Version2.1 2021-01-12T23:51:26Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 29-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCn1c2ccc(cc2nc1C[NH+]3CCC(CC3)C)NC(=O)c4ccccc4[N+](=O)[O-] C26121537 RHF 6-31G(d) (6D,7F) CCCn1c2ccc(cc2nc1C[NH+]3CCC(CC3)C)NC(=O)c4ccccc4[N+](=O)[O-] C01[X(C24H30N5O3)] 180 C1 540 CCCn1c(C[NH+]2CCC(CC2)C)nc2c1ccc(c2)NC(=O)c1ccccc1[N+](=O)[O-] CCCn1c(C[NH+]2CCC(CC2)C)nc2c1ccc(c2)NC(=O)c1ccccc1[N+](=O)[O-] CCCn1c(C[NH+]2CCC(C)CC2)nc3cc(NC(=O)c4ccccc4[N+]([O-])=O)ccc13 InChIKey=BNMXBFVUOFBISN-UHFFFAOYSA-O InChI=1S/C24H29N5O3/c1-3-12-28-22-9-8-18(25-24(30)19-6-4-5-7-21(19)29(31)32)15-20(22)26-23(28)16-27-13-10-17(2)11-14-27/h4-9,15,17H,3,10-14,16H2,1-2H3,(H,25,30)/p+1 InChI=1/C24H29N5O3/c1-3-12-28-22-9-8-18(25-24(30)19-6-4-5-7-21(19)29(31)32)15-20(22)26-23(28)16-27-13-10-17(2)11-14-27/h4-9,15,17H,3,10-14,16H2,1-2H3,(H,25,30)/p+1/fC24H30N5O3/h25,27H/q+1 CCCn1c2ccc(cc2nc1C[NH+]3CCC(CC3)C)NC(=O)c4ccccc4[N+](=O)[O-] C01[X(C24H30N5O3)] 180 C01 540 CCCn1c(C[NH+]2CCC(CC2)C)nc2c1ccc(c2)NC(=O)c1ccccc1[N+](=O)[O-] CCC[N]1[C]([N][C]2[C]1[CH][CH][C]([CH]2)NC(=O)[C]1[CH][CH][CH][CH][C]1[N]([O])[O])C[NH]1CC[C@H](CC1)C CCCN1[C]2[CH][CH][C]([CH][C]2[N][C]1C[NH]3CCC(C)CC3)NC(=O)[C]4[CH][CH][CH][CH][C]4N([O])[O] InChIKey=KWAVHEZWGUUMEY-UHFFFAOYSA-N InChI=1S/C24H30N5O3/c1-3-12-28-22-9-8-18(25-24(30)19-6-4-5-7-21(19)29(31)32)15-20(22)26-23(28)16-27-13-10-17(2)11-14-27/h4-9,15,17,27H,3,10-14,16H2,1-2H3,(H,25,30) InChI=1/C24H30N5O3/c1-3-12-28-22-9-8-18(25-24(30)19-6-4-5-7-21(19)29(31)32)15-20(22)26-23(28)16-27-13-10-17(2)11-14-27/h4-9,15,17,27H,3,10-14,16H2,1-2H3,(H,25,30)/f/h25H 3114.2548379436 -1422.872534 1-A 21715.8029 116 424 540 |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| -20.67231 -20.66772 -20.60877 -15.92378 -15.83158 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12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 15.99491 15.99491 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 9716.2405 30474.8127 37704.1502 0.99993 -0.01005 0.00543 0.00997 0.99985 0.01405 -0.00557 -0.01399 0.99989 1 0.00891 0.00284 0.00230 0.18574 0.05922 0.04787 11.02 25.97 37.66 42.76 45.85 62.54 64.90 78.43 95.34 124.87 131.39 164.28 166.87 191.21 227.79 244.14 294.06 309.52 342.38 348.96 358.09 370.75 379.18 413.08 428.14 443.43 452.24 470.83 523.46 533.74 551.62 577.60 635.96 644.24 654.15 675.59 681.72 696.29 710.30 746.14 775.72 830.59 846.86 869.20 906.62 949.81 967.43 1007.74 1025.77 1060.65 1082.66 1124.27 1151.78 1155.36 1172.43 1208.03 1209.74 1215.72 1229.02 1252.24 1284.66 1299.43 1311.58 1313.20 1357.40 1389.33 1393.02 1400.58 1413.51 1449.69 1453.92 1479.05 1488.19 1499.06 1517.92 1523.67 1547.30 1557.96 1573.84 1591.15 1600.18 1612.57 1642.23 1643.60 1661.54 1676.34 1701.79 1747.51 1754.46 1758.99 1767.20 1779.29 1785.22 1813.22 1836.23 1838.98 1857.83 1866.76 1873.37 1929.43 1938.34 1953.30 1973.96 2001.80 2003.67 2013.46 2042.17 2054.43 2072.98 2077.66 2084.21 2099.85 2114.56 2122.78 2141.56 2161.03 2205.07 2214.94 2231.98 2237.56 