Version2.1 2021-01-07T09:25:12Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 18-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC(C)[C@H](c1nnc2n1CCN(CC2)C(=O)c3cccnc3OC)NC(=O)[C@@H]4CCOC4 C14986815 RHF 6-31G(d) (6D,7F) CC(C)[C@H](c1nnc2n1CCN(CC2)C(=O)c3cccnc3OC)NC(=O)[C@@H]4CCOC4 C01[X(C22H30N6O4)] 180 C1 540 COc1ncccc1C(=O)N1CCc2n(CC1)c(nn2)[C@@H](C(C)C)NC(=O)[C@H]1COCC1 COc1ncccc1C(=O)N1CCc2n(CC1)c(nn2)[C@@H](C(C)C)NC(=O)[C@H]1COCC1 COc1ncccc1C(=O)N2CCn3c(CC2)nnc3[C@H](NC(=O)[C@@H]4CCOC4)C(C)C InChIKey=FIODKAYXKYATGW-CRAIPNDOSA-N InChI=1S/C22H30N6O4/c1-14(2)18(24-20(29)15-7-12-32-13-15)19-26-25-17-6-9-27(10-11-28(17)19)22(30)16-5-4-8-23-21(16)31-3/h4-5,8,14-15,18H,6-7,9-13H2,1-3H3,(H,24,29)/t15-,18-/m1/s1 InChI=1/C22H30N6O4/c1-14(2)18(24-20(29)15-7-12-32-13-15)19-26-25-17-6-9-27(10-11-28(17)19)22(30)16-5-4-8-23-21(16)31-3/h4-5,8,14-15,18H,6-7,9-13H2,1-3H3,(H,24,29)/t15-,18-/m1/s1/f/h24H CC(C)[C@H](c1nnc2n1CCN(CC2)C(=O)c3cccnc3OC)NC(=O)[C@@H]4CCOC4 C01[X(C22H30N6O4)] 180 C01 540 COc1ncccc1C(=O)N1CCc2n(CC1)c(nn2)[C@@H](C(C)C)NC(=O)[C@H]1COCC1 CO[C]1[N][CH][CH][CH][C]1C(=O)N1CCN2C(=[N][N][C]2[C@@H](C(C)C)NC(=O)[C@H]2COCC2)CC1 CO[C]1[N][CH][CH][CH][C]1C(=O)N2CCN3[C]([N]N=C3CC2)[C@H](NC(=O)[C@@H]4CCOC4)C(C)C InChIKey=FIODKAYXKYATGW-CRAIPNDOSA-N InChI=1S/C22H30N6O4/c1-14(2)18(24-20(29)15-7-12-32-13-15)19-26-25-17-6-9-27(10-11-28(17)19)22(30)16-5-4-8-23-21(16)31-3/h4-5,8,14-15,18H,6-7,9-13H2,1-3H3,(H,24,29)/t15-,18-/m1/s1 InChI=1/C22H30N6O4/c1-14(2)18(24-20(29)15-7-12-32-13-15)19-26-25-17-6-9-27(10-11-28(17)19)22(30)16-5-4-8-23-21(16)31-3/h4-5,8,14-15,18H,6-7,9-13H2,1-3H3,(H,24,29)/t15-,18-/m1/s1/f/h24H 3505.8838746293 -1476.7235749 1-A 14136.9758 118 422 540 |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| -20.60014 -20.55985 -20.53248 -20.52291 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CC(C)[C@H](c1nnc2n1CCN(CC2)C(=O)c3cccnc3OC)NC(=O)[C@@H]4CCOC4 C14986815 RHF 6-31G(d) (6D,10F) C1 442.232854 |X|Y|Z| 63.328535 94.986475 33.226735 58.467739 25 6 7 8 18 6 1 |36.858105| |12.440455|36.858105| |7.578615|12.430666|36.858105| |7.518253|12.347070|7.523573|36.858105| |6.925734|8.876557|6.876417|17.663369|0.500000| |4.906999|7.526886|6.364302|12.606186|0.248009|36.858105| |4.260731|6.282667|5.458919|7.732788|0.159407|14.838018|53.358707| |3.311022|4.453762|4.286885|5.297396|0.124354|8.922257|19.077695|53.358707| |3.186630|4.182007|4.168204|5.263088|0.133449|8.893314|12.139264|20.185315|36.858105| |3.832161|5.171868|5.034072|7.442412|0.197309|13.998160|11.924981|11.915736|13.952140|53.358707| |3.561148|4.393204|4.391642|6.113636|0.196774|7.554291|7.233326|7.193154|7.423451|17.692136|36.858105| |2.770131|3.266105|3.327271|4.134818|0.125916|5.008796|5.597691|6.128682|6.400611|10.359023|12.467006|36.858