Version2.1 2020-12-27T03:05:07Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 15-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC[C@H](c1nnnn1C[C@H]2CCCO2)[NH+](Cc3cc4cccc(c4[nH]c3=O)C)C5CCCC5 C33937382 RHF 6-31G(d) (6D,7F) CC[C@H](c1nnnn1C[C@H]2CCCO2)[NH+](Cc3cc4cccc(c4[nH]c3=O)C)C5CCCC5 C01[X(C25H35N6O2)] 198 C1 565 CC[C@@H]([NH+](C1CCCC1)Cc1cc2cccc(c2[nH]c1=O)C)c1nnnn1C[C@H]1CCCO1 CC[C@@H]([NH+](C1CCCC1)Cc1cc2cccc(c2[nH]c1=O)C)c1nnnn1C[C@H]1CCCO1 CC[C@@H]([NH+](CC1=Cc2cccc(C)c2NC1=O)C3CCCC3)c4nnnn4C[C@H]5CCCO5 InChIKey=YSSOYGPKSNYNDR-FGZHOGPDSA-O InChI=1S/C25H34N6O2/c1-3-22(24-27-28-29-31(24)16-21-12-7-13-33-21)30(20-10-4-5-11-20)15-19-14-18-9-6-8-17(2)23(18)26-25(19)32/h6,8-9,14,20-22H,3-5,7,10-13,15-16H2,1-2H3,(H,26,32)/p+1/t21-,22-/m1/s1 InChI=1/C25H34N6O2/c1-3-22(24-27-28-29-31(24)16-21-12-7-13-33-21)30(20-10-4-5-11-20)15-19-14-18-9-6-8-17(2)23(18)26-25(19)32/h6,8-9,14,20-22H,3-5,7,10-13,15-16H2,1-2H3,(H,26,32)/p+1/t21-,22-/m1/s1/fC25H35N6O2/h26,30H/q+1 CC[C@H](c1nnnn1C[C@H]2CCCO2)[NH+](Cc3cc4cccc(c4[nH]c3=O)C)C5CCCC5 C01[X(C25H35N6O2)] 198 C01 565 CC[C@@H]([NH+](C1CCCC1)Cc1cc2cccc(c2[nH]c1=O)C)c1nnnn1C[C@H]1CCCO1 CC[C@H]([C]1[N][N][N][N]1C[C@H]1CCCO1)[NH](C1CCCC1)CC1=[CH][C]2[CH][CH][CH][C]([C]2NC1=O)C CC[C@H]([C]1[N][N][N]N1C[C@H]2CCCO2)[NH](CC3=C[C]4[CH][CH][CH][C](C)[C]4NC3=O)C5CCCC5 InChIKey=UDNYSIDZILWPBC-FGZHOGPDSA-N InChI=1S/C25H35N6O2/c1-3-22(24-27-28-29-31(24)16-21-12-7-13-33-21)30(20-10-4-5-11-20)15-19-14-18-9-6-8-17(2)23(18)26-25(19)32/h6,8-9,14,20-22,30H,3-5,7,10-13,15-16H2,1-2H3,(H,26,32)/t21-,22-/m1/s1 InChI=1/C25H35N6O2/c1-3-22(24-27-28-29-31(24)16-21-12-7-13-33-21)30(20-10-4-5-11-20)15-19-14-18-9-6-8-17(2)23(18)26-25(19)32/h6,8-9,14,20-22,30H,3-5,7,10-13,15-16H2,1-2H3,(H,26,32)/t21-,22-/m1/s1/f/h26H 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|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 4.6088 22.8164 25.1510 35.6818 40.8517 44.3216 50.8092 56.2222 65.8838 75.9882 91.9473 99.2115 103.6777 119.4345 124.9516 137.8940 157.1503 179.1839 181.3844 197.7284 208.1987 228.1962 235.7946 247.1760 253.6753 275.6978 286.5338 298.7118 328.1909 346.0443 372.5400 373.0886 416.5110 424.8042 439.6442 447.7633 468.0408 483.7005 521.2602 530.8578 539.6936 583.9989 585.8526 606.0499 616.2107 642.9419 649.1517 673.7845 690.7981 715.2644 748.1989 752.7246 771.3318 779.4655 802.2226 825.8479 829.7432 837.2966 845.7164 857.5407 882.0229 885.2083 887.7474 889.1822 898.0167 922.9477 947.1585 952.7484 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226.10 257.81 260.97 284.49 299.55 328.32 339.26 355.63 364.98 396.67 412.26 429.78 472.19 497.88 536.00 536.79 599.27 611.20 632.55 644.23 673.41 695.94 749.98 763.79 776.50 840.24 842.91 871.97 886.59 925.05 933.98 969.43 993.90 1029.11 1076.49 1083.00 1109.77 1121.48 1154.22 1188.21 1193.82 1204.68 1216.80 1233.81 1269.03 1273.62 1277.27 1279.33 1292.05 1327.92 1362.75 1370.79 1389.26 1395.22 1411.72 1431.41 1442.61 1474.03 1487.99 1503.85 1510.61 1513.81 1542.93 1549.47 1553.65 1573.86 1576.77 1580.66 1590.35 1606.94 