2247.22 2260.47 2262.34 2265.07 2289.94 2313.99 2322.23 2342.00 2350.54 2353.54 2355.77 2363.28 2363.44 2364.47 2365.15 2368.17 2370.06 2372.72 2384.37 2388.97 2391.33 2409.27 2450.83 2488.46 2547.25 2578.22 2588.43 2635.32 2687.65 2865.12 4581.07 4607.49 4613.05 4614.78 4617.05 4628.57 4662.27 4677.05 4686.27 4692.68 4700.03 4706.03 4707.79 4710.87 4719.17 4727.75 4734.35 4742.69 4774.41 4780.85 4810.49 4863.21 4876.53 4881.73 4883.29 4898.68 4928.66 4945.13 5135.64 5556.76 0.564555 0.592291 0.593235 0.500975 -1422.307979 -1422.280243 -1422.279299 -1422.371559 3.094416D-04 MUNgauss RevisionA2.0 retrievium 12-Jan-2021 DUDE CCCn1c2ccc(cc2nc1C[NH+]3CCC(CC3)C)NC(=O)c4ccccc4[N+](=O)[O-] C26121537 RHF 6-31G(d) (6D,10F) C1 436.234865 |X|Y|Z| 126.222979 70.215355 29.209232 63.732881 24 6 7 20 4 |36.858105| |12.466507|36.858105| |7.525126|12.461995|36.858105| |4.960541|7.637378|13.060885|53.358707| |4.057332|5.720994|7.496382|18.670426|36.858105| |3.881119|5.079685|5.958436|10.186226|13.677935|36.858105| |3.063845|3.779672|4.190301|6.984242|8.074691|13.875070|36.858105| |2.661413|3.271692|3.627626|6.318515|6.941030|7.848104|13.528837|36.858105| |2.711192|3.413445|3.884119|7.315025|7.876208|6.719268|7.865181|13.859824|36.858105| |3.247205|4.318866|5.240268|11.712058|13.739006|7.847266|6.934187|8.043265|13.671960|36.858105| |3.230073|4.279676|5.252748|11.674603|8.435861|5.317984|4.633093|5.145029|7.575278|13.771079|53.358707| |3.979163|5.558045|7.535151|19.231872|8.766185|5.364838|4.270952|4.291157|5.465130|8.992288|20.152658|36.858105| |3.801236|4.894571|6.109965|10.248431|5.235424|3.822666|3.197246|3.217650|3.902922|5.341402|10.700565|12.657856|36.858105| |2.998665|3.688720|4.204907|6.994901|4.211612|3.221793|2.857355|3.011447|3.740775|4.759594|9.834464|7.885989|12.771262|53.358707| |2.799468|3.463185|4.016106|7.084339|4.543702|3.422067|3.096731|3.373592|4.382447|5.583253|12.704518|8.233354|9.514365|25.511674|0.500000| |2.599612|3.016998|3.406684|5.250209|3.264502|2.636986|2.382859|2.497263|2.992599|3.581014|6.569379|5.148159|7.623613|17.293350|0.255915|36.858105| |2.190474|2.506102|2.741875|4.226755|2.783944|2.315343|2.158583|2.310223|2.759906|3.133031|5.494977|3.957385|4.968233|10.432229|0.197493|12.501135|36.858105| |2.147950|2.458929|2.582922|3.947764|2.633838|2.217431|2.081918|2.230826|2.642898|2.953468|5.047431|3.611808|4.358333|8.791940|0.163469|7.493866|12.426494|36.858105| |2.377087|2.811841|2.912675|4.599979|3.090238|2.552043|2.391523|2.589486|3.136923|3.550556|6.227456|4.322422|4.982451|10.424442|0.199898|6.517440|7.621852|12.429897|36.858105| |2.926459|3.594229|3.745968|6.005719|3.780300|2.996183|2.701088|2.853210|3.479675|4.230259|7.904966|6.016819|7.663819|17.225276|0.260043|7.669342|6.529533|7.518130|12.515307|36.858105| |1.841785|2.075776|2.162578|3.280367|2.260412|1.952942|1.873543|2.026495|2.366107|2.541788|4.146686|2.890548|3.273999|5.959953|0.119637|4.891324|7.528075|12.468585|7.521727|4.896713|36.858105| |2.243411|2.653303|2.860841|4.698275|4.577685