105| |2.508564|2.939692|2.890777|3.708983|0.106952|4.601063|5.518676|6.368702|6.543428|8.921120|7.659202|13.142434|53.358707| |2.337347|2.776499|2.767556|3.365578|0.092785|4.351009|5.693074|7.276770|7.478267|8.085049|5.664259|7.643770|17.796887|36.858105| |2.575211|3.183055|3.270539|3.784484|0.101273|5.287116|7.234235|10.560213|12.733836|10.178306|5.979520|6.734621|10.443428|12.424781|36.858105| |2.392394|2.716125|2.589591|3.438761|0.099864|3.989465|4.812459|5.254405|4.849617|6.925306|5.953812|7.943885|19.063416|7.632696|5.140926|36.858105| |2.485811|2.755140|2.599424|3.519873|0.106063|3.836469|4.479682|4.638453|4.146753|6.392565|5.949852|7.157330|11.597733|5.313988|4.124605|15.827682|73.516695| |2.110815|2.367503|2.238385|2.901712|0.081611|3.334163|4.266878|4.720750|4.061912|5.388808|4.171977|5.027677|10.493329|6.504256|4.411373|12.671053|14.453630|36.858105| |2.122590|2.352351|2.166769|2.884097|0.079784|3.230076|4.200615|4.498089|3.658870|4.916965|3.662297|3.998549|7.351521|4.837508|3.711129|7.677605|11.464594|13.830435|36.858105| |1.872959|2.050640|1.898640|2.432846|0.066667|2.688448|3.599926|3.859099|3.027129|3.975519|2.905455|3.142522|5.469450|3.891637|3.117185|5.058743|7.926172|7.952551|13.674378|36.858105| |1.694989|1.855924|1.752221|2.160839|0.059471|2.402565|3.240541|3.541275|2.794655|3.598021|2.645319|2.952864|5.128371|3.808017|3.006720|4.520800|6.931117|7.023409|8.050949|13.881159|36.858105| |1.684130|1.856397|1.781903|2.159166|0.059968|2.430656|3.252016|3.620061|2.936251|3.743412|2.799183|3.270611|5.832400|4.404227|3.305727|5.051073|7.399973|7.977185|6.906725|7.997278|14.320030|53.358707| |1.848866|2.059343|1.985184|2.439292|0.068427|2.787805|3.654063|4.107701|3.470080|4.450550|3.410304|4.195328|8.113145|5.847324|3.999228|7.429814|9.817554|13.571632|8.028171|7.034485|8.420699|19.864785|36.858105| |1.794653|2.002753|1.973979|2.343409|0.066450|2.685947|3.495390|3.966997|3.426455|4.379824|3.440874|4.496534|8.408968|6.188232|4.162507|6.688172|9.061298|8.155462|5.327388|4.713790|5.466548|11.389577|14.284917|73.516695| |1.590620|1.757981|1.747364|2.008069|0.056723|2.269547|2.998969|3.383960|2.834329|3.602091|2.786163|3.485853|5.890430|4.560066|3.418447|4.475569|6.649955|5.240700|4.025026|3.897652|4.786153|9.782026|8.065930|23.986073|36.858105| |6.484773|7.684685|4.979651|13.092676|0.259901|7.899763|8.526759|6.188029|4.380047|7.564702|4.832551|3.586961|4.669671|3.106255|3.313518|3.378676|6.242530|2.954044|3.077920|2.605112|2.255788|2.992551|2.447707|4.068077|1.961088|53.358707| |5.003773|5.221140|3.891247|7.734740|0.211195|5.744654|6.322807|5.136683|3.836674|6.559113|4.690098|3.613050|4.764699|3.041305|3.071482|3.649587|7.090341|3.175316|3.383261|2.817550|2.392769|3.144145|2.577479|4.227172|2.022224|19.127897|