Version2.0 2020-04-08T01:00:21Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 24-Mar-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCc1ccccc1NC(=O)CSc2nnc(n2CC)[C@H](C(C)C)NC(=O)c3ccc4c(c3)OCO4 C10002755 RHF 6-31G(d) (6D,7F) CCc1ccccc1NC(=O)CSc2nnc(n2CC)[C@H](C(C)C)NC(=O)c3ccc4c(c3)OCO4 C01[X(C26H31N5O4S1)] 195 C1 606 CCn1c(SCC(=O)Nc2ccccc2CC)nnc1[C@H](C(C)C)NC(=O)c1ccc2c(c1)OCO2 CCn1c(SCC(=O)Nc2ccccc2CC)nnc1[C@H](C(C)C)NC(=O)c1ccc2c(c1)OCO2 CCn1c(SCC(=O)Nc2ccccc2CC)nnc1[C@@H](NC(=O)c3ccc4OCOc4c3)C(C)C InChIKey=WJQKIXQYIHGGKD-QHCPKHFHSA-N InChI=1S/C26H31N5O4S/c1-5-17-9-7-8-10-19(17)27-22(32)14-36-26-30-29-24(31(26)6-2)23(16(3)4)28-25(33)18-11-12-20-21(13-18)35-15-34-20/h7-13,16,23H,5-6,14-15H2,1-4H3,(H,27,32)(H,28,33)/t23-/m0/s1 InChI=1/C26H31N5O4S/c1-5-17-9-7-8-10-19(17)27-22(32)14-36-26-30-29-24(31(26)6-2)23(16(3)4)28-25(33)18-11-12-20-21(13-18)35-15-34-20/h7-13,16,23H,5-6,14-15H2,1-4H3,(H,27,32)(H,28,33)/t23-/m0/s1/f/h27-28H CCc1ccccc1NC(=O)CSc2nnc(n2CC)[C@H](C(C)C)NC(=O)c3ccc4c(c3)OCO4 C01[X(C26H31N5O4S1)] 195 C01 606 CCn1c(SCC(=O)Nc2ccccc2CC)nnc1[C@H](C(C)C)NC(=O)c1ccc2c(c1)OCO2 CCN1[C@H](SCC(=O)Nc2ccccc2CC)NN[C@@H]1[C@H](C(C)C)NC(=O)c1ccc2c(c1)OCO2 CCN1[C@@H](NN[C@@H]1[C@@H](NC(=O)c2ccc3OCOc3c2)C(C)C)SCC(=O)Nc4ccccc4CC InChIKey=KEVCRDYZGPXOHT-KYPHJKQUSA-N InChI=1S/C26H35N5O4S/c1-5-17-9-7-8-10-19(17)27-22(32)14-36-26-30-29-24(31(26)6-2)23(16(3)4)28-25(33)18-11-12-20-21(13-18)35-15-34-20/h7-13,16,23-24,26,29-30H,5-6,14-15H2,1-4H3,(H,27,32)(H,28,33)/t23-,24-,26+/m0/s1 InChI=1/C26H35N5O4S/c1-5-17-9-7-8-10-19(17)27-22(32)14-36-26-30-29-24(31(26)6-2)23(16(3)4)28-25(33)18-11-12-20-21(13-18)35-15-34-20/h7-13,16,23-24,26,29-30H,5-6,14-15H2,1-4H3,(H,27,32)(H,28,33)/t23-,24-,26+/m0/s1/f/h27-28H 3781.3451604224 -1971.8427778 1-A 35002.6649 135 471 606 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4669.36 4683.38 4692.83 4696.59 4700.84 4701.08 4709.59 4717.63 4726.75 4731.27 4735.56 4738.85 4748.74 4775.05 4785.33 4796.47 4822.49 4846.59 4871.77 4876.41 4904.74 4934.75 4938.86 5569.52 5593.75 0.589296 0.622977 0.623922 0.516112 -1971.253482 -1971.219800 -1971.218856 -1971.326666 3.615965D-04 MUNgauss RevisionA2.0 retrievium 08-Apr-2020 DUDE CCc1ccccc1NC(=O)CSc2nnc(n2CC)[C@H](C(C)C)NC(=O)c3ccc4c(c3)OCO4 C10002755 RHF 6-31G(d) (6D,10F) C1 509.209677 |X|Y|Z| 75.396899 38.860924 166.756670 78.761977 27 6 7 8 16 19 5 2 1 |36.858105| |12.407665|36.858105| |7.461667|12.562876|36.858105| |5.618994|7.584698|13.697058|36.858105| |4.125729|5.014908|7.864470|13.782551|36.858105| |3.720104|4.419951|6.817886|7.974320|13.761214|36.858105| |4.126750|4.978964|7.874913|6.912631|7.949204|13.785086|36.858105| |5.617119|7.457332|13.645748|7.974947|6.867606|7.930975|13.713604|36.858105| |5.423083|6.556760|7.840740|5.163912|4.541913|5.147091|7.821145|13.409234|53.358707| |3.982807|4.652691