|5.137601|7.809151|13.441717|7.896122|5.187127|5.271101|3.293695|2.632280|3.456450|0.078509|2.172857|2.063405|2.008827|2.297400|2.445142|1.869913|53.358707| |2.127043|2.476611|2.570140|4.069042|3.797234|4.341421|6.171981|7.829054|5.487995|4.087872|4.389844|2.835434|2.330264|3.074874|0.068515|1.949496|1.866855|1.850372|2.116709|2.233937|1.738464|18.970653|36.858105| |2.268016|2.639766|2.663659|4.135271|3.839246|4.556423|6.329702|6.779761|4.883104|3.921441|4.235122|2.814379|2.316375|3.017105|0.066187|1.903772|1.808982|1.809110|2.079818|2.222037|1.689323|11.462082|15.997593|73.516695| |1.819387|2.071114|2.142798|3.324147|2.954342|3.249700|4.204209|5.064773|4.100608|3.201326|3.641317|2.368114|2.011761|2.702956|0.060054|1.751695|1.706629|1.695983|1.910854|1.970417|1.622928|10.687821|12.575946|14.356824|36.858105| |1.701610|1.902792|1.975881|3.003094|2.627472|2.933542|3.719030|4.167819|3.395626|2.766423|3.192027|2.118803|1.822966|2.430012|0.053561|1.597543|1.552521|1.531498|1.698810|1.754975|1.468724|8.054851|7.685650|10.705087|13.743037|36.858105| |1.514875|1.673384|1.729832|2.598987|2.215726|2.419239|2.929822|3.235592|2.785746|2.335021|2.774183|1.854261|1.626652|2.188566|0.048018|1.457937|1.430689|1.415254|1.554178|1.586567|1.372162|5.764991|5.052467|7.656487|7.901289|13.745221|36.858105| |1.436821|1.588462|1.632341|2.458051|2.070241|2.208753|2.619397|2.941482|2.630388|2.213749|2.676306|1.779510|1.576044|2.149214|0.047183|1.436277|1.425388|1.421487|1.561575|1.573208|1.392019|5.105073|4.422674|6.801682|6.810966|7.925567|13.762073|36.858105| |1.503549|1.679975|1.719894|2.620324|2.214856|2.329900|2.767095|3.203197|2.913573|2.413594|2.919614|1.916369|1.690702|2.327816|0.051364|1.543151|1.540021|1.548408|1.719525|1.720578|1.519817|5.601310|4.958447|7.496281|7.848571|6.875160|7.961296|13.779937|36.858105| |1.685567|1.912437|1.961674|3.037313|2.627718|2.780686|3.406929|4.107327|3.639947|2.901928|3.420868|2.213580|1.914799|2.625126|0.058339|1.711859|1.695222|1.704089|1.921139|1.941178|1.653785|7.656868|7.398803|10.292239|13.706353|8.019088|6.944791|7.988026|13.774463|36.858105| |1.748404|2.007465|2.044477|3.206326|2.754678|2.820837|3.367785|4.162452|3.933320|3.128169|3.742910|2.383185|2.062976|2.876590|0.064261|1.856500|1.855630|1.892349|2.170235|2.166205|1.842822|7.153949|6.363461|9.511064|7.712008|5.118889|4.535559|5.146150|7.841858|13.066756|53.358707| |1.622009|1.843882|1.859865|2.878435|2.409814|2.437832|2.812772|3.343177|3.256911|2.708499|3.345747|2.157589|1.907769|2.689475|0.059574|1.755060|1.775696|1.832708|2.090425|2.052148|1.810275|5.394922|4.602846|7.399545|5.425138|4.106137|3.918532|4.686601|7.087140|8.378496|21.816217|73.516695| |1.934410|2.265134|2.322109|3.734148|3.274612|3.292830|3.969714|5.219226|5.091324|3.856514|4.516983|2.798869|2.370404|3.311423|0.074923|2.094051|2.079968|2.119081|2.478093|2.494749|2.036792|8.742171|7.200984|10.552886|6.960971|4.639449|3.904529|4.111979|5.477542|8.383983|21.636753|16.023098|73.516695| |17.583980|8.811041|5.485687|5.581256|3