36.858105| |4.611339|4.704427|3.773765|6.808488|0.225634|5.219932|5.539053|4.716818|3.706869|6.547169|5.250083|3.996876|5.060667|3.089381|3.056200|3.931890|8.093271|3.276243|3.389752|2.779915|2.385433|3.183310|2.648854|4.402400|2.093188|11.552146|15.843819|73.516695| |3.899061|3.929206|3.060366|5.006614|0.131849|4.250907|5.204479|4.419830|3.210395|5.048946|3.563419|2.982963|4.132353|2.713549|2.678561|3.275944|6.276850|3.040748|3.421708|2.944069|2.447919|3.121954|2.490279|3.994104|1.932491|10.672117|12.491949|14.130937|36.858105| |4.109651|3.975739|3.037129|4.696314|0.120035|3.900297|4.943413|4.134337|2.922377|4.507893|3.119764|2.624711|3.602750|2.425791|2.443254|2.790228|5.251166|2.622525|2.914725|2.585217|2.191932|2.800000|2.205691|3.574413|1.755833|9.919168|8.920994|10.814093|17.555463|0.500000| |3.192497|3.123221|2.574411|3.815151|0.107266|3.345557|4.093242|3.647129|2.725719|4.235659|3.165867|2.770745|3.846086|2.481464|2.376769|3.164772|6.304978|2.974681|3.384886|2.949140|2.446559|3.099567|2.452661|3.921513|1.907592|6.905421|7.526475|12.203151|12.449777|0.241498|36.858105| |2.762428|2.825955|2.409286|3.523587|0.099779|3.314468|4.068729|3.772553|2.888887|4.418258|3.363768|3.067480|4.437779|2.803910|2.578402|3.874725|7.881004|3.730188|4.471685|3.770353|2.996071|3.729568|2.967169|4.605412|2.199770|5.977613|6.092619|10.715832|7.960541|0.158627|12.431249|36.858105| |2.791748|2.973479|2.515486|3.774142|0.102082|3.742331|4.727193|4.418107|3.327035|4.950503|3.569720|3.254538|4.921052|3.189890|2.925501|4.276082|8.099025|4.284009|5.481118|4.514828|3.423220|4.167872|3.310577|4.999772|2.359466|6.513660|6.157466|9.730573|8.136219|0.162376|8.066534|13.420548|73.516695| |3.208863|3.427714|2.776247|4.343034|0.111248|4.173393|5.405371|4.789903|3.434757|5.120350|3.490810|3.044076|4.464971|2.998902|2.896925|3.613753|6.638032|3.533716|4.226653|3.638571|2.903912|3.599109|2.840552|4.413141|2.117561|8.293904|7.507967|10.042482|12.394090|0.243102|8.075989|8.188703|24.184051|36.858105| |17.550346|8.815555|6.988791|5.477798|0.141429|4.068330|5.073490|4.060891|2.839337|4.474426|3.051756|2.454878|3.043806|2.118248|2.345680|2.124998|3.891540|1.899213|1.905456|1.704028|1.557118|2.108959|1.688038|2.928782|1.476013|6.587813|3.917503|6.498989|3.252790|0.096367|2.739683|2.399219|4.316434|2.764554|0.500000| |17.593839|8.732340|5.488944|6.803790|0.169603|4.537283|5.505443|4.292026|3.004920|4.839938|3.304016|2.616932|3.304707|2.259267|2.443811|2.364409|4.388852|2.115295|2.166609|1.920155|1.721081|2.301558|1.843393|3.143332|1.566633|9.866108|5.651324|8.705343|4.552624|0.140502|3.617378|3.004425|5.373210|3.580721|0.301906|0.500000| |17.525664|8.765879|6.834073|6.822589|0.205998|4.532048|5.153891|4.165220|3.056224|5.109302|3.698989|2.865047|3.455208|2.