1621.92 1639.52 1646.17 1648.62 1649.46 1691.36 1700.44 1718.41 1740.11 1755.98 1783.68 1794.83 1826.72 1836.27 1838.64 1869.25 1904.30 1908.14 1909.70 1919.42 1921.55 1944.95 1965.98 1983.48 1992.64 1995.81 2009.08 2020.26 2024.73 2036.82 2051.50 2072.38 2086.45 2094.59 2100.89 2103.85 2114.53 2133.76 2136.97 2149.15 2151.36 2159.55 2168.41 2199.52 2224.58 2227.27 2237.09 2248.24 2252.92 2261.47 2266.78 2272.17 2286.58 2303.68 2326.27 2333.56 2346.14 2347.25 2351.58 2353.12 2356.83 2361.37 2369.14 2369.54 2372.71 2376.58 2377.06 2384.26 2388.23 2405.57 2411.38 2424.12 2513.83 2565.21 2602.83 2629.40 2757.65 4601.47 4602.75 4611.23 4630.07 4647.13 4658.42 4662.79 4669.27 4670.99 4674.17 4675.35 4677.26 4683.16 4685.26 4690.93 4720.61 4728.51 4741.81 4746.42 4747.17 4749.17 4755.88 4761.76 4770.17 4789.11 4800.48 4823.14 4823.80 4830.35 4849.50 4861.53 4895.52 4923.71 5358.86 5548.90 0.635869 0.664935 0.665879 0.570853 -1442.637488 -1442.608422 -1442.607478 -1442.702504 3.187188D-04 MUNgauss RevisionA2.0 retrievium 27-Dec-2020 DUDE CC[C@H](c1nnnn1C[C@H]2CCCO2)[NH+](Cc3cc4cccc(c4[nH]c3=O)C)C5CCCC5 C33937382 RHF 6-31G(d) (6D,10F) C1 451.282150 |X|Y|Z| 120.400609 55.254682 36.571294 62.427992 29 6 7 8 22 6 1 |36.858105| |12.443355|36.858105| |7.369752|12.359214|36.858105| |6.935778|8.904617|17.669312|0.500000| |4.902963|7.617812|12.669555|0.250675|36.858105| |4.077890|5.939908|7.648114|0.159618|14.745277|53.358707| |3.300276|4.465036|5.341200|0.126371|9.068059|19.430095|53.358707| |3.277362|4.356366|5.296266|0.135146|8.912973|12.197758|20.748802|53.358707| |4.023388|5.572341|7.541994|0.199675|14.277086|12.174976|12.434916|19.526673|53.358707| |3.764213|4.727423|5.886518|0.185291|7.397600|7.255431|7.509939|10.807646|17.773985|36.858105| |4.222572|5.107031|5.448368|0.174395|5.818149|5.964117|5.886678|7.461814|10.335586|12.414654|36.858105| |5.189161|5.990591|6.263110|0.220114|5.761080|5.749018|5.327303|6.312056|8.855773|8.841061|17.539793|0.500000| |3.297804|3.676393|3.817604|0.120308|4.005869|4.481236|4.587155|5.671644|6.799747|7.500031|12.398227|0.243251|36.858105| |2.903847|3.293023|3.299495|0.097716|3.619479|4.284418|4.567830|5.618972|6.118584|5.855387|7.980767|0.161695|12.436427|36.858105| |3.360259|3.937464|3.699067|0.105418|4.061198|4.835405|5.054366|6.016856|6.581177|5.599488|8.163316|0.172412|8.043530|12.504975|36.858105| |4.245719|5.393676|5.106576|0.145259|5.710079|6.277857|6.293432|7.678514|9.475350|7.937817|13.610508|0.261152|8.087910|8.145578|13.404474|73.516695| |6.156771|7.549753|12.564476|0.255401|7.548992|8.491377|6.052880|5.659665|7.036006|4.242245|3.857537|0.119876|2.981863|2.627247|2.858277|6.457193|53.358707| |7.488923|7.622396|9.499496|0.223180|5.744399|6.633826|5.014425|4.770189|5.826426|3.733079|3.591394|0.114804|2.837917|2.492963|2.722177|6.044795|25.777529|0.500000| |4.836606|5.951920|7.372333|0.153450|6.260533|8.935490|6.198047|5.320826|5.973455|3.487100|3.174465|0.094075|2.535553|2.331980|2.565560|5.608815|16.879148|0.260381|36.858105| |4.343029|4.644251|5.021800|0.116410