Version2.1 2021-01-07T22:09:03Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 22-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCCn1c2ccc(cc2nc1SCC(=O)Nc3ccnn3C(C)C)S(=O)(=O)N(C)C C31839874 RHF 6-31G(d) (6D,7F) CCCCn1c2ccc(cc2nc1SCC(=O)Nc3ccnn3C(C)C)S(=O)(=O)N(C)C C01[X(C21H30N6O3S2)] 180 C1 548 CCCCn1c(SCC(=O)Nc2ccnn2C(C)C)nc2c1ccc(c2)S(=O)(=O)N(C)C CCCCn1c(SCC(=O)Nc2ccnn2C(C)C)nc2c1ccc(c2)S(=O)(=O)N(C)C CCCCn1c(SCC(=O)Nc2ccnn2C(C)C)nc3cc(ccc13)[S](=O)(=O)N(C)C InChIKey=SROIFRSTCLMYND-UHFFFAOYSA-N InChI=1S/C21H30N6O3S2/c1-6-7-12-26-18-9-8-16(32(29,30)25(4)5)13-17(18)23-21(26)31-14-20(28)24-19-10-11-22-27(19)15(2)3/h8-11,13,15H,6-7,12,14H2,1-5H3,(H,24,28) InChI=1/C21H30N6O3S2/c1-6-7-12-26-18-9-8-16(32(29,30)25(4)5)13-17(18)23-21(26)31-14-20(28)24-19-10-11-22-27(19)15(2)3/h8-11,13,15H,6-7,12,14H2,1-5H3,(H,24,28)/f/h24H CCCCn1c2ccc(cc2nc1SCC(=O)Nc3ccnn3C(C)C)S(=O)(=O)N(C)C C01[X(C21H30N6O3S2)] 180 C01 548 CCCCn1c(SCC(=O)Nc2ccnn2C(C)C)nc2c1ccc(c2)S(=O)(=O)N(C)C CCCCN1[C]([N][C]2[C]1[CH][CH][C]([CH]2)S(=O)(=O)N(C)C)SCC(=O)N[C]1[CH][CH][N][N]1C(C)C CCCCN1[C]2[CH][CH][C]([CH][C]2[N][C]1SCC(=O)N[C]3[CH][CH][N]N3C(C)C)[S](=O)(=O)N(C)C InChIKey=SROIFRSTCLMYND-UHFFFAOYSA-N InChI=1S/C21H30N6O3S2/c1-6-7-12-26-18-9-8-16(32(29,30)25(4)5)13-17(18)23-21(26)31-14-20(28)24-19-10-11-22-27(19)15(2)3/h8-11,13,15H,6-7,12,14H2,1-5H3,(H,24,28) InChI=1/C21H30N6O3S2/c1-6-7-12-26-18-9-8-16(32(29,30)25(4)5)13-17(18)23-21(26)31-14-20(28)24-19-10-11-22-27(19)15(2)3/h8-11,13,15H,6-7,12,14H2,1-5H3,(H,24,28)/f/h24H 3505.9578484270 -2158.9292237 1-A 27519.8343 127 421 548 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -92.19873 -91.98167 -20.56125 -20.54391 -20.54385 -15.64102 -15.63849 -15.62913 -15.59813 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CCCCn1c2ccc(cc2nc1SCC(=O)Nc3ccnn3C(C)C)S(=O)(=O)N(C)C C31839874 RHF 6-31G(d) (6D,10F) C1 478.182083 |X|Y|Z| 80.319589 141.606005 31.879696 71.308140 18 6 7 16 12 5 1 |36.858105| |12.467234|36.858105| |7.488041|12.453172|36.858105| |4.880843|7.511664|12.466132|36.858105| |3.784014|4.959449|7.647839|13.083314|53.358707| |3.291722|4.045068|5.699030|7.533668|18.829093|36.858105| |3.211900|3.853745|5.034696|5.991527|10.245952|13.707944|36.858105| |2.667211|3.042739|3.749892|4.201128|7.002084|8.067072|13.820662|36.858105| |2.364041|2.653998|3.262093|3.646596|6.358903|6.978424|7.880079|13.591483|36.858105| |2.391796|2.707768|3.410105|3.899417|7.355722|7.893726|6.709443|7.823656|13.768978|36.858105| |2.769072|3.245311|4.319461|5.254192|11.762125|13.664144|7.813253|6.895373|8.049931|13.745206|36.858105| |2.757472|3.235627|4.293643|5.247461|11.628282|8.384352|5.301199|4.616999|5.148916|7.605894|13.788591|53.358707| |3.243876|3.990583|5.588854|7.505620|18.962948|8.717619|5.350632|4.259056|4.298494|5.484121|9.011654|20.172145|36.858105| |3.205763|3.881812|4.947629|5.996581|9.531416|4.920