317946|2.516951|2.432769|4.575786|2.116880|2.110711|1.852504|1.680687|2.285372|1.853155|3.218169|1.602546|7.876417|4.940225|8.773872|3.761605|0.106783|3.214247|2.788427|4.875495|3.055227|0.301616|0.301755|0.500000| |8.878370|17.539233|8.920892|8.906071|0.175006|6.959337|9.413437|6.390406|4.109943|6.424073|3.836498|2.976782|3.773954|2.696736|3.122669|2.567373|4.547599|2.293427|2.304104|2.034334|1.841744|2.490281|2.008665|3.449646|1.713330|9.526466|4.710608|7.220066|3.805581|0.109960|2.977122|2.702997|5.178131|3.441258|0.212477|0.212174|0.173139|0.500000| |6.824660|8.760941|17.510541|6.836153|0.204601|5.678645|6.266411|5.210632|3.947036|6.726690|4.727319|3.538206|4.031865|2.762093|3.197063|2.654061|4.816570|2.253726|2.157797|1.879734|1.740135|2.425136|1.998758|3.565715|1.772594|6.274532|3.831777|6.965419|2.970540|0.080549|2.567434|2.415269|4.393153|2.663114|0.170481|0.139278|0.201586|0.173536|0.500000| |5.489420|8.726530|17.584348|6.789229|0.167272|7.118491|8.765870|7.046033|4.966272|7.848548|4.685703|3.586603|4.248516|3.070851|3.803130|2.717206|4.735519|2.348253|2.246255|1.966314|1.826432|2.546468|2.093276|3.723521|1.851470|6.235841|3.615768|6.208753|2.898452|0.078917|2.442600|2.342608|4.430329|2.727938|0.142482|0.122354|0.139220|0.214106|0.300464|0.500000| |7.001355|8.809339|17.559913|5.479632|0.141018|4.776106|6.035805|4.932088|3.456130|5.368823|3.521772|2.813261|3.390171|2.417561|2.825718|2.257890|4.026447|1.989109|1.936444|1.722623|1.600202|2.209469|1.788299|3.166104|1.596898|5.600144|3.316077|5.689004|2.721075|0.076522|2.322774|2.159386|3.984330|2.475348|0.213192|0.142412|0.171299|0.212702|0.302087|0.302547|0.500000| |3.756340|4.588381|4.941812|5.923927|0.203690|6.576344|6.448613|6.216583|5.928100|12.412491|17.562307|8.896784|7.633710|4.527621|4.980095|4.576650|8.373631|3.412797|3.043123|2.498943|2.310314|3.327431|2.911530|5.322132|2.505260|6.038650|4.222873|8.521226|3.212942|0.080160|2.888005|2.971504|5.447879|3.046662|0.090057|0.093580|0.111621|0.107450|0.158852|0.144372|0.108574|0.500000| |3.718551|4.397598|4.102460|6.486060|0.222743|6.947775|6.655431|6.261898|5.845902|12.514443|17.656852|8.921915|9.211532|4.860905|4.768649|6.237138|12.429586|4.327406|3.942681|3.064936|2.718310|3.836047|3.411268|5.920514|2.688030|7.550307|5.872507|12.721568|4.236334|0.099358|3.791341|4.063905|7.487208|4.032105|0.086571|0.098407|0.108938|0.105649|0.122530|0.115421|0.092530|0.301393|0.500000| |2.602536|3.079126|3.270683|3.702612|0.110592|4.517676|5.270782|5.957405|6.182635|8.997680|8.794283|17.619889|12.537809|7.410748|7.307819|5.866915|9.257612|4.236710|3.411619|2.798929|2.704482|4.129504|3.802725|7.582196|3.449783|4.296746|3.092333|5.948862|2.598204|0.064916|2.410338|2.618617|4.935026|2.647946|0.065244|0.067490|0.074441|0.078