E-04 -1.14835799E-03 -7.00725787E-03 7.12277940E-06 1.03418281E-03 -2.30346589E-04 -2.44595063E-04 -1.46112788E-02 5.64025921E-03 1.96474513E-03 -1.46094928E-02 5.63781627E-03 -1.97141579E-03 1.39733627E-02 -1.17654316E-02 3.46066422E-03 2.28835039E-06 -1.33237165E-02 -3.28035293E-02 5.61298333E-06 -2.09288315E-04 7.14495297E-04 1.93106811E-04 -3.30553731E-03 -1.03460808E-03 -3.40441424E-06 -2.12973934E-04 7.14375913E-04 -1.96308543E-04 1.75031376E-02 -7.50211112E-03 -3.37117995E-04 1.75022443E-02 -7.50224833E-03 3.46164752E-04 1.42872183E-02 3.15553455E-02 1.54839536E-06 -2.94326872E-06 2.55339230E-04 -2.50843992E-05 1.72598978E-05 -4.21199826E-02 7.93952663E-04 -6.53173824E-05 -5.96424034E-05 -8.66978080E-07 3.95500484E-08 8.38232183E-04 -7.95898748E-04 6.32721796E-05 -5.82492249E-05 -1.93742358E-02 8.26587611E-03 -5.88414848E-04 1.93698708E-02 -8.26168762E-03 -5.80565792E-04 2.39993277E-05 -1.82051785E-05 4.25864052E-02 9.22760207E-03 -9.25093735E-04 3.73599801E-06 -1.06326766E-01 3.66268153E-02 -7.51112070E-06 1.05543569E-04 1.99472676E-04 -7.31224297E-06 5.31329134E-05 1.66074613E-03 -1.59829658E-06 1.09714911E-04 1.99891100E-04 7.25756628E-06 6.60240896E-03 -1.99816312E-03 -1.44434802E-03 6.59819107E-03 -1.99536265E-03 1.44536619E-03 5.87390133E-02 -2.04756526E-02 6.71467348E-06 2.48911593E-02 -4.73516240E-03 8.32396319E-04 -7.68822231E-06 4.96582942E-02 -1.50982340E-02 3.99474018E-06 3.46675990E-04 5.01830430E-05 -2.83585041E-04 1.15714110E-04 -7.33606338E-04 2.83439932E-06 3.48482691E-04 5.21821165E-05 2.86944182E-04 -3.14185608E-03 9.73854578E-04 2.34493755E-04 -3.13949783E-03 9.73429786E-04 -2.36732885E-04 -2.61599976E-02 1.23976159E-02 1.70571123E-06 -1.32926531E-02 5.52178645E-04 -3.57029042E-06 5.73854991E-08 -9.26255087E-04 1.43797021E-05 -6.77651959E-06 4.95133490E-03 -4.55842354E-04 -1.74293001E-04 2.23082336E-04 -1.29760147E-07 -3.87570012E-07 2.14582703E-04 4.57424977E-04 1.76273595E-04 2.22142835E-04 4.67126059E-04 -4.83061523E-04 -2.80067101E-06 -4.69772521E-04 4.82291039E-04 -2.57057610E-06 -7.31106046E-06 7.86323339E-06 -2.73121751E-04 -2.30475217E-06 -1.96664016E-06 -4.40639469E-03 GRADIENT 3.55884832E-03 -6.09349642E-04 1.65238674E-06 -1.03093682E-02 2.06420427E-03 3.46041301E-07 -4.16036922E-05 8.70097811E-05 7.98661839E-05 2.22038412E-04 4.62350492E-04 -2.80265159E-06 -3.87834274E-05 8.33934614E-05 -7.82338639E-05 3.03589953E-03 -9.03229113E-04 -6.07609938E-04 3.03587914E-03 -9.04848788E-04 6.10437207E-04 1.70506572E-02 -8.02708010E-03 -4.80938193E-06 -1.65135673E-02 7.74754965E-03 1.15401689E-06 