|4.228702|5.939534|4.595262|4.067880|4.461335|2.775604|2.615878|0.078120|2.169000|2.005897|2.191485|4.630954|10.249750|0.215207|12.658133|36.858105| |4.464843|4.509757|4.331674|0.101992|3.652676|5.120957|4.078212|3.642586|3.960886|2.513156|2.451567|0.073425|2.055140|1.922525|2.129072|4.437484|7.630237|0.173380|7.638638|14.159517|36.858105| |3.564024|3.437426|3.299248|0.081519|2.866298|4.002482|3.342247|3.033745|3.251031|2.120794|2.084902|0.062142|1.794403|1.687767|1.848615|3.760004|5.524633|0.125172|4.966166|7.786548|13.239335|36.858105| |3.298649|3.103885|2.858693|0.071661|2.516601|3.502460|2.991695|2.741507|2.917741|1.931027|1.934737|0.057525|1.686342|1.601525|1.763657|3.532400|4.490758|0.101450|3.822252|5.110169|7.645693|13.581443|36.858105| |2.715401|2.549552|2.391531|0.061216|2.141829|2.974997|2.599429|2.403945|2.538090|1.703224|1.705264|0.050435|1.510740|1.438940|1.567952|3.095952|3.706978|0.082602|3.069801|3.932503|5.105822|7.944982|13.931129|36.858105| |2.448146|2.322052|2.249710|0.058144|2.029658|2.819596|2.480393|2.299065|2.420425|1.629668|1.612275|0.047552|1.436044|1.362530|1.467333|2.893067|3.547564|0.078246|2.931455|3.791863|4.542563|6.912490|7.968857|13.608906|36.858105| |2.532452|2.434195|2.427921|0.062616|2.185299|3.040618|2.653853|2.449957|2.585579|1.729811|1.687546|0.049796|1.494394|1.408567|1.508490|2.999057|3.958760|0.086846|3.325955|4.506547|5.106135|7.814818|6.767411|7.820953|13.829901|36.858105| |3.007837|2.924290|2.943028|0.074408|2.604345|3.634058|3.091479|2.823688|3.006045|1.978988|1.917617|0.056855|1.670091|1.565688|1.687100|3.406265|5.007347|0.110762|4.405748|6.748828|7.851983|13.660445|7.876696|6.865346|8.020373|13.561866|36.858105| |2.985336|2.980463|3.161788|0.080079|2.814581|3.931006|3.325179|3.029033|3.230441|2.111736|2.002684|0.059231|1.736190|1.615653|1.724182|3.507467|5.645093|0.121130|5.058629|7.953719|7.016168|8.003687|5.195406|4.583693|5.215294|7.859776|13.785263|53.358707| |2.624500|2.620632|2.809619|0.072500|2.547274|3.551820|3.069080|2.818319|2.983441|1.971626|1.860551|0.054736|1.631693|1.519435|1.605731|3.238329|4.891537|0.103233|4.200060|5.804605|5.132744|5.797870|4.257456|4.013582|4.791553|7.284659|9.229488|25.996846|0.500000| |3.393205|3.520830|3.929880|0.097172|3.466553|4.854229|3.973300|3.576542|3.855897|2.463225|2.290826|0.067827|1.948492|1.799729|1.923283|3.984302|7.636406|0.156982|7.455264|12.954214|7.836115|6.686356|4.480708|3.764128|3.949125|5.133866|7.778403|19.047739|0.266077|36.858105| |3.082879|3.260544|3.829325|0.096910|3.490956|4.873268|4.064241|3.683975|3.952047|2.530476|2.295636|0.067402|1.962218|1.803431|1.898616|3.928341|7.383273|0.142337|6.634763|8.062368|5.372446|4.695945|3.489792|3.058539|3.241274|4.088084|5.391960|11.582004|0.220926|15.763299|73.516695| |2.189342|2.122456|2.164644|0.056672|1.978505|2.748530|2.438614|2.266980|2.378232|1.604975|1.552680|0.045569|1.389372|1.308657|1.385013|2.734913|3.505997|0.075513|2.881274|3.693041|3.837655|4.979804|4.404032|4.981528|7.553963|12.610448|7.499983|8.949050|0.210034|4.481987|6.912384|