351|3.666203|3.069095|3.081126|3.696818|4.963587|9.559373|10.827073|388.023441| |2.519208|2.869344|3.480833|3.939637|6.463534|3.967273|3.076869|2.750843|2.917406|3.618018|4.515151|9.125294|7.088538|74.825206|36.858105| |2.317073|2.577817|2.967004|3.231109|4.879912|3.052863|2.498200|2.262473|2.367017|2.810734|3.322942|5.949750|4.678449|49.788813|12.545512|36.858105| |2.419736|2.693640|3.013789|3.244400|4.647471|2.850415|2.370793|2.123434|2.174377|2.518241|2.976187|5.111075|4.227561|47.384865|7.976642|15.979684|73.516695| |2.012352|2.193040|2.490044|2.669687|4.046754|2.654404|2.224528|2.068028|2.199809|2.603158|2.949659|5.097448|3.744228|34.086421|7.931956|13.951365|14.970370|53.358707| |1.822302|1.957074|2.162645|2.283448|3.359528|2.229280|1.917600|1.796230|1.894821|2.187825|2.425517|4.001205|2.964338|26.211735|5.084170|7.783703|11.937290|18.550803|36.858105| |1.769583|1.898043|2.052242|2.163718|3.100184|2.043828|1.779475|1.659043|1.726235|1.959906|2.172833|3.509786|2.663399|23.788134|4.168677|6.134281|11.359926|10.305677|13.950035|36.858105| |1.586042|1.677861|1.797438|1.872614|2.673363|1.794844|1.587160|1.496695|1.560453|1.753262|1.907501|3.012147|2.252120|19.225971|3.272546|4.335391|7.803151|7.284089|8.760569|13.530390|36.858105| |1.534042|1.614099|1.744420|1.808977|2.616263|1.779773|1.575868|1.499829|1.579031|1.780999|1.916037|3.019768|2.212682|18.396114|3.214174|4.098517|6.935828|7.338343|8.601453|8.476837|14.663686|53.358707| |1.655832|1.753697|1.928072|2.009933|2.958950|2.008230|1.753605|1.666603|1.769885|2.028057|2.196105|3.535628|2.561446|21.442111|3.995931|5.239293|8.211317|10.854320|14.139429|8.685981|9.054424|19.345273|53.358707| |1.598460|1.681918|1.865297|1.932547|2.886075|1.999023|1.753104|1.688686|1.817587|2.091212|2.222356|3.545232|2.494597|19.944523|3.732667|4.410146|6.691906|8.626573|7.486793|5.250676|5.465931|10.742673|17.761871|36.858105| |1.452624|1.533707|1.693762|1.773108|2.655803|1.869889|1.656868|1.615722|1.752166|2.005387|2.089765|3.273856|2.268586|17.579115|3.212225|3.601611|5.540213|6.596586|5.444554|4.277876|4.581045|8.498293|10.554945|12.466381|36.858105| |1.538008|1.591882|1.748483|1.775461|2.615509|1.820055|1.617498|1.562534|1.670036|1.892416|1.996138|3.116081|2.212917|17.495580|3.088248|3.557237|5.681480|6.212567|5.275265|4.239282|4.675999|8.919772|10.572342|12.474961|7.504781|36.858105| |1.971874|2.150149|2.523626|2.727260|4.434787|4.231921|4.721843|6.949051|10.750456|6.986135|4.757971|4.957998|3.115880|17.280161|2.388539|2.009488|3.291094|2.610442|1.685220|1.540512|1.415057|1.963880|2.181694|1.665163|1.632057|1.543792|388.023441| |1.847592|1.990808|2.335113|2.490995|4.068965|3.713214|3.825868|4.964532|7.363719|6.521383|4.436715|4.905610|2.996946|16.969222|2.438090|2.056058|3.324446|2.719237|1.753331|1.585064|1.463878|2.053615|2.294850|1.779825|1.754826|1.650674|94.741371|73.516