|5.246117|3.959520|3.714268|4.339719|6.268746|7.676462|19.086972|36.858105| |3.326039|3.926956|4.613197|3.738952|3.701768|4.513577|6.422827|6.588362|11.445389|15.931790|73.516695| |3.645365|3.957745|4.013145|3.148911|2.919947|3.255715|4.245437|5.045152|10.811875|12.530125|14.196702|36.858105| |2.716439|2.942996|3.027915|2.536417|2.439112|2.736789|3.390677|3.660713|6.530454|6.997093|11.893784|10.516345|388.023441| |2.515311|2.612557|2.574168|2.185221|2.075136|2.260265|2.699665|2.952674|5.104145|4.681139|7.535316|7.102189|76.972005|36.858105| |2.702859|2.729335|2.606795|2.195536|2.050113|2.195253|2.605535|2.922283|5.083749|4.355279|6.667450|6.670399|49.760568|14.853548|53.358707| |2.327830|2.318466|2.208531|1.904621|1.790256|1.899732|2.200098|2.421474|4.021908|3.323844|5.294728|4.519794|35.176266|8.948779|19.012575|53.358707| |2.072684|2.095339|2.033795|1.777464|1.693687|1.810369|2.083183|2.243453|3.657924|3.084529|5.105932|4.032188|35.194732|8.893851|12.093849|20.238959|36.858105| |2.134222|2.203942|2.180152|1.897393|1.822460|1.976116|2.302323|2.456723|4.048903|3.577684|6.056119|4.750399|49.317249|13.978989|11.887258|11.933757|13.935460|53.358707| |1.906989|1.990884|2.006902|1.776936|1.734306|1.894447|2.181997|2.266518|3.626218|3.215091|5.735737|3.930748|42.199518|7.534702|7.222048|7.213392|7.449915|17.748853|36.858105| |1.836030|1.952060|1.965104|1.751117|1.709246|1.856250|2.117421|2.196923|3.456143|3.059605|5.601393|3.584235|37.577903|5.770101|5.904438|5.760000|5.379610|10.375468|12.486840|36.858105| |1.793944|1.803113|1.752085|1.558118|1.493643|1.586088|1.791827|1.905152|3.016392|2.482577|4.189503|3.056844|25.745881|5.264597|7.190229|10.514642|12.611499|10.114940|5.986520|4.674331|36.858105| |1.696321|1.708804|1.681680|1.505771|1.456847|1.556599|1.753569|1.839515|2.888068|2.387926|4.092209|2.883320|24.815364|4.787980|6.157812|8.013953|8.974077|9.390216|6.487300|4.791143|17.634106|0.500000| |1.679164|1.705399|1.648183|1.475520|1.412375|1.488534|1.665597|1.771122|2.766059|2.264089|3.866718|2.716802|22.776010|4.318576|5.800481|7.587761|7.486331|7.768761|5.144133|4.722573|12.296589|0.246821|36.858105| |1.484216|1.500913|1.457647|1.321105|1.272424|1.337382|1.479046|1.556415|2.388474|1.929395|3.328385|2.246818|18.450383|3.264864|4.382113|5.420297|4.907122|5.566668|4.011845|3.772791|7.517904|0.198308|12.442651|36.858105| |1.748209|1.770990|1.681237|1.500202|1.420224|1.480498|1.652282|1.781554|2.781916|2.241472|3.775415|2.691312|21.494198|4.016108|5.766561|7.483839|6.138489|6.447101|4.039105|3.918182|7.415687|0.152235|12.445510|7.553640|36.858105| |1.769153|1.745331|1.682128|1.500566|1.433193|1.510894|1.696380|1.810248|2.847734|2.283764|3.804271|2.782057|21.912952|4.274418|6.376796|9.458932|7.950107|7.049135|4.236748|3.465855|13.137332|0.259306|7.631275|6.238138|6.301824|53.358707| |1.624