36.858105| |4.452948|4.915683|7.384438|0.203619|5.769306|6.663782|5.285364|5.137464|6.242923|4.021557|3.498249|0.107146|2.824651|2.449738|2.552147|5.584212|17.002630|0.262548|7.515350|5.820345|4.334289|3.466759|2.836485|2.440975|2.419015|2.752330|3.386382|5.473626|0.101758|5.425428|10.739810|2.543491|36.858105| |3.547335|4.094186|6.070237|0.171973|5.966606|7.032371|5.965027|5.951216|7.063478|4.504223|3.589020|0.104445|2.932900|2.553379|2.590044|5.619743|9.947092|0.156496|5.695747|4.360130|3.408152|2.823762|2.378835|2.090596|2.083780|2.347128|2.794797|4.476099|0.086181|4.242387|8.842266|2.221753|12.485410|36.858105| |2.976965|3.214080|4.281700|0.127831|4.089620|4.971032|4.481063|4.570599|5.220415|3.649173|3.031624|0.088558|2.619842|2.270800|2.246875|4.701827|6.807213|0.121611|4.129953|3.562312|2.889401|2.514224|2.145401|1.931220|1.958824|2.213823|2.565752|4.124880|0.082272|3.716406|7.927466|2.154207|8.065379|12.388628|36.858105| |3.248781|3.307086|4.268041|0.134798|3.728058|4.390526|3.900108|4.019886|4.725986|3.455250|3.043851|0.092599|2.654187|2.250629|2.229337|4.657134|6.796016|0.131793|3.867871|3.499189|2.916355|2.568438|2.207326|1.991243|2.015409|2.265118|2.610827|4.121087|0.081739|3.608073|7.298881|2.193110|7.928746|7.727781|12.265686|36.858105| |4.388813|4.374083|5.906412|0.193736|4.533374|5.104091|4.306351|4.391242|5.392379|3.844395|3.495234|0.111116|2.911237|2.445639|2.492684|5.366972|10.110176|0.205581|4.918656|4.342112|3.579117|3.031590|2.572479|2.261852|2.246349|2.514680|2.981681|4.643034|0.088473|4.180890|7.977390|2.354411|12.449653|7.891105|7.685569|12.311390|36.858105| |17.523038|8.649110|6.449322|0.164987|4.378232|5.178164|4.162592|4.042668|4.829773|3.274008|3.496354|0.115157|2.823704|2.511677|2.835894|6.170283|8.939370|0.253085|5.305999|5.165777|5.490455|4.311904|3.906822|3.138187|2.812787|2.928436|3.554360|4.739196|0.083393|3.936681|6.145953|2.481985|4.722985|3.572243|3.037018|3.357392|4.614484|0.500000| |17.546444|8.741019|6.765713|0.208338|4.584243|5.031319|4.207036|4.321293|5.411223|3.956723|4.575876|0.166724|3.614681|3.051714|3.429770|7.663466|7.592848|0.184234|4.174526|3.757813|3.730054|3.100396|2.872622|2.437694|2.241750|2.329734|2.717713|3.730543|0.068214|3.097740|5.147262|2.056327|4.439854|3.579041|3.085693|3.489609|4.771312|0.300995|0.500000| |17.589107|8.858621|5.439685|0.142686|4.109800|4.871754|4.077936|4.043593|4.788128|3.337132|3.855688|0.127447|3.123099|2.831503|3.348599|7.230735|6.329575|0.149200|4.010505|3.738153|4.030862|3.348727|3.246972|2.691329|2.381752|2.405318|2.796441|3.679628|0.066435|2.979100|4.790873|2.071625|3.563620|2.967948|2.547605|2.747953|3.521951|0.304423|0.302684|0.500000| |8.785886|17.580830|8.808958|0.174358|6.872835|8.567227|6.251617|5.713314|6.740633|4.030292|4.193266|0.127700|3.166327|2.961780|3.566864|8.255955|9.317138|0.188171|6.576017|5.136093|5.211222|3.820320|3.455894|2.771124|2.483183|2.588265|3.145386|4.290496|0.075937|3.715146|5.955738|2.220947|4.450079|3.764713|2.962503|2.970767|3.790383|0.208826|0.172054|0.210685|0.500000| |8.872188