S -0.1690 FORMULA C2H6O PHASE = (gas) SCALING_FACTOR 0.97 ENERGY_LEVEL = (-154.802916,3) COORDINATES C -1.328623E0 -4.674548E-1 4.080579E-6 C -4.016099E-1 7.144811E-1 -2.09511E-6 H -1.178539E0 -1.090882E0 8.853682E-1 H -2.375364E0 -1.399906E-1 -1.024953E-3 H -1.177142E0 -1.091967E0 -8.843579E-1 H -4.231428E-1 1.328618E0 -9.026542E-1 H -4.234447E-1 1.328904E0 9.024459E-1 H 7.432381E-1 2.829379E-1 1.709515E-4 O 1.901974E0 -2.624724E-1 5.013785E-6 HESSIAN 5.47512143E-01 -2.89478060E-02 5.52853485E-01 -2.40544702E-05 -5.69801072E-06 6.06608857E-01 -1.24820825E-01 -8.58058749E-02 1.79945825E-05 2.99110176E-01 -9.07559994E-02 -1.81149679E-01 5.34126426E-06 8.34217895E-02 5.25532166E-01 8.44827516E-06 -1.87778152E-06 -8.66533401E-02 -7.30978700E-05 3.35313045E-05 6.24860283E-01 -5.41231047E-02 2.49175839E-02 -3.63332420E-02 1.90528776E-03 -1.35920673E-02 2.12595735E-02 5.66844984E-02 2.26741214E-02 -1.39156801E-01 1.27562342E-01 4.97891864E-03 -1.51105999E-02 2.35611450E-02 -2.18032378E-02 1.50387713E-01 -3.37308643E-02 1.29286288E-01 -2.38447798E-01 5.68962047E-04 -1.36442450E-03 1.34848191E-03 3.75749419E-02 -1.41896404E-01 2.53574625E-01 -2.95075668E-01 8.30130189E-02 -2.46735350E-04 -2.06950528E-02 4.03499838E-03 -1.62199562E-05 -3.69609704E-03 1.21567009E-03 8.93413327E-05 3.22667781E-01 7.99355873E-02 -7.44365214E-02 8.06301246E-05 -2.54921110E-02 7.07341519E-03 -2.60013931E-05 1.73072803E-02 -5.99981286E-03 -1.34293943E-03 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1.55277201E-03 6.63397620E-02 -2.45274525E-02 6.26988013E-06 2.42252561E-02 -4.97256127E-03 7.96737022E-04 -8.00486299E-06 5.35857140E-02 -1.64686399E-02 4.06110041E-06 3.82842820E-04 9.02976819E-05 -3.18091700E-04 1.61269953E-04 -7.13113775E-04 2.98514901E-06 3.84696638E-04 9.24904032E-05 3.21593484E-04 -3.34972665E-03 1.05510128E-03 2.55715125E-04 -3.34710288E-03 1.05460252E-03 -2.58032468E-04 -3.06433922E-02 1.24352111E-02 2.03320724E-06 -1.22017404E-02 1.65731368E-03 -3.73913430E-06 4.00046982E-08 -9.85977516E-04 1.53004045E-05 -7.16955413E-06 5.28273918E-03 -4.94049973E-04 -1.88855965E-04 2.36180921E-04 -1.40449347E-07 -3.85446932E-07 2.27849418E-04 4.95739883E-04 1.90959516E-04 2.35196249E-04 5.23398301E-04 -5.24513389E-04 4.56576029E-06 -5.26218636E-04 5.23730540E-04 4.76947792E-06 -8.26408803E-06 8.45332917E-06 -2.32477928E-03 -2.02630839E-06 -2.25903478E-06 -2.68054422E-03 GRADIENT 2.82876100E-03 -4.82835709E-04 5.26061489E-07 -1.04361381E-02 2.55395630E-03 1.69018026E-07 -3.83192787E-05 6.49000812E-05 6.48164831E-05 1.53440043E-04 