653|0.096702|0.100288|0.077739|0.219057|0.174572|0.500000| |2.623475|2.980547|3.023175|3.704715|0.116387|4.150303|4.676662|4.929561|4.729650|7.647707|9.012559|17.655454|12.523434|5.717584|4.913028|7.558391|14.250355|4.787077|3.829815|3.032390|2.861120|4.320204|4.050691|7.815250|3.446710|4.494712|3.453019|7.053567|2.878058|0.070136|2.766672|3.084057|5.598891|2.882238|0.064740|0.069222|0.076845|0.074844|0.091089|0.087874|0.072082|0.212950|0.224904|0.303930|0.500000| |2.091271|2.439130|2.472958|2.863461|0.079764|3.547969|4.686720|5.815406|5.517291|6.258574|4.598999|6.360624|12.343060|17.575868|8.881793|6.252223|8.185937|5.732987|4.233376|3.588717|3.706385|6.135208|5.940125|12.863702|5.485729|3.607037|2.611654|4.755907|2.363969|0.059363|2.204044|2.478672|4.902032|2.582546|0.053290|0.056047|0.057933|0.065851|0.069094|0.075866|0.060990|0.108835|0.111194|0.189491|0.144153|0.500000| |2.259906|2.664389|2.588034|3.225548|0.087069|4.123449|5.619552|7.182294|6.598933|7.090390|4.743672|5.698656|12.527664|17.651581|8.905439|7.292474|8.968632|7.575467|5.794002|4.671464|4.531386|7.004224|6.709255|11.097699|4.607495|4.214369|3.049902|5.378018|2.808066|0.069597|2.559014|2.937076|6.142583|3.224913|0.056943|0.061602|0.061616|0.073150|0.070688|0.078971|0.063366|0.106487|0.120677|0.147013|0.128243|0.302827|0.500000| |2.382736|2.920099|2.989864|3.347366|0.087718|4.542786|6.747742|10.282906|9.148101|7.686637|4.519934|4.886247|7.659430|8.899196|17.604005|4.236006|6.151862|3.946870|3.436295|3.006410|2.947563|4.374565|3.730890|6.815891|3.282404|4.088980|2.763389|4.794891|2.478129|0.063715|2.197001|2.369441|4.817488|2.716884|0.061139|0.063251|0.063901|0.081740|0.079636|0.096709|0.073430|0.109401|0.106103|0.145861|0.107252|0.209237|0.223835|0.500000| |2.514419|3.084301|3.311558|3.554656|0.097578|4.745515|6.271843|8.314924|8.977380|8.991408|5.839476|6.831575|8.979736|8.790185|17.562933|4.501503|6.718376|3.789769|3.184572|2.719461|2.662568|4.022379|3.543265|6.851337|3.264258|4.129365|2.816936|5.079661|2.436575|0.062272|2.190751|2.346415|4.602869|2.563263|0.064227|0.065293|0.069071|0.082770|0.091765|0.108083|0.079877|0.145933|0.124926|0.243768|0.140282|0.220660|0.174784|0.304726|0.500000| |2.339860|2.584376|2.325281|3.243601|0.089514|3.560709|4.551868|4.697673|3.772233|5.276870|3.913918|4.021474|7.000663|4.435873|3.606306|7.143302|11.954153|8.954945|17.727643|8.868955|5.687930|6.765364|5.674428|7.601471|3.342302|4.885326|4.089480|7.198046|4.223913|0.096427|4.173351|5.889547|14.023426|5.459451|0.057658|0.067107|0.064550|0.070077|0.064188|0.066246|0.057367|0.089540|0.122196|0.093401|0.107083|0.105089|0.142034|0.091721|0.086121|0.500000| |1.839004|1.992443|1.825277|2.342140|0.063706|2.540887|3.432550|3.605345|2.755227|3.649585|2.636898|2.762326|4.609