695| |1.970250|2.116542|2.439340|2.565076|4.002996|3.730765|4.431193|6.486971|7.361724|4.991841|3.866711|4.154832|2.733720|15.534856|2.106300|1.804489|2.997314|2.337937|1.527046|1.408946|1.300936|1.800136|1.982322|1.506916|1.470837|1.414229|94.726815|13.594186|73.516695| |1.789196|1.967642|2.258714|2.498360|3.982139|3.650667|4.008336|5.376548|6.918825|5.372277|4.021350|4.403068|2.816522|16.039814|2.228783|1.899860|3.125013|2.480081|1.614606|1.487973|1.369844|1.893592|2.089229|1.584099|1.574251|1.458471|82.405059|13.734031|13.731930|53.358707| |1.704027|1.884037|2.162275|2.428801|3.915586|3.478794|3.563669|4.373152|5.673111|5.268252|4.016522|4.593290|2.875807|16.568870|2.367523|2.014129|3.278898|2.655264|1.723245|1.580586|1.453553|2.014268|2.230641|1.695030|1.705129|1.541182|51.056262|11.708635|8.898724|17.803743|36.858105| |1.795772|1.985841|2.240399|2.492841|3.851607|3.486687|4.021030|5.279082|5.660524|4.360723|3.578238|3.961717|2.640175|15.225569|2.061834|1.777246|2.965156|2.299316|1.508577|1.406971|1.294846|1.775354|1.942748|1.456390|1.443476|1.345223|51.029379|8.898946|11.713027|17.805236|7.753912|36.858105| |17.558616|8.785437|5.463574|4.054198|4.361339|2.832312|2.799662|2.372793|2.113604|2.125211|2.421090|3.285427|2.798304|20.014988|2.258741|2.116459|3.962736|2.523822|1.701336|1.670060|1.506374|1.975013|2.111714|1.491941|1.362016|1.440580|12.769708|2.993100|3.204802|2.246249|1.575272|1.668636|0.500000| |17.542219|8.775142|6.785898|4.507641|4.985999|3.334475|3.365625|2.821032|2.468579|2.452792|2.793573|3.688905|3.108662|20.963535|2.378718|2.165436|3.952633|2.594542|1.724367|1.661747|1.499927|1.991117|2.152656|1.543317|1.409405|1.489994|14.692779|3.422595|3.724398|2.520597|1.741237|1.860298|0.301689|0.500000| |17.546134|8.779332|6.787208|4.509712|4.980828|3.148300|2.983399|2.514831|2.282642|2.350723|2.727491|3.788394|3.273230|23.830962|2.650374|2.466307|4.608968|2.906053|1.935244|1.876248|1.679439|2.211586|2.391337|1.693288|1.522584|1.639105|13.602932|3.234219|3.369589|2.353058|1.659419|1.714307|0.301735|0.301604|0.500000| |8.861799|17.506708|8.847350|6.903696|6.301729|3.965450|3.985142|3.133928|2.666308|2.654339|3.125887|4.117065|3.639154|24.330040|2.600708|2.335032|4.304159|2.739684|1.806242|1.756966|1.562889|2.048588|2.215533|1.565760|1.443613|1.479468|15.434365|3.517647|3.839237|2.731170|1.905397|2.060493|0.213088|0.210719|0.173009|0.500000| |8.863607|17.515242|8.853785|6.910612|6.292389|3.665154|3.393386|2.731672|2.438050|2.527636|3.035338|4.256605|3.909963|29.135773|2.965874|2.723059|5.187456|3.111727|2.051290|2.014553|1.767631|2.289329|2.476517|1.722018|1.565186|1.624183|14.194881|3.315925|3.456742|2.523139|1.800470|1.868418|0.213039|0.172990|0.210946|0.303750|0.500000| |6.860596|8.836512|17.539503|8.886289|9.495498|5.147296|4.332640|3.395363|3.090891|3.336706|4.241101|6.096610|5.901425|40.256025|3.907