.523517|3.436021|2.811940|2.468810|2.497077|2.915768|3.938435|3.443353|3.322991|3.721036|0.070953|2.387951|2.052350|2.049580|2.273965|2.756449|1.773658|2.881101|2.042746|3.910769|1.759026|1.644336|1.470987|1.401299|1.468376|1.640392|2.322605|2.833975|3.335797|0.500000| |17.539240|8.755333|6.809978|6.222619|3.639043|3.382028|2.727853|2.427381|2.512851|3.012543|4.217305|3.862324|3.929413|4.178649|0.078132|2.725231|2.264648|2.201444|2.391530|2.953890|1.874683|2.811426|1.946550|3.639818|1.686206|1.582322|1.419359|1.351687|1.412820|1.573289|2.223820|2.708725|3.203378|0.302024|0.500000| |17.552438|8.771221|6.809342|6.250763|3.949253|3.984970|3.139089|2.661700|2.647153|3.113931|4.096181|3.614623|3.366738|3.670152|0.071261|2.369645|2.018071|1.960675|2.150472|2.590079|1.702555|3.068915|2.138453|4.060773|1.828841|1.728776|1.536185|1.445188|1.500011|1.677890|2.339243|2.823037|3.360494|0.302256|0.301531|0.500000| |8.831458|17.517648|8.867494|9.451391|5.159360|4.367973|3.422919|3.101547|3.337006|4.229562|6.044184|5.817905|5.476283|5.655020|0.105054|3.319358|2.739340|2.742828|3.196369|4.240375|2.276398|3.461796|2.385715|4.497143|2.013494|1.833573|1.622899|1.557018|1.660346|1.887702|2.738152|3.312796|4.049934|0.212762|0.209720|0.172656|0.500000| |8.833554|17.561213|8.880823|9.553261|6.168518|5.956278|4.352858|3.634374|3.667576|4.520375|5.704321|5.066236|4.204245|4.559615|0.090001|2.733957|2.335165|2.316572|2.681637|3.335579|1.987997|3.973507|2.762694|5.360522|2.266878|2.070032|1.802224|1.702968|1.804849|2.073819|2.958522|3.524183|4.375645|0.212523|0.172551|0.210383|0.304212|0.500000| |6.888955|8.807535|17.603570|12.590421|7.023452|6.434033|4.416043|3.651102|3.734290|4.794740|6.126511|5.801993|4.749938|4.778292|0.095579|2.960757|2.442185|2.287061|2.535754|3.127779|1.955024|3.941837|2.594863|4.783375|2.161464|2.021460|1.763724|1.646316|1.716443|1.952093|2.722174|3.219077|4.002210|0.140640|0.169846|0.204111|0.173432|0.210488|0.500000| |6.844546|8.806521|17.574640|12.513089|5.673137|4.569315|3.468255|3.126276|3.405540|4.483442|6.603963|7.093236|6.931921|6.119613|0.114866|3.762444|2.924707|2.701742|2.968326|3.853471|2.232834|3.453828|2.282846|4.153432|1.944296|1.804190|1.598323|1.516944|1.594895|1.799778|2.555740|3.064727|3.762032|0.140217|0.202706|0.168073|0.211627|0.173582|0.305215|0.500000| |4.391886|5.528245|6.253590|8.916739|8.791170|17.739284|8.944679|5.601393|4.873479|5.586788|5.860232|4.608609|3.503166|3.966046|0.083764|2.438734|2.133778|2.048498|2.323774|2.728971|1.807823|5.675902|3.731882|7.155449|2.896955|2.687881|2.248956|2.046417|2.130265|2.493625|3.403172|3.903529|5.052083|0.106645|0.103162|0.131569|0.124124|0.185625|0.207317|0.130474|0.500000| |2.846997|3.363415|3.605926|5.593965|5.703037|8.985012|17.776933|8.903996|5.641055|4.988896|5.002964|3.472380|2.731906|3.355770|0.073261|2.103849|1.924858|1.865929|2.116274|2.356133|1.698498|9.843776|6.470693|12.512014|4.425743|4.083230|3.152697|2.742028|2.832874|3.456618|4.464060|4.881628|6.605528|0.073651|0.070278|0.082566|0.084218