993|1.593917|1.549016|1.395604|1.342712|1.416709|1.578061|1.664838|2.583013|2.052622|3.450269|2.436267|19.004261|3.478983|5.032691|6.645248|5.440459|5.591538|3.634268|2.991710|7.786052|0.214130|5.494217|5.428644|4.544114|19.087803|36.858105| |1.523152|1.504669|1.477652|1.339598|1.299123|1.377158|1.528829|1.594930|2.455724|1.964168|3.349777|2.296434|18.319400|3.251163|4.486029|5.603889|4.828344|5.351834|3.722479|3.047394|6.879487|0.229661|5.141503|5.520924|4.000353|11.533329|15.824298|73.516695| |1.594044|1.541270|1.489028|1.347171|1.292548|1.354311|1.498673|1.584777|2.438838|1.899330|3.169664|2.224416|16.654384|2.943162|4.382839|5.531492|4.111102|4.438093|2.884629|2.451964|5.026678|0.134011|4.018167|4.025272|3.701108|10.667237|12.701874|14.363856|36.858105| |1.639018|1.572348|1.499614|1.354769|1.289465|1.339659|1.478834|1.578986|2.427412|1.866790|3.087413|2.185475|15.934679|2.802922|4.306384|5.415182|3.789487|4.088841|2.609182|2.277593|4.390149|0.110438|3.740826|3.657145|3.748494|8.968897|7.516462|9.431157|13.763262|36.858105| |1.571472|1.492606|1.420812|1.292279|1.229821|1.270470|1.391649|1.483459|2.255354|1.709476|2.827394|1.966295|14.047725|2.387605|3.647413|4.348275|3.007279|3.396842|2.206141|1.957702|3.325046|0.085937|2.943449|2.917059|2.995489|6.057828|4.985089|7.103304|7.842238|13.617291|36.858105| |1.477907|1.402816|1.347988|1.233949|1.182284|1.224549|1.335716|1.410888|2.128965|1.611645|2.683154|1.831178|13.124560|2.186402|3.271038|3.799818|2.684342|3.115705|2.067006|1.828398|2.955766|0.079264|2.602957|2.627156|2.566841|5.166104|4.495896|6.852017|6.957084|8.093282|13.949603|36.858105| |1.443845|1.379825|1.339519|1.227548|1.184044|1.235043|1.349495|1.414162|2.135265|1.631349|2.734878|1.852548|13.508409|2.249297|3.301438|3.836144|2.789586|3.259808|2.194741|1.913949|3.126908|0.086710|2.690117|2.753654|2.550443|5.434174|5.130869|8.191276|8.071212|6.982282|7.923490|13.766750|36.858105| |1.490934|1.437314|1.400395|1.277088|1.233619|1.294527|1.423774|1.490854|2.270000|1.758076|2.954850|2.020783|15.063501|2.564588|3.732738|4.458056|3.337986|3.818986|2.568416|2.194075|3.901420|0.110362|3.220894|3.312773|2.940082|7.080325|7.706730|12.156891|13.545607|7.862225|6.729000|7.929431|13.997487|36.858105| |1.351364|1.289392|1.258515|1.161740|1.125950|1.173736|1.274172|1.325970|1.982507|1.506330|2.538853|1.685000|12.231175|1.986481|2.877912|3.248849|2.371085|2.853057|1.955154|1.721099|2.603158|0.073272|2.282987|2.348881|2.164247|4.283485|3.870789|6.574999|5.189277|4.682336|5.397115|8.537524|14.024793|7.764280|73.516695| |1.316213|1.248835|1.212115|1.122563|1.084602|1.123200|1.213119|1.266300|1.882476|1.416752|2.381886|1.574366|11.271580|1.813845|2.647177|2.957760|2.125456|2.569733|1.754458|1.567561|2.299169|0.063604|2.062890|2.112518|2.004619|3.741948|3.217512|5.365198|4.216161|4.224092|5