013|3.332689|6.037582|3.750473|2.372264|2.234031|1.943962|2.570924|2.862916|2.031432|1.816439|1.909644|17.226240|4.082346|4.119026|2.934018|2.088001|2.101014|0.140293|0.168857|0.203515|0.173452|0.211487|0.500000| |6.858818|8.831685|17.528892|8.874854|9.535489|6.103877|5.838599|4.285031|3.603815|3.648234|4.502625|5.709630|5.078620|29.773705|3.168005|2.686483|4.753795|3.146167|2.014047|1.896917|1.680822|2.243053|2.479491|1.787669|1.633776|1.685700|19.603521|4.480052|4.819596|3.277751|2.257567|2.386965|0.140263|0.203437|0.168836|0.211188|0.173465|0.303529|0.500000| |4.529789|6.855060|8.805089|17.588314|12.605810|7.091465|6.542131|4.460225|3.687558|3.756329|4.808509|6.107164|5.758737|32.957379|3.327729|2.793407|4.982397|3.221525|2.056515|1.964136|1.718781|2.261359|2.489428|1.764357|1.640263|1.625177|19.724708|4.393790|4.703240|3.517812|2.480751|2.650175|0.108582|0.119419|0.111194|0.206783|0.171278|0.173587|0.210908|0.500000| |4.528811|6.845319|8.812241|17.604345|12.545557|5.713905|4.607855|3.487061|3.148925|3.425247|4.503618|6.599865|7.065366|49.350193|4.219597|3.542176|6.521028|3.879680|2.441894|2.344834|2.002533|2.598118|2.878083|1.997837|1.825752|1.823435|17.333845|4.022558|4.051486|3.106077|2.263089|2.276168|0.108513|0.111138|0.119551|0.170697|0.206622|0.211801|0.173556|0.304858|0.500000| |3.560143|4.352816|5.472486|6.298200|8.965586|8.808009|17.738289|8.919076|5.613501|4.868280|5.572902|5.847728|4.599689|24.160386|2.790090|2.326309|4.001045|2.810610|1.802863|1.693313|1.514363|2.034369|2.243558|1.635885|1.543391|1.520099|27.776072|5.717119|6.899504|4.687716|3.062262|3.602708|0.086332|0.104893|0.088834|0.131384|0.103421|0.123056|0.181324|0.212251|0.131747|0.500000| |2.527942|2.825990|3.337756|3.613141|5.603782|5.697584|8.953897|17.761842|8.900025|5.615542|4.968117|4.988677|3.463632|18.778874|2.384315|2.009589|3.384807|2.521705|1.631539|1.518268|1.380709|1.882843|2.074671|1.544957|1.484847|1.440920|47.496471|8.189692|13.329314|7.269834|4.095630|5.695826|0.063308|0.075189|0.065629|0.082306|0.070279|0.083554|0.106434|0.108825|0.084833|0.215002|0.500000| |2.154645|2.398062|2.949054|3.301712|5.960337|5.616933|4.870498|5.586503|8.873172|17.764682|8.872061|9.172430|4.752083|24.472280|3.601669|2.821068|4.418680|3.653880|2.253347|1.994659|1.795469|2.509943|2.876555|2.215361|2.147921|1.993069|47.138270|13.257099|8.166477|7.178797|5.609456|4.051616|0.053653|0.061095|0.059495|0.064889|0.063005|0.081926|0.086248|0.087605|0.083224|0.106153|0.123672|0.500000| |2.505685|2.792010|3.436578|3.733051|6.256819|4.014211|3.120869|2.835869|3.065097|3.870029|4.750673|9.652263|6.745053|56.463925|17.621232|8.850509|10.899748|9.748655|4.736724|3.775894|3.089850|4.273766|5.387997|3.917171|3.314861|3.291371|17.879207|4.650209|3.926597|3.121453|2.420173|2.089031|0.061931|0.066694|0.073807|0.070065|0.078403|0.108808|0.089296|0.087772|0.106166|0.077