190|3.290838|2.763923|4.111212|6.758747|5.643746|8.842410|17.752907|8.923160|7.747549|5.039006|6.622607|3.216091|3.485280|2.783675|4.802650|3.016596|0.074149|3.052898|3.907476|8.428907|3.814814|0.046582|0.052909|0.050289|0.055287|0.049941|0.052135|0.046283|0.063804|0.077915|0.068802|0.074270|0.084233|0.107491|0.074809|0.067509|0.212174|0.500000| |1.562550|1.698043|1.606486|1.946136|0.053388|2.142014|2.917297|3.167444|2.454979|3.156664|2.305744|2.536385|4.247706|3.199405|2.627447|3.602230|5.699711|5.030412|5.676675|8.926687|17.711803|12.712663|5.932060|7.848431|4.198519|2.770444|2.146312|3.783060|2.219680|0.056001|2.228008|2.675243|5.359329|2.612857|0.040153|0.044165|0.042947|0.047054|0.044208|0.046410|0.041091|0.056837|0.065583|0.065559|0.068534|0.087817|0.103521|0.072712|0.065486|0.124171|0.213475|0.500000| |1.508818|1.648343|1.628565|1.876226|0.053169|2.082788|2.743887|3.038472|2.508058|3.249737|2.529927|3.084691|5.064813|3.749722|2.915674|4.033209|6.274701|4.799969|3.880559|3.894470|4.904896|9.807824|7.137674|16.433752|17.629244|2.522349|1.931717|3.564767|1.867840|0.047171|1.872004|2.170634|4.085917|2.042485|0.038936|0.041491|0.042337|0.044596|0.045974|0.047495|0.041523|0.063677|0.069095|0.083496|0.086733|0.118369|0.106543|0.077800|0.077477|0.089665|0.090125|0.122894|0.500000| |1.547136|1.716126|1.704422|1.945293|0.054289|2.214850|2.982331|3.404133|2.800071|3.474689|2.608245|3.172531|5.355747|4.424073|3.404031|3.964432|5.866938|4.747243|3.828623|3.853746|4.875871|9.801473|7.088256|16.417532|17.624121|2.592278|1.943075|3.525971|1.870920|0.047547|1.829362|2.093880|4.047875|2.069518|0.040041|0.042390|0.042976|0.046895|0.047598|0.050413|0.043449|0.065253|0.069533|0.088102|0.084946|0.147858|0.129239|0.094105|0.089172|0.088428|0.089252|0.122674|0.300535|0.500000| |1.570309|1.735240|1.747851|1.966690|0.055917|2.218364|2.914861|3.286484|2.774761|3.544017|2.776985|3.531040|5.688036|4.380845|3.388721|4.113952|6.256960|4.402624|3.432562|3.250934|3.786643|7.002770|5.918759|16.992773|17.646443|2.577780|1.940916|3.596219|1.833037|0.046476|1.805743|2.052450|3.868419|1.976352|0.040611|0.042662|0.044134|0.046759|0.049564|0.051562|0.044446|0.070515|0.073329|0.100303|0.097971|0.152059|0.116244|0.089679|0.093140|0.082097|0.076536|0.094225|0.298769|0.298551|0.500000| |5.724894|6.836201|4.536966|9.107927|0.181294|7.094291|9.017868|6.386688|4.242532|6.765634|4.133301|3.224654|4.338726|2.992401|3.219293|3.137658|5.646578|2.842102|3.013045|2.601503|2.248691|2.951391|2.379891|3.923367|1.906117|26.021530|9.385634|10.884510|7.519519|0.214116|4.726071|4.121973|8.390411|6.503261|0.126574|0.183430|0.134803|0.201605|0.112244|0.119452|0.108027|0.104949|0.126048|0.080261|0.081790|0.071097|0.084652|0.083256|0.080821|0.097099|0.071910|0.056755|0.