.357921|8.596420|8.591660|5.363533|24.087715|36.858105| |1.397977|1.320656|1.270206|1.170749|1.123527|1.159120|1.255388|1.321693|1.974551|1.481382|2.472303|1.659253|11.774882|1.917182|2.846451|3.214947|2.267838|2.698817|1.811788|1.622134|2.445238|0.066114|2.198488|2.224118|2.182872|4.073081|3.422560|5.459626|4.678127|5.208635|7.774498|14.097209|8.542688|5.406631|14.923326|13.500227|73.516695| |17.530055|8.697483|6.711677|4.954055|3.897462|3.717924|4.309766|5.885396|8.441414|4.428849|6.350133|4.136604|21.113614|2.760257|4.083327|3.470427|2.246037|3.145509|2.042780|1.935128|1.924164|0.050553|1.774696|1.561462|1.835588|2.592293|1.749061|2.905631|1.717061|1.760237|1.683501|1.584761|1.552075|1.606031|2.576910|1.406148|2.655731|0.500000| |17.564088|8.775435|6.772585|5.910832|4.342465|3.758379|3.950654|5.018152|6.152788|3.432446|5.280225|3.109643|17.118398|2.231190|3.228759|2.829263|1.872824|2.621039|1.742896|1.678816|1.642340|0.043440|1.539632|1.374923|1.594247|2.213374|1.509266|2.527735|1.488433|1.527261|1.475688|1.398432|1.367688|1.404453|2.292738|1.260295|2.369114|0.302965|0.500000| |17.550635|8.770196|5.461428|4.416544|3.398304|3.093340|3.387848|4.393458|6.076605|3.511090|5.265532|3.377637|18.297633|2.453966|3.650929|3.186840|2.066876|2.854094|1.860847|1.797148|1.798642|0.046886|1.694412|1.497574|1.787078|2.431908|1.634806|2.706753|1.612818|1.676243|1.612882|1.506305|1.458954|1.500577|2.420029|1.333120|2.534787|0.301689|0.301102|0.500000| |8.818947|17.552934|8.871953|5.709609|4.220287|3.961506|4.660773|6.969897|9.894232|5.329456|7.720540|4.642066|23.770405|2.954576|4.221907|3.518929|2.317355|3.332852|2.184670|2.153640|1.967229|0.051380|1.865834|1.623056|1.951179|2.571033|1.704442|2.849031|1.635537|1.670748|1.572063|1.466476|1.441644|1.511058|2.378005|1.291493|2.436888|0.207520|0.172857|0.213054|0.500000| |8.887135|17.564091|8.961788|7.298797|4.795103|4.010758|4.219074|5.642233|6.660918|3.804598|5.987977|3.310699|18.446929|2.331435|3.299319|2.858296|1.914965|2.727737|1.828905|1.814435|1.670021|0.043996|1.598147|1.416651|1.667884|2.202496|1.482289|2.493314|1.436701|1.470035|1.401379|1.317678|1.292819|1.342023|2.153622|1.178159|2.214298|0.172711|0.212358|0.213509|0.305499|0.500000| |5.543126|7.105024|8.947048|17.699382|8.947054|5.664583|4.971133|5.664524|5.693361|3.330863|5.584248|2.773850|16.163722|2.003921|2.764692|2.428647|1.663039|2.391307|1.644556|1.627133|1.470301|0.039373|1.401190|1.260255|1.434116|1.937878|1.326135|2.259062|1.286854|1.301214|1.247451|1.190150|1.178533|1.220310|1.985867|1.084788|2.015033|0.128013|0.171538|0.125866|0.146280|0.222839|0.500000| |3.524115|4.100112|5.616766|8.924040|17.718832|8.899784|5.647115|4.949350|4.920745|3.079740|5.518265|2.508347|15.308861|1.859491|2.501103|2.213147|1.546454|2.252878|1.586343|1.569194|1.378003|0.037431|1.309193|1.188085|1.316