668|0.068049|0.109135|0.500000| |2.307656|2.643043|3.173236|3.708720|6.227047|3.990525|3.103476|2.820580|3.049057|3.846038|4.717971|9.568864|6.699274|56.465312|17.610682|8.869341|11.029769|9.598074|4.733683|3.919457|3.132320|4.212371|5.192092|3.614121|3.266473|2.928227|17.818382|4.557588|3.862387|3.243167|2.590874|2.191306|0.057976|0.061052|0.066267|0.068050|0.075457|0.095199|0.081485|0.089861|0.109398|0.077228|0.067652|0.108294|0.303347|0.500000| |1.937900|2.111081|2.421627|2.610529|4.055624|2.726291|2.280481|2.148816|2.327963|2.796537|3.120025|5.423957|3.786066|31.970995|7.727507|9.406898|10.874461|26.077121|9.274356|5.758453|4.565867|6.659762|9.894997|6.864480|5.483104|4.678140|14.509478|3.829961|3.212131|2.636172|2.095336|1.773896|0.049469|0.051524|0.056736|0.054214|0.060346|0.073797|0.063349|0.064737|0.076030|0.058117|0.053265|0.081804|0.212655|0.211441|0.500000| |1.851846|2.002977|2.146542|2.279012|3.215897|2.089983|1.817849|1.678598|1.729160|1.953900|2.189389|3.532803|2.743856|25.221898|4.194960|6.195274|13.028175|8.813773|8.718489|17.866614|8.503744|7.914038|8.030645|4.111995|3.497075|3.458906|10.894174|2.774124|2.498517|2.020568|1.571838|1.414663|0.048718|0.047884|0.054443|0.051456|0.059803|0.064728|0.054491|0.057421|0.069749|0.048353|0.042678|0.054623|0.101907|0.109070|0.138169|0.500000| |1.500189|1.579693|1.671842|1.735284|2.449341|1.649411|1.472754|1.390547|1.441622|1.603483|1.736276|2.703302|2.030756|17.145173|2.808419|3.579852|6.622950|5.650128|5.910719|8.536222|17.781336|12.611061|8.304384|4.301308|3.822565|3.927669|9.348513|2.408099|2.161235|1.739294|1.351816|1.214722|0.039866|0.039383|0.044025|0.041043|0.046339|0.049913|0.043464|0.044564|0.051573|0.039269|0.035836|0.045439|0.073706|0.075136|0.101221|0.193151|0.500000| |1.714021|1.811073|2.039529|2.117001|3.214920|2.228225|1.930427|1.857891|2.016603|2.356901|2.517341|4.090373|2.833143|22.498543|4.419908|5.047618|7.249392|10.140981|7.224801|4.844305|4.597723|7.929723|12.660961|17.590260|8.888244|8.965326|13.014746|3.499172|2.922041|2.346954|1.846310|1.572830|0.044077|0.046076|0.050509|0.046650|0.051238|0.062106|0.054411|0.053263|0.060437|0.049617|0.046844|0.069836|0.134652|0.117569|0.249879|0.109835|0.102446|0.500000| |1.410383|1.482253|1.641118|1.709720|2.573337|1.836190|1.637298|1.612442|1.761982|2.012717|2.065409|3.194305|2.183383|16.490229|2.967664|3.188924|4.917023|5.570774|4.309303|3.483127|3.665777|6.421985|7.635497|8.819410|17.553986|6.864917|11.807448|3.210436|2.657710|2.172262|1.729137|1.453028|0.036692|0.038257|0.041000|0.038850|0.041715|0.048767|0.044357|0.044084|0.048421|0.042239|0.041255|0.060494|0.087031|0.084020|0.130620|0.081934|0.087950|0.212678|0.500000| |1.473224|1.570927|1.741347|1.848974|2.790282|1.965493|1.732465|1.689306|1.839851|2.120699|2.212779|3.491742|2.402138|18.564283|3.454381|3.832011|5.792592|7.079005|5.596052|4.381