050031|0.051959|0.050875|0.500000| |3.311415|3.138870|2.612650|3.786831|0.110945|3.221441|3.860127|3.435270|2.600807|4.112860|3.171778|2.756971|3.716531|2.368986|2.279591|3.029958|6.175852|2.776690|3.053340|2.655730|2.253462|2.905325|2.315344|3.769475|1.841296|6.564271|7.159511|13.418049|8.699939|0.193593|17.640297|8.721064|10.426786|5.745947|0.078594|0.103626|0.095654|0.081108|0.073738|0.067881|0.065571|0.082171|0.106523|0.066736|0.077876|0.058931|0.066637|0.058122|0.059262|0.101620|0.075089|0.057113|0.050267|0.048724|0.048870|0.119466|0.500000| |2.882506|2.782667|2.316651|3.252474|0.089909|2.895461|3.649462|3.279126|2.413944|3.656276|2.694267|2.404521|3.360798|2.218071|2.132592|2.742268|5.346309|2.651616|3.038790|2.750133|2.300093|2.884285|2.238409|3.578762|1.766791|5.734453|5.553119|8.891585|8.870331|0.221795|17.555691|8.783687|11.683463|6.877639|0.070308|0.091415|0.079696|0.075111|0.063696|0.061170|0.059050|0.069103|0.086834|0.059121|0.066588|0.055360|0.063973|0.055549|0.054773|0.101438|0.080808|0.059113|0.048443|0.047375|0.046401|0.114291|0.300689|0.500000| |2.782313|2.867106|2.487515|3.640140|0.107031|3.440686|4.101597|3.844070|3.035666|4.750387|3.801008|3.493000|4.991540|3.022976|2.732917|4.499820|9.845397|4.114919|4.730927|3.806230|3.068175|3.917635|3.203720|5.018699|2.360824|5.889084|6.035450|12.074341|6.481593|0.133280|8.745719|17.633494|16.646035|6.282799|0.066805|0.082228|0.079615|0.074648|0.070475|0.067274|0.061370|0.092431|0.132268|0.081002|0.100022|0.074148|0.086312|0.068504|0.069570|0.171547|0.104953|0.074952|0.064655|0.061485|0.061459|0.108470|0.221440|0.174944|0.500000| |2.404616|2.439177|2.119132|2.936551|0.082945|2.804144|3.518724|3.322581|2.533019|3.776689|2.875493|2.707917|3.953864|2.542081|2.318247|3.467059|6.952849|3.485644|4.250242|3.787831|3.014155|3.683102|2.855751|4.406617|2.137353|4.811210|4.552650|8.070578|5.794036|0.129190|8.703344|17.583064|16.551094|6.225895|0.059101|0.072307|0.067421|0.065406|0.059035|0.057458|0.053454|0.071551|0.093571|0.065278|0.076297|0.063570|0.074435|0.059899|0.058953|0.148727|0.112591|0.075924|0.059419|0.056586|0.055113|0.094312|0.189858|0.222968|0.300202|0.500000| |2.896319|3.032380|2.488086|3.623171|0.092603|3.494945|4.701797|4.227365|2.972187|4.295726|2.922831|2.609662|3.831269|2.641925|2.564466|3.074368|5.578052|3.104925|3.734347|3.408042|2.749246|3.356856|2.581155|4.013778|1.962170|6.608769|5.537141|7.800852|8.812826|0.222622|6.843155|6.593509|16.514887|17.520490|0.070945|0.090498|0.075983|0.086347|0.065906|0.067925|0.062856|0.072357|0.091105|0.064370|0.068998|0.064364|0.079434|0.068180|0.063500|0.127959|0.102765|0.070219|0.052930|0.053729|0.050793|0.149893|0.138165|0.191124|0.139356|0.159178|0.500000| 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