|0.107986|0.107869|0.084445|0.215922|0.500000| |2.399769|2.950292|3.293149|5.941325|5.612827|4.873528|5.597862|8.901621|17.735772|8.849410|9.145781|4.740582|3.625994|5.022459|0.123091|3.001664|2.865269|2.757185|3.278346|3.474879|2.514956|9.776020|5.188810|7.880509|4.165768|3.386174|2.832632|2.740110|3.100252|3.879314|5.927433|6.393598|10.351564|0.062102|0.062663|0.064715|0.081886|0.086551|0.087260|0.082897|0.106203|0.123922|0.500000| |3.608710|4.375350|5.729186|8.797157|4.656222|3.542667|2.980934|2.971524|3.519750|4.636893|8.526219|8.893391|17.603219|12.336586|0.208702|7.575888|4.785629|3.948305|4.169834|5.657519|3.046674|3.355513|2.173734|3.816346|1.896332|1.741119|1.561207|1.506693|1.601461|1.798049|2.601359|3.144921|3.858082|0.086529|0.106587|0.091017|0.128574|0.103817|0.130878|0.196498|0.091905|0.071705|0.091212|0.500000| |4.344532|5.587649|6.343886|9.151936|4.670251|3.574117|2.970974|2.922926|3.418158|4.500691|8.041174|8.778584|17.628903|12.322895|0.185393|6.389574|4.413658|4.137626|4.730697|7.481395|3.117610|3.296273|2.191690|3.936127|1.897205|1.724677|1.544694|1.498784|1.605558|1.810619|2.654895|3.231288|3.950569|0.105841|0.127840|0.102296|0.188693|0.126833|0.131763|0.207172|0.093890|0.071713|0.087981|0.301848|0.500000| |2.554490|2.934060|3.433924|5.275987|3.287766|2.664520|2.404264|2.509865|2.992444|3.579008|6.449510|5.072581|7.160305|12.395595|0.222000|17.621986|8.791667|5.468008|4.897804|5.607341|4.062590|2.970639|1.937672|3.342118|1.743513|1.602515|1.461950|1.432106|1.527958|1.691148|2.467290|3.029206|3.621926|0.064385|0.074699|0.065698|0.087048|0.073749|0.084583|0.106927|0.068575|0.059009|0.082886|0.234186|0.158547|0.500000| |2.694479|3.059983|3.371414|4.935504|3.015292|2.478413|2.220561|2.283219|2.669864|3.180820|5.583151|4.595364|6.992323|12.415140|0.180575|17.595832|8.767539|6.713105|5.735182|7.001247|4.476399|2.715745|1.813351|3.181540|1.631903|1.496298|1.369584|1.348213|1.443050|1.593648|2.342869|2.907141|3.423910|0.069067|0.080052|0.067427|0.094889|0.075730|0.080893|0.105884|0.064838|0.055002|0.073410|0.196275|0.187351|0.300977|0.500000| |2.092168|2.408447|2.666878|4.210160|2.854031|2.373771|2.246650|2.451982|2.973988|3.312351|5.809464|3.952613|4.619388|9.354697|0.207774|8.886608|17.510188|8.815601|6.805305|5.687888|6.952855|2.997511|1.971352|3.353972|1.809531|1.640919|1.511887|1.509264|1.635337|1.802592|2.691749|3.352906|3.956737|0.054336|0.059403|0.054128|0.072006|0.063210|0.066817|0.077718|0.060050|0.055445|0.087745|0.124222|0.110071|0.216155|0.173171|0.500000| |2.025985|2.266303|2.470290|3.706009|2.451477|2.080287|1.946200|2.064348|2.414753|2.700888|4.556077|3.337798|4.131209|7.612142|0.144369|8.978751|17.567659|8.784351|5.520381|4.897132|6.812831|2.539033|1.697556|2.926173|1.566265|1.438259|1.334454|1.329729|1.427315|1.556632|2.298622|2.886734|3.324839|0.052882|0.058677|0.052179|0.068125|0.058560|0.061982|0.073835|0.053868|0.048734|0.069347|0.115894|0.105007|0.212767|0.214300|0.303795|0.500000| |2.181346|2.458870|2.540659|3.769119|2.475850|2.