659|4.455890|7.617542|9.575217|8.779402|17.550903|5.469802|12.145182|3.258459|2.714673|2.262221|1.820374|1.522280|0.038339|0.039657|0.042662|0.041215|0.044598|0.051588|0.046545|0.047611|0.053059|0.044653|0.042962|0.063328|0.096994|0.100948|0.170126|0.101051|0.103250|0.212956|0.300742|0.500000| |1.367575|1.438451|1.571149|1.639594|2.424809|1.704883|1.524151|1.485520|1.597926|1.806385|1.880255|2.910075|2.042552|15.893057|2.807817|3.183732|5.072567|5.609711|4.886901|4.162331|4.805551|9.218191|9.509322|8.832975|17.590861|6.805598|10.640948|2.841490|2.415715|1.976028|1.566857|1.341331|0.035832|0.036804|0.039781|0.037710|0.040911|0.046622|0.042045|0.042355|0.047052|0.039713|0.038156|0.053315|0.079177|0.078997|0.122398|0.094556|0.114895|0.173946|0.300440|0.301388|0.500000| |1.635318|1.682106|1.846093|1.853351|2.711656|1.869497|1.657342|1.589073|1.686057|1.907691|2.033133|3.184759|2.292792|18.402981|3.206853|3.747814|6.087371|6.345363|5.316793|4.330864|4.632576|8.204171|9.656380|8.809733|5.476824|17.575409|10.990880|2.921431|2.529693|1.973095|1.519161|1.341528|0.042469|0.043874|0.048835|0.043107|0.047753|0.056581|0.049273|0.046804|0.052942|0.043415|0.040676|0.055295|0.095666|0.082064|0.127186|0.099398|0.108453|0.215180|0.140436|0.122807|0.139732|0.500000| |1.492644|1.538887|1.695917|1.716324|2.543461|1.793386|1.602884|1.562782|1.681896|1.902738|1.979832|3.055840|2.139874|16.473506|2.878980|3.169086|5.031202|5.351941|4.233810|3.466357|3.713756|6.593324|7.654812|8.854282|6.855279|17.553689|11.166684|3.014715|2.556611|2.010853|1.560139|1.354397|0.038781|0.040460|0.044076|0.039853|0.043274|0.051273|0.045842|0.043804|0.048487|0.041712|0.040111|0.056140|0.086871|0.076577|0.116044|0.081396|0.089536|0.215824|0.205571|0.140535|0.167887|0.300582|0.500000| |1.438787|1.485771|1.613967|1.639382|2.390298|1.664297|1.491365|1.441947|1.532566|1.719427|1.807881|2.791580|1.997807|15.799035|2.715795|3.142341|5.166381|5.341801|4.734127|4.102647|4.885549|9.694186|9.454321|8.815618|6.821483|17.610392|10.136209|2.695823|2.333219|1.846673|1.433120|1.258845|0.037687|0.038669|0.042478|0.038515|0.042249|0.048644|0.043178|0.041958|0.046927|0.039152|0.037140|0.050081|0.078621|0.072255|0.109248|0.093109|0.118038|0.174530|0.169494|0.139508|0.202108|0.301247|0.300411|0.500000| |1.572171|1.730444|1.953213|2.183153|3.433537|2.961220|3.050833|3.626548|4.357932|4.069347|3.309246|3.917139|2.517043|14.926011|2.134583|1.850022|3.033636|2.453505|1.611593|1.489521|1.378262|1.907373|2.095143|1.588036|1.610741|1.447639|38.313485|8.956876|7.528631|12.564379|17.600730|7.191433|0.040697|0.044523|0.042483|0.048824|0.046190|0.052351|0.056299|0.062314|0.057131|0.075035|0.097449|0.118852|0.060096|0.064806|0.053555|0.041182|0.035784|0.047610|0.045366|0.047791|0.041405|0.039509|0.040686|0.037635|0.500000| |1.800438|2.020408|2.337352|2.694352|4.422842|3.944690|3.925446|4.