320|1.804896|1.248733|2.153759|1.205867|1.203437|1.152613|1.111486|1.112852|1.155509|1.889066|1.026308|1.885670|0.091838|0.105380|0.083258|0.097481|0.113964|0.215880|0.500000| |3.091280|3.537592|4.923616|5.656871|8.902697|17.720523|8.951136|5.648193|5.683968|3.758176|7.190783|2.911706|18.120025|2.112681|2.767905|2.421881|1.713824|2.551231|1.822013|1.787030|1.514444|0.041579|1.422533|1.286829|1.405072|1.961455|1.360239|2.365643|1.299295|1.278855|1.214200|1.176322|1.191549|1.248998|2.021837|1.086759|1.983687|0.086511|0.087318|0.073376|0.090240|0.091189|0.124322|0.213914|0.500000| |3.525809|4.067374|5.628822|4.978030|5.654651|8.929832|17.786739|8.938658|9.792853|6.787946|13.624787|4.519713|26.606184|2.884956|3.705546|3.116861|2.193126|3.350994|2.360066|2.271012|1.878758|0.051486|1.733318|1.537802|1.698245|2.402985|1.646244|2.852401|1.552233|1.517758|1.421058|1.368429|1.392710|1.478143|2.337634|1.244024|2.278968|0.104880|0.093054|0.082916|0.110548|0.097068|0.107925|0.124166|0.215790|0.500000| |6.584666|7.197200|7.196897|4.769835|4.038468|4.316099|5.876114|9.215387|26.091022|9.469083|10.881721|7.783832|32.097648|3.803851|5.425354|4.268384|2.773799|4.073730|2.614753|2.464375|2.278530|0.059967|2.077997|1.788095|2.114154|2.969319|1.969874|3.292768|1.876457|1.885986|1.756874|1.649066|1.641581|1.737937|2.699316|1.447047|2.717022|0.229557|0.142671|0.149794|0.228139|0.142764|0.112264|0.091633|0.099301|0.149957|0.500000| |3.680628|3.757836|3.793009|3.013940|2.806002|3.120833|4.019328|4.700152|9.695293|8.848624|10.954693|17.614094|56.444803|6.749186|9.491710|6.467502|4.106259|6.306498|3.762707|3.283037|3.116550|0.081907|2.687814|2.239317|2.645075|3.965090|2.574740|4.281834|2.377420|2.331069|2.102659|1.965018|1.990989|2.168550|3.216231|1.685583|3.160538|0.120953|0.087932|0.094602|0.117779|0.086900|0.074151|0.067345|0.078054|0.119201|0.213229|0.500000| |3.893648|4.250434|4.018609|3.121809|2.811172|3.023766|3.812730|4.711981|9.654697|8.848766|10.974886|17.617075|56.471389|6.730735|9.640256|6.455274|4.060843|6.219159|3.683700|3.461640|3.078792|0.078703|2.793687|2.286713|2.861817|3.842160|2.431493|4.018919|2.233347|2.234288|2.009589|1.847526|1.845672|2.003728|2.967648|1.571286|2.972605|0.120557|0.089832|0.103301|0.146284|0.099065|0.077881|0.067472|0.074550|0.107549|0.213420|0.303412|0.500000| |1.939269|2.029228|2.081703|1.845675|1.820075|2.015852|2.338095|2.390199|3.822314|3.447881|6.284357|4.129264|46.168369|6.975291|6.652571|6.257589|5.830921|12.551199|17.600224|8.832386|4.747482|0.145137|4.031675|3.332137|3.316324|4.987700|3.277829|6.026070|2.679004|2.417016|2.078905|1.975466|2.109610|2.446563|3.384891|1.706804|3.107516|0.058011|0.049432|0.051980|0.061397|0.051500|0.047078|0.046132|0.054173|0.071497|0.075444|0.110669|0.102699|0.500000| |1.751083|1.807917|1.816823|1.624722|1.589433|1.725968|1.962