3.51725723E-04 -2.57761141E-06 -3.56097189E-05 6.15544290E-05 -6.25581480E-05 2.40359269E-03 -7.22375392E-04 -4.94690479E-04 2.40325498E-03 -7.23642194E-04 4.97677689E-04 1.58130075E-02 -7.25593429E-03 -3.93823219E-06 -1.30919891E-02 6.15265106E-03 5.75219817E-07 S -0.1343 FORMULA C2H6O PHASE = (gas) SCALING_FACTOR 0.97 ENERGY_LEVEL = (-154.802237,3) COORDINATES C -1.328912E0 -4.670331E-1 4.170204E-6 C -4.029363E-1 7.15011E-1 -2.039909E-6 H -1.179268E0 -1.090379E0 8.854403E-1 H -2.375683E0 -1.389211E-1 -1.028874E-3 H -1.177867E0 -1.091469E0 -8.844268E-1 H -4.206733E-1 1.328096E0 -9.032022E-1 H -4.209752E-1 1.328379E0 9.029969E-1 H 7.610158E-1 2.746759E-1 1.670225E-4 O 1.900568E0 -2.622811E-1 5.101642E-6 HESSIAN 5.44399920E-01 -2.87539727E-02 5.52899878E-01 -2.57828353E-05 -6.64263089E-06 6.06844026E-01 -1.23355459E-01 -8.57633320E-02 1.94424135E-05 2.77259871E-01 -9.17062894E-02 -1.81260247E-01 5.80789537E-06 9.25949641E-02 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2.56435229E-06 -1.26693509E-02 4.99370410E-03 -3.96385985E-06 -4.08052662E-08 -1.08825408E-03 1.63645491E-05 -7.58993799E-06 5.81861895E-03 -5.58887104E-04 -2.13727557E-04 2.58802410E-04 -1.48774231E-07 -3.60211013E-07 2.51809871E-04 5.60752491E-04 2.16070425E-04 2.57700821E-04 6.19650930E-04 -5.90764225E-04 1.24818961E-05 -6.22720127E-04 5.89855886E-04 1.26874818E-05 -8.79456616E-06 9.08977148E-06 -6.10008800E-03 -2.25353930E-06 -2.53334405E-06 5.76240651E-04 GRADIENT 1.50861346E-03 -2.45447404E-04 -6.24002947E-07 -7.14017575E-03 2.00691247E-03 1.15439121E-06 -2.50685968E-05 3.02433607E-05 3.75993043E-05 6.46870848E-05 1.69786160E-04 -2.18531634E-06 -2.25821794E-05 2.67277750E-05 -3.50195043E-05 1.28186883E-03 -3.87298450E-04 -2.75149716E-04 1.28130564E-03 -3.89009958E-04 2.77335138E-04 9.91956316E-03 -4.44884251E-03 -2.74060922E-06 -6.86821165E-03 3.23692856E-03 -3.69684320E-07 S -0.0521 FORMULA C2H6O PHASE = (gas) SCALING_FACTOR 0.97 ENERGY_LEVEL = (-154.801337,3) COORDINATES C 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2.64394257E-04 5.93268814E-04 2.28759683E-04 2.69090537E-04 6.69065904E-04 -6.22348590E-04 1.45744821E-05 -6.72203558E-04 6.21345556E-04 1.48024685E-05 -8.32028068E-06 9.04909487E-06 -8.10934282E-03 -2.72386681E-06 -2.49471206E-06 2.33715126E-03 GRADIENT 8.21259979E-04 -1.25252215E-04 -1.65412506E-06 -4.24185633E-03 1.23175837E-03 1.73225151E-06 -1.55627206E-05 1.44371093E-05 2.41449442E-05 3.11091530E-05 8.78455358E-05 -1.97555252E-06 -1.33512229E-05 1.09504038E-05 -2.10489368E-05 7.01818202E-04 -2.09989456E-04 -1.55380671E-04 7.01115602E-04 -2.11781034E-04 1.57394254E-04 5.70340752E-03 -2.53808720E-03 -2.42281739E-06 -3.68794018E-03 1.74011849E-03 -7.89347147E-07 S -0.0093 FORMULA C2H6O PHASE = (gas) SCALING_FACTOR 0.97 ENERGY_LEVEL = (-154.801182,3) COORDINATES C -1.329754E0 -4.660255E-1 -7.546235E-17 C -4.072461E-1 7.166467E-1 -2.847056E-6 H -1.181256E0 -1.089098E0 8.856607E-1 H -2.376721E0 -1.364247E-1 -1.053177E-3 H -1.179816E0 -1.090265E0 -8.845995E-1 H -4.144222E-1 1.326725E0 -9.046137E-1 H -4.147543E-1 1.326988E0 9.044234E-1 H 8.148561E-1 2.502669E-1 1.150682E-4 O 1.896764E0 -2.6149E-1 9.964578E-6 HESSIAN 5.34935466E-01 -2.81843009E-02 5.52622905E-01 -3.27285235E-05 -3.46738146E-06 6.07343963E-01 -1.20131325E-01 -8.51625925E-02 2.36356361E-05 2.31987699E-01 -9.40676670E-02 -1.81466442E-01 8.01444511E-06 1.12256439E-01 5.09379209E-01 8.46913209E-06 -2.62242685E-06 -8.73026591E-02 -8.73459341E-05 3.78530138E-05 6.24329654E-01 -5.31879811E-02 2.46356254E-02 -3.62016285E-02 1.55828538E-03 -1.35661549E-02 2.15634528E-02 5.62562066E-02 2.24346403E-02 -1.39655245E-01 1.27714042E-01 4.56773374E-03 -1.47065397E-02 2.35700392E-02 -2.14810538E-02 1.50540989E-01 -3.35828676E-02 1.29236523E-01 -2.39181405E-01 1.00312741E-03 -1.15441780E-03 1.32748993E-03 3.72372537E-02 -1.42196661E-01 2.54190367E-01 -2.92438112E-01 8.41770712E-02 -2.51937170E-04 -2.14137116E-02 2.49198154E-03 -1.67609024E-05 -3.72985009E-03 1.27977032E-03 1.42170040E-04 3.20194981E-01 7.87494452E-02 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-1.92950652E-06 4.08023765E-03 GRADIENT 1.35834123E-04 -4.50816813E-05 -3.63041116E-06 -7.36768918E-04 2.25882543E-04 5.61539226E-06 -9.76024495E-06 2.17486730E-05 -7.59859850E-06 6.47864774E-06 1.17177495E-05 -2.66791221E-07 -6.83676907E-06 1.51464220E-05 1.01064549E-05 1.22526010E-04 -4.36973954E-05 6.48961786E-06 1.18843526E-04 -4.59141839E-05 -4.81258635E-06 1.07724309E-03 -4.71452689E-04 -5.45747052E-06 -7.07559467E-04 3.31650562E-04 -4.45607283E-07 S 0.0098 FORMULA C2H6O PHASE = (gas) SCALING_FACTOR 0.97 ENERGY_LEVEL = (-154.801184,3) COORDINATES C -1.329882E0 -4.658991E-1 -3.891924E-17 C -4.080262E-1 7.169331E-1 -2.775319E-6 H -1.181533E0 -1.088942E0 8.856937E-1 H -2.376901E0 -1.361282E-1 -1.053157E-3 H -1.180094E0 -1.090111E0 -8.846324E-1 H -4.135122E-1 1.326506E0 -9.048537E-1 H -4.138453E-1 1.32677E0 9.046635E-1 H 8.23647E-1 2.463392E-1 1.131652E-4 O 1.896211E0 -2.613297E-1 1.008437E-5 HESSIAN 5.33423837E-01 -2.80718509E-02 5.52533830E-01 -3.33859291E-05 -3.82020239E-06 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-4.87768138E-03 