104253|1.958108|2.062223|2.398093|2.695280|4.515970|3.366460|4.172466|7.797230|0.136411|6.836857|8.914633|17.492195|8.915567|6.868557|8.916619|2.528002|1.725839|3.027909|1.581616|1.436908|1.330409|1.333254|1.444922|1.583946|2.377997|3.016148|3.451621|0.058178|0.062798|0.054895|0.076955|0.063683|0.062289|0.074698|0.054719|0.049087|0.068322|0.106047|0.115908|0.139701|0.199880|0.174033|0.215338|0.500000| |2.266850|2.699729|2.837814|4.612813|3.217361|2.653773|2.536457|2.824605|3.507970|3.865852|6.783419|4.351307|4.639072|9.367005|0.211251|5.690085|6.799697|8.799490|17.516564|8.887138|6.927738|3.429040|2.299377|3.961575|2.080028|1.831127|1.671865|1.687198|1.873705|2.105913|3.278745|4.111859|4.950720|0.060036|0.062606|0.057704|0.083430|0.072805|0.069542|0.078936|0.066042|0.061962|0.105427|0.109291|0.116925|0.128013|0.132104|0.198608|0.139021|0.173872|0.500000| |2.296020|2.686999|2.692819|4.157431|2.832304|2.394470|2.260489|2.432705|2.880295|3.188660|5.301263|3.725813|4.144253|7.605169|0.145968|4.887070|5.520504|8.787341|17.568289|8.985873|6.807530|2.974746|2.051946|3.619219|1.862534|1.653117|1.518925|1.534928|1.696451|1.888731|2.925751|3.727202|4.330579|0.062056|0.063796|0.057529|0.085511|0.071984|0.065466|0.075397|0.061088|0.056141|0.083365|0.097438|0.114758|0.107758|0.128532|0.139162|0.123236|0.215328|0.303879|0.500000| |3.059387|3.662114|3.692056|5.537716|3.403439|2.766495|2.469358|2.544422|2.997499|3.607341|6.332026|5.173750|7.009629|12.413585|0.182182|7.039320|5.784120|6.777535|8.787788|17.597652|4.499919|2.993266|2.035088|3.636946|1.804215|1.622994|1.474377|1.459569|1.585216|1.773910|2.667929|3.321654|3.954995|0.080775|0.087539|0.073949|0.123396|0.092164|0.085142|0.108270|0.071715|0.060680|0.081906|0.150630|0.223708|0.144133|0.212284|0.132712|0.129627|0.202579|0.173292|0.214062|0.500000| |3.157960|4.041454|4.103957|6.834609|4.376422|3.407232|3.054124|3.233127|3.990003|4.948254|9.146942|6.789219|7.255322|12.396867|0.226802|5.616533|4.900748|5.475413|8.785487|17.652613|4.060030|3.702807|2.492305|4.449054|2.160113|1.900993|1.702197|1.684752|1.854762|2.120129|3.251639|3.991888|4.969556|0.082975|0.086119|0.077217|0.134857|0.106745|0.093916|0.111990|0.084980|0.073084|0.108902|0.144347|0.199900|0.126917|0.143974|0.127766|0.107880|0.140198|0.215482|0.212790|0.300002|0.500000| |1.731671|1.923305|2.010577|3.003260|2.063530|1.799805|1.725577|1.851474|2.134237|2.287376|3.681571|2.606603|2.974146|5.214146|0.103583|4.525424|6.862130|8.790260|5.476546|4.059102|17.566203|2.337718|1.598583|2.761051|1.501124|1.370906|1.287096|1.303736|1.412976|1.525806|2.288726|2.939545|3.272420|0.046303|0.049312|0.044674|0.058117|0.050948|0.050901|0.058167|0.046640|0.043739|0.062589|0.079055|0.079059|0.108183|0.118416|0.172730|0.203265|0.213542|0.140824|0.139848|0.107754|0.094669|0.500000| |1.791703|2.010312|2.054898|3.089166|2.142454|1.871051|1.801788|1.942652|2.242820|2.387951|3.816377|2.672805|2.975864|5.212756|0.103808|4.053627|5.479866|8.794287|6.856070|4.529643|17.568325|2.455605|1.698330|2.952