684|2.028507|3.194701|2.752693|4.888785|3.290094|32.053259|5.711920|6.165621|6.679916|7.140949|12.588136|17.642627|8.836639|6.905008|0.239867|5.766408|4.679809|4.162438|6.379648|4.128937|7.870419|3.149787|2.769894|2.315315|2.182644|2.353265|2.808815|3.710322|1.850936|3.375715|0.052020|0.044783|0.047686|0.054592|0.046411|0.042030|0.040666|0.046351|0.058666|0.064507|0.089879|0.086690|0.304581|0.500000| |1.975172|2.135275|2.158889|1.909793|1.860655|2.028927|2.335611|2.433099|3.855330|3.500958|6.522313|4.070845|45.073915|6.067844|6.064738|5.534465|4.805434|9.287272|8.777306|17.593589|3.981543|0.109690|3.987057|3.209629|3.550920|4.218477|2.677695|4.763129|2.254769|2.129258|1.852623|1.728281|1.792385|2.026287|2.880402|1.488107|2.746192|0.057628|0.049880|0.053448|0.066075|0.055000|0.049029|0.047171|0.053983|0.069677|0.075355|0.099346|0.109128|0.210671|0.172897|0.500000| |1.691982|1.799309|1.829061|1.650643|1.627674|1.771910|1.998946|2.040424|3.146880|2.753293|5.142848|3.100323|31.037754|4.468996|4.799228|4.723217|4.283230|7.587188|8.881864|17.558447|3.977540|0.117904|4.056089|3.483149|3.359169|4.166963|2.740551|5.084425|2.267318|2.091592|1.816977|1.716871|1.809243|2.066595|2.922479|1.495840|2.727142|0.049335|0.043359|0.045864|0.054539|0.046736|0.042662|0.041774|0.047858|0.059797|0.061877|0.079779|0.082294|0.213520|0.214017|0.301690|0.500000| |1.777643|1.881670|1.866781|1.667197|1.615179|1.732659|1.959476|2.053323|3.212442|2.777402|4.991881|3.259659|31.651174|5.188278|5.701212|5.839898|5.488089|9.331432|8.784378|17.587201|5.045105|0.137848|5.681623|4.380380|4.689400|4.982554|3.093174|5.543343|2.519799|2.364100|2.017871|1.864814|1.937451|2.221614|3.076485|1.582535|2.929962|0.051750|0.045118|0.048830|0.057807|0.048924|0.043387|0.041345|0.046186|0.057584|0.064444|0.083486|0.090493|0.172856|0.210303|0.301496|0.301121|0.500000| |1.684850|1.733432|1.687121|1.510503|1.451039|1.536102|1.722238|1.823349|2.846975|2.365524|4.096113|2.824048|24.665468|4.572690|5.756731|6.974213|7.062854|8.561245|6.181301|6.145803|8.945447|0.215100|17.512590|8.947652|8.929902|7.646522|4.388637|7.674223|3.343338|3.112367|2.537004|2.287490|2.373587|2.797604|3.657798|1.866410|3.499253|0.049290|0.042876|0.046967|0.052864|0.045157|0.039716|0.037325|0.040845|0.050000|0.058741|0.076019|0.080179|0.127401|0.190082|0.136467|0.142302|0.227744|0.500000| |1.419835|1.443302|1.399735|1.274153|1.227204|1.284984|1.413437|1.486032|2.263096|1.821817|3.160961|2.093559|17.095154|2.931071|3.915172|4.665543|4.067220|4.848584|3.566316|3.560662|5.476934|0.144640|8.816277|17.547127|6.918641|6.395106|4.178531|7.528479|3.338693|3.140500|2.594858|2.346777|2.425807|2.829050|3.745362|1.924905|3.599736|0.041196|0.036596|0.039881|0.043351|0.038077|0.033874|0.031922|0.034375|0.040674|0.046916|0.057346|0.059549|0.083259|0.111844|0.085270|0.092834|0.117