3.40665243E-04 -8.00799257E-06 6.05846102E-02 -1.90268662E-02 8.85203445E-07 5.09967096E-04 2.81955416E-04 -4.49769465E-04 3.83013348E-04 -3.66403653E-04 3.20785020E-06 5.11844198E-04 2.84907906E-04 4.53540702E-04 -3.52319296E-03 1.14170102E-03 2.40766225E-04 -3.51876256E-03 1.14064594E-03 -2.42767122E-04 -2.99145347E-02 3.58720095E-03 3.91582311E-06 -2.01552633E-02 1.26161933E-02 -3.38464993E-06 -3.23133459E-07 -1.21341707E-03 1.20513064E-05 -5.63648523E-06 6.44316354E-03 -6.37711065E-04 -2.44403454E-04 2.86973225E-04 -1.73952093E-07 -1.63381862E-07 2.83280329E-04 6.39723960E-04 2.47044910E-04 2.85640020E-04 7.42368690E-04 -6.65689442E-04 1.46935165E-05 -7.45074706E-04 6.64429474E-04 1.49818462E-05 -3.92215275E-06 6.51273652E-06 -1.10142093E-02 -3.87743242E-06 -1.77122302E-06 4.89889392E-03 GRADIENT -1.83989620E-04 3.89814648E-06 -3.94862589E-06 1.09452218E-03 -3.35886516E-04 6.17372514E-06 -4.78429669E-06 1.68535989E-05 -1.56825275E-05 -2.84975743E-06 -1.61842003E-05 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2.48512589E-03 -1.18171422E-03 -1.64467234E-06 S 0.0889 FORMULA C2H6O PHASE = (gas) SCALING_FACTOR 0.97 ENERGY_LEVEL = (-154.8017083,3) COORDINATES C -1.330364E0 -4.654906E-1 4.864684E-6 C -4.115249E-1 7.181923E-1 -2.135643E-6 H -1.182515E0 -1.088495E0 8.858159E-1 H -2.377671E0 -1.352484E-1 -1.037163E-3 H -1.181107E0 -1.089597E0 -8.847962E-1 H -4.099207E-1 1.325558E0 -9.059492E-1 H -4.102298E-1 1.32584E0 9.057529E-1 H 8.595211E-1 2.304441E-1 1.498989E-4 O 1.894157E0 -2.605892E-1 5.928308E-6 HESSIAN 5.27475181E-01 -2.74803109E-02 5.52133981E-01 -3.47760133E-05 -1.13154896E-05 6.07326020E-01 -1.19042920E-01 -8.45015810E-02 2.38821654E-05 2.16359359E-01 -9.55526679E-02 -1.81768482E-01 9.02574114E-06 1.20889438E-01 5.00997295E-01 9.44199385E-06 -1.08358339E-06 -8.76301272E-02 -8.76702459E-05 4.20403516E-05 6.21815232E-01 -5.26460116E-02 2.44424018E-02 -3.61019238E-02 1.39996538E-03 -1.35223868E-02 2.17086387E-02 5.60128247E-02 2.23539092E-02 -1.39875634E-01 1.27685019E-01 4.23769936E-03 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-1.83664433E-04 -1.39842757E-04 -1.08586861E-02 4.77979631E-03 -3.65272588E-04 1.08572908E-02 -4.77647719E-03 -3.61801573E-04 7.26214625E-06 -1.29411412E-05 3.89434965E-02 8.53140162E-03 6.59838589E-04 1.99621329E-06 -1.23474443E-01 4.59305974E-02 -4.04785419E-06 5.38641060E-05 -3.32250740E-04 1.94167898E-04 -4.77424518E-04 4.97946901E-04 -1.36337807E-06 5.85145191E-05 -3.33156731E-04 -1.93893911E-04 6.38379005E-03 -1.93407775E-03 -1.60099752E-03 6.37671824E-03 -1.93053935E-03 1.60160853E-03 2.30998378E-02 -8.95141230E-03 1.10004023E-05 7.94477411E-02 -4.28454813E-03 9.62273954E-06 -8.02510350E-06 5.85074699E-02 -1.83827105E-02 2.28187443E-06 5.52087554E-04 3.69205370E-04 -4.96811144E-04 4.86474263E-04 -9.83646999E-05 3.20101415E-06 5.54574967E-04 3.72427566E-04 5.00754522E-04 -3.24729224E-03 1.06068034E-03 1.64350505E-04 -3.24376587E-03 1.06015619E-03 -1.66461014E-04 -1.57180544E-02 -5.95832316E-03 1.02650083E-06 -3.36069460E-02 2.15673062E-02 -4.12249838E-06 -2.84259320E-07 -1.29964292E-03 1.63600758E-05 -7.67400640E-06 6.85125261E-03 -6.91287052E-04 -2.66187856E-04 3.06898432E-04 -1.72324848E-07 -2.15497438E-07 3.06880113E-04 6.93483248E-04 2.69041435E-04 3.05571741E-04 8.32699252E-04 -7.12189635E-04 1.05567711E-05 -8.35999993E-04 7.10945663E-04 1.08754042E-05 -2.49032668E-06 6.88131212E-06 -1.41060396E-02 -8.47037942E-06 -3.17155047E-07 7.61364749E-03 GRADIENT -1.34422787E-03 1.87654616E-04 -2.69552066E-06 8.90619821E-03 -2.88708780E-03 2.80773528E-06 1.61832951E-05 -1.43189770E-05 -3.70194800E-05 -2.37716888E-05 -7.09893877E-05 -1.30202599E-06 1.81617438E-05 -1.77164772E-05 4.00414829E-05 -1.17753830E-03 3.54939585E-04 2.76602251E-04 -1.17737942E-03 3.52503078E-04 -2.75741394E-04 -9.92319745E-03 4.33832201E-03 -5.86987003E-07 4.70557147E-03 -2.24330665E-03 -2.10606195E-06 S 0.1404 FORMULA C2H6O PHASE = (gas) SCALING_FACTOR 0.97 ENERGY_LEVEL = (-154.802396,3) COORDINATES C -1.330648E0 -4.65294E-1 5.294381E-6 C -4.13869E-1 7.190072E-1 -2.118152E-6 H -1.183107E0 -1.088233E0 8.859075E-1 H -2.37817E0 -1.34874E-1 -1.033695E-3 H -1.181702E0 -1.089329E0 -8.848926E-1 H -4.076711E-1 1.324947E0 -9.066094E-1 H -4.079799E-1 1.325233E0 9.064118E-1 H 8.819061E-1 2.206782E-1 1.498927E-4 O 1.892978E0 -2.600878E-1 5.926625E-6 HESSIAN 5.23993851E-01 -2.70140923E-02 5.51918073E-01 -3.67568374E-05 -1.29409952E-05 6.07310406E-01 -1.18968585E-01 -8.42586537E-02 2.39415620E-05 2.14326991E-01 -9.61875973E-02 -1.82016192E-01 9.58317383E-06 1.23375523E-01 4.97647761E-01 9.66235483E-06 -9.79227623E-07 -8.77737718E-02 -8.86582631E-05 4.43654061E-05 6.20562109E-01 -5.23862774E-02 2.43392383E-02 -3.60424981E-02 1.33984594E-03 -1.34950555E-02 2.17661069E-02 5.58953456E-02 2.23246963E-02 -1.39954225E-01 1.27665859E-01 4.07333374E-03 -1.43045359E-02 2.35595720E-02 -2.12427295E-02 1.50525365E-01 -3.34954552E-02 1.28950544E-01 -2.39449092E-01 1.37576861E-03 -9.55310632E-04 1.29976634E-03 3.69695986E-02 -1.42282019E-01 2.54411459E-01 -2.89985059E-01 8.51030226E-02 -2.47000937E-04