652142|5.965650|5.916844|4.626961|5.266818|3.266372|18.497784|2.629241|2.205040|3.578556|2.878219|1.850325|1.696538|1.545794|2.130518|2.368974|1.784781|1.789600|1.606457|43.783204|9.818907|7.858405|12.213441|17.502085|6.823246|0.046115|0.050722|0.048638|0.056749|0.053896|0.062485|0.067079|0.076560|0.069999|0.092360|0.116020|0.169634|0.073676|0.081256|0.063075|0.047086|0.039822|0.054147|0.049983|0.053483|0.045565|0.044027|0.044858|0.041432|0.300226|0.500000| |1.662481|1.822323|2.099509|2.327841|3.776674|3.311921|3.296809|3.975682|5.326731|5.309838|3.961736|4.642187|2.845249|16.525425|2.423209|2.060937|3.321842|2.751952|1.782459|1.619831|1.495155|2.089481|2.325908|1.789266|1.809098|1.625706|49.073172|13.912606|8.393483|12.434449|17.675494|5.649768|0.042606|0.047183|0.045357|0.050673|0.048451|0.057095|0.060852|0.064914|0.060475|0.078544|0.102153|0.172584|0.069834|0.073716|0.060983|0.044393|0.038490|0.054410|0.051414|0.053619|0.045913|0.044324|0.046034|0.041825|0.301828|0.298762|0.500000| |1.814703|1.986620|2.225274|2.426203|3.682287|3.324957|3.972689|5.309771|5.312154|3.970880|3.316861|3.677236|2.487942|14.442315|1.937874|1.681109|2.821367|2.171900|1.431170|1.338291|1.235212|1.693446|1.847501|1.385494|1.366618|1.290148|49.048439|8.396767|13.919630|12.434682|5.649410|17.675279|0.046902|0.052747|0.047907|0.057563|0.051469|0.057698|0.066736|0.071966|0.061044|0.101468|0.174959|0.101335|0.054804|0.056449|0.046321|0.037390|0.032261|0.041498|0.038257|0.039775|0.035362|0.035875|0.036129|0.033569|0.146957|0.139875|0.127354|0.500000| |1.920640|2.160330|2.446359|2.790672|4.321593|3.955651|4.639537|5.945134|5.945368|4.625982|3.940623|4.305806|2.905403|16.533133|2.198394|1.881601|3.149787|2.407480|1.572297|1.470754|1.344316|1.832344|2.007017|1.492235|1.472584|1.371501|43.738281|7.851446|9.823825|12.213045|6.826679|17.501148|0.049494|0.054974|0.050608|0.062743|0.056511|0.062964|0.071980|0.083875|0.070536|0.115224|0.172759|0.114606|0.061178|0.065149|0.051358|0.041317|0.035011|0.044790|0.040900|0.043286|0.038004|0.038081|0.038136|0.035643|0.171739|0.196796|0.139893|0.298704|0.500000| |1.640836|1.805504|2.008104|2.227410|3.390813|2.965330|3.313012|4.077111|4.351885|3.616636|3.057548|3.513447|2.358657|13.947487|1.908301|1.666246|2.786660|2.171804|1.436523|1.345394|1.244322|1.706160|1.857440|1.391882|1.390412|1.285927|38.307636|7.532120|8.957613|12.565224|7.188220|17.600749|0.042686|0.046973|0.043625|0.052023|0.047610|0.052602|0.058765|0.065600|0.057383|0.084363|0.120242|0.096493|0.053428|0.056555|0.046534|0.037555|0.032530|0.041505|0.038903|0.040795|0.036041|0.035481|0.035972|0.033575|0.222280|0.171498|0.146964|0.301841|0.300282|0.500000| 2156.588492 -12089.497356 4502.783588 -234.762096 -5664.887372 3505.958101 -2158.929271 2.001085 4086600000000016 44C30C315AA226AE 4443329687B189C2 415465B300000000 C026000000000000 42F417DD1A16BF40