490|0.215711|0.500000| |1.434764|1.452700|1.424090|1.295348|1.255908|1.326872|1.466055|1.529130|2.338346|1.897266|3.301928|2.191810|18.253418|3.169859|4.146880|5.001734|4.618406|5.489869|4.192631|3.859498|6.918550|0.216981|8.739765|17.563660|5.479454|7.668079|5.375772|10.862349|3.907349|3.397714|2.751528|2.550342|2.745543|3.349199|4.215970|2.102539|3.861298|0.042010|0.037066|0.039963|0.043428|0.038040|0.034232|0.032614|0.035638|0.042597|0.048319|0.060875|0.061001|0.097762|0.143570|0.089298|0.102188|0.120643|0.212594|0.301123|0.500000| |1.457939|1.460485|1.412151|1.281989|1.232214|1.290016|1.422353|1.499876|2.295552|1.832544|3.137930|2.129322|17.015510|3.001526|4.157314|5.207795|4.467780|4.934164|3.443570|3.179251|6.730974|0.173100|8.771743|17.571648|6.844467|9.269784|6.275465|10.824499|4.733245|4.320535|3.364899|2.986113|3.112689|3.773776|4.627195|2.338667|4.418654|0.042658|0.037604|0.041027|0.043692|0.038321|0.034076|0.032011|0.034456|0.040926|0.048063|0.059653|0.060381|0.081950|0.109238|0.077292|0.081842|0.099292|0.173907|0.301772|0.302233|0.500000| |1.929650|1.963037|1.847769|1.631684|1.533378|1.597327|1.796549|1.959985|3.100868|2.510183|4.176891|3.079763|24.396685|4.705966|6.983677|9.018019|6.845790|7.216493|4.237649|4.133402|6.759871|0.138814|8.718297|5.474554|17.578359|7.759374|4.093906|6.368129|3.428873|3.522692|2.865262|2.456117|2.422417|2.757089|3.679465|1.928095|3.744319|0.056351|0.048402|0.054948|0.060807|0.051119|0.043239|0.039262|0.041830|0.051137|0.065837|0.083153|0.093141|0.096708|0.114991|0.107749|0.095434|0.135972|0.211601|0.141055|0.122184|0.139657|0.500000| |1.646821|1.679702|1.595067|1.433264|1.358758|1.410886|1.562949|1.679083|2.590791|2.078746|3.537807|2.440687|19.441403|3.441263|4.815260|5.805461|4.694501|5.400384|3.585142|3.682012|5.439123|0.123492|8.827028|6.930899|17.550585|6.435448|3.732460|6.078727|3.146983|3.199443|2.650814|2.303949|2.283399|2.585918|3.502768|1.842243|3.544758|0.047584|0.041878|0.046835|0.051306|0.044322|0.038212|0.035125|0.037278|0.044481|0.054359|0.065858|0.072168|0.082928|0.102248|0.093474|0.089748|0.125177|0.215476|0.208861|0.141236|0.170280|0.301620|0.500000| |1.715140|1.714905|1.619771|1.449385|1.369517|1.421277|1.579537|1.705233|2.650598|2.102879|3.516684|2.509801|19.395888|3.575125|5.330298|7.036456|5.372308|5.536975|3.461063|3.267399|6.658209|0.139197|8.785046|6.860646|17.557646|9.392425|4.981386|7.412051|4.217138|4.480169|3.491788|2.896372|2.820608|3.235939|4.180949|2.190958|4.314592|0.050109|0.043589|0.048976|0.052145|0.044914|0.038638|0.035340|0.037464|0.044923|0.056426|0.069732|0.074122|0.081627|0.100048|0.083423|0.079662|0.103946|0.173836|0.170347|0.139981|0.203682|0.301593|0.302122|0.500000| |1.900159|1.857640|1.771525|1.570225|1.488294|1.562218|1.759481|1.898343|3.008633|2.389170|3.916386|2.949331|22.398803|4.429708|7.