772|1.590817|1.437051|1.346617|1.372517|1.503389|1.631696|2.489319|3.224922|3.574968|0.048420|0.050442|0.045906|0.061547|0.053834|0.051638|0.058467|0.048308|0.045622|0.066054|0.076109|0.080585|0.094668|0.107132|0.141181|0.139944|0.213628|0.172161|0.203036|0.118888|0.108118|0.302042|0.500000| |1.785438|2.024047|2.128024|3.278216|2.302777|1.992359|1.935412|2.126564|2.504840|2.641946|4.286504|2.893022|3.167918|5.733231|0.121770|4.531072|6.803653|8.775679|6.800650|4.532076|17.544338|2.691543|1.828554|3.126958|1.716613|1.547272|1.447195|1.474261|1.617070|1.759998|2.683994|3.445303|3.883765|0.047620|0.050096|0.046188|0.061006|0.054350|0.053831|0.060439|0.050797|0.048647|0.075446|0.082082|0.081901|0.108810|0.110420|0.206176|0.166646|0.173479|0.205372|0.166628|0.110811|0.108602|0.301459|0.301573|0.500000| |2.069128|2.426410|2.638732|4.335194|4.065080|4.292473|5.839601|9.275404|7.328676|4.811928|5.126547|3.143351|2.558222|3.430355|0.078853|2.181654|2.100517|2.033532|2.307258|2.410165|1.912676|26.040826|9.492460|10.952393|7.607885|5.813884|4.350127|3.944703|4.376162|5.907699|7.503915|7.354551|11.850317|0.054216|0.053594|0.057515|0.065302|0.072706|0.073717|0.066274|0.098742|0.149319|0.214196|0.067032|0.064766|0.061129|0.055184|0.063073|0.052824|0.051806|0.071153|0.060638|0.059834|0.073502|0.048847|0.051035|0.056782|0.500000| |1.769318|1.970205|2.057422|3.103452|2.733947|3.138670|4.038415|4.311511|3.399963|2.809864|3.207551|2.153879|1.844005|2.424985|0.053254|1.594487|1.534406|1.503612|1.662275|1.736289|1.431644|8.081968|7.218992|10.659077|8.950538|17.732987|8.921515|5.644785|4.954575|5.683022|5.645201|6.061322|7.076533|0.047293|0.045556|0.050409|0.052136|0.059709|0.059244|0.051953|0.080775|0.128903|0.091299|0.049194|0.048486|0.044665|0.041592|0.044891|0.039556|0.039332|0.049446|0.044757|0.044788|0.052190|0.037227|0.038790|0.041696|0.154018|0.500000| |1.444282|1.579586|1.634736|2.428992|2.050870|2.246600|2.678011|2.876877|2.493124|2.132996|2.553831|1.725623|1.524810|2.042679|0.044596|1.370915|1.342700|1.323338|1.441679|1.474469|1.283441|4.925567|4.132874|6.513314|5.638613|8.936297|17.731379|8.920923|5.657034|4.990299|4.915972|5.725812|5.708892|0.038957|0.037684|0.040894|0.042391|0.047067|0.046590|0.042130|0.058806|0.080767|0.069756|0.040922|0.040316|0.038330|0.035900|0.039307|0.034971|0.034690|0.042826|0.039107|0.038273|0.043691|0.033612|0.034955|0.037482|0.102451|0.215841|0.500000| |1.329416|1.458002|1.495347|2.233382|1.855806|1.965830|2.285570|2.528381|2.302476|1.974984|2.422274|1.622200|1.452902|1.987213|0.043437|1.339694|1.335399|1.332927|1.452780|1.456006|1.313226|4.228791|3.540514|5.618774|4.921658|5.638513|8.904132|17.742607|8.942621|5.671113|5.688802|7.174182|6.084583|0.036098|0.034890|0.037144|0.039780|0.043175|0.041883|0.038847|0.051042|0.066229|0.066662|0.038734|0.038490|0.037123|0.035035|0.039216|0.034787|0.034818|0.043443|0.039757|0.037692|0.043030|0.034316|0.036031|0.038600|0.090722|0.124106|0.214484|0.500000| 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