124784|11.247381|7.734042|6.799659|3.899449|3.242751|9.156794|0.185209|6.243830|4.977703|6.057329|26.044096|9.394549|10.929228|7.418260|7.301673|4.860967|3.958132|3.973639|4.912599|5.545376|2.783421|5.529613|0.057080|0.048252|0.053646|0.056035|0.047675|0.041440|0.038145|0.041146|0.050561|0.064862|0.086771|0.084441|0.095387|0.113852|0.082945|0.078876|0.094556|0.134987|0.111648|0.123254|0.149894|0.164695|0.125894|0.192531|0.500000| |1.707554|1.644062|1.555132|1.398266|1.323467|1.371143|1.517396|1.632528|2.522881|1.943735|3.200843|2.296979|16.727275|2.993416|4.687723|6.070967|4.147298|4.356287|2.723930|2.404651|4.795627|0.114170|4.208813|3.974406|4.476427|9.932742|6.898488|8.651165|8.913696|17.744738|8.955828|5.733824|5.011092|5.607800|6.589206|3.451405|7.435233|0.050772|0.043908|0.048803|0.048899|0.042737|0.037349|0.034240|0.036212|0.043110|0.054633|0.067445|0.066214|0.069006|0.079461|0.062624|0.060613|0.070311|0.095098|0.095102|0.098498|0.130979|0.116732|0.103690|0.157455|0.246769|0.500000| |1.580254|1.493832|1.410676|1.284434|1.216677|1.249069|1.363692|1.460643|2.212441|1.662725|2.741582|1.902847|13.410746|2.256435|3.471414|4.071238|2.769028|3.161845|2.050099|1.846846|2.992527|0.076489|2.727160|2.679957|2.866775|5.243907|4.056092|5.928489|5.593235|8.800270|17.752575|8.929473|5.633156|4.879565|7.761034|4.651168|12.191077|0.046813|0.041239|0.045404|0.043673|0.039111|0.034601|0.031716|0.033077|0.038446|0.048084|0.056282|0.054542|0.053672|0.059066|0.048978|0.047564|0.053073|0.065893|0.067540|0.069433|0.084990|0.077032|0.071389|0.093278|0.119044|0.214343|0.500000| |1.445074|1.401224|1.376981|1.259261|1.223819|1.290811|1.419065|1.474155|2.238762|1.745363|2.958357|1.994426|15.098232|2.542051|3.609932|4.242482|3.273475|3.837446|2.647915|2.242049|3.843282|0.114207|3.155356|3.291665|2.789396|6.545323|7.179176|13.568385|8.827319|5.613616|4.881498|5.630079|8.917035|17.778140|12.125566|4.643490|7.757636|0.043229|0.037901|0.040150|0.040849|0.036330|0.033331|0.031870|0.034749|0.041160|0.047248|0.059317|0.054341|0.070735|0.081732|0.057078|0.059299|0.062487|0.077474|0.077915|0.095801|0.101741|0.072566|0.068712|0.083059|0.121168|0.123548|0.106355|0.500000| |1.230899|1.173160|1.139349|1.059077|1.024740|1.059522|1.140038|1.187338|1.757147|1.323573|2.235957|1.462996|10.528855|1.684284|2.439356|2.718796|1.971823|2.397529|1.652926|1.491192|2.150894|0.059688|1.966323|2.045144|1.913124|3.453458|2.954194|5.013144|3.747380|3.754867|4.625066|6.645595|6.640825|4.627524|16.564476|17.598705|16.565828|0.036333|0.032793|0.034656|0.033691|0.030869|0.028485|0.027006|0.028529|0.032447|0.037388|0.043178|0.040626|0.044563|0.048568|0.039271|0.039721|0.041978|0.049549|0.052236|0.056627|0.063077|0.050761|0.049341|0.058040|0.070568|0.087440|0.115298|0.115075|0.500000| 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