|17.593853|9.000111|0.213862|7.316391|7.689555|6.239749|6.390247|8.253670|5.344870|6.378381|0.204773|4.350304|3.943810|5.022169|13.270298|7.568701|0.150630|4.625811|3.711788|3.635000|2.904893|2.692772|2.263748|2.068030|2.145828|2.516417|3.478852|0.063539|2.956836|4.968376|1.896284|4.091861|3.661157|2.936469|2.993142|3.777286|0.172161|0.208519|0.217655|0.306463|0.500000| |3.678037|4.388634|5.770290|0.198553|6.491330|6.434668|6.374075|8.332716|12.418788|17.572327|8.795072|0.221121|6.447876|4.768614|4.407934|10.212658|5.997449|0.107804|3.485289|2.803055|2.499920|2.122564|1.916805|1.698766|1.640073|1.754132|2.006268|2.947761|0.056512|2.536526|4.704999|1.639664|4.490041|5.210240|4.319548|4.123409|4.489505|0.090865|0.110588|0.088848|0.103001|0.129676|0.500000| |3.125470|3.811527|4.508925|0.135122|5.731227|6.359475|7.216552|10.953801|12.867062|17.658969|8.801385|0.174292|7.213385|6.341593|5.523500|12.027940|4.771952|0.086572|3.030552|2.463014|2.244981|1.923564|1.763999|1.570853|1.508811|1.597287|1.809031|2.623715|0.050415|2.223582|4.085095|1.493284|3.398918|3.902275|3.283606|3.044788|3.243876|0.077029|0.090169|0.079080|0.094428|0.118796|0.302486|0.500000| |3.349068|3.547221|3.550068|0.112807|3.526311|3.986788|3.975670|4.703824|5.595192|5.589376|8.815225|0.226690|17.575203|8.806743|6.823530|11.748678|3.849923|0.076616|2.397781|2.091849|2.005663|1.766290|1.673189|1.503817|1.425852|1.475828|1.641012|2.304291|0.044198|1.881744|3.344132|1.370389|2.675720|2.700406|2.456481|2.557013|2.827006|0.079273|0.104584|0.089558|0.084365|0.115673|0.144150|0.143971|0.500000| |2.953682|3.256925|3.528208|0.112467|3.732212|4.218190|4.370955|5.440068|6.401911|7.271759|8.661243|0.190250|17.575181|8.647979|5.720024|10.405967|3.878645|0.074834|2.422369|2.079895|1.949431|1.713037|1.601419|1.443723|1.384308|1.448272|1.613415|2.302527|0.044483|1.899429|3.443556|1.358220|2.800151|2.989288|2.733126|2.752370|2.923240|0.072038|0.090140|0.076758|0.078809|0.102507|0.193387|0.210587|0.302334|0.500000| |2.599238|2.852360|2.816053|0.083188|3.011029|3.642813|3.852418|4.570572|4.875377|4.442479|5.705074|0.129309|8.687841|17.603094|8.722187|10.352818|3.144257|0.061669|2.071596|1.815380|1.754833|1.559832|1.492420|1.351130|1.280201|1.316901|1.451566|2.028109|0.039078|1.642354|2.920144|1.227371|2.172788|2.246973|2.038453|2.037998|2.193155|0.063152|0.076088|0.071496|0.072124|0.092954|0.107028|0.132213|0.218408|0.194116|0.500000| |2.659523|3.065814|3.167862|0.092472|3.625625|4.390182|4.882321|6.195912|6.358251|5.999695|6.748407|0.137262|8.772770|17.563272|8.833590|12.114413|3.483217|0.066482|2.303920|1.969524|1.871153|1.643258|1.551808|1.397435|1.329884|1.380385|1.534003|2.168257|0.041767|1.780067|3.197641|1.288579|2.415840|2.583383|2.293829|2.223479|2.374590|0.064992|0.076587|0.071340|0.077998|0.099604|0.133669|0.204685|0.173782|0.216222|0.301911|0.500000| |3.414902|3.815634|3.426008|0.097961|3.562049|4.274571|4.326967|4.927213|5.434340|4.509735|6.544413|0.158147|6.747846|8.776036|17.558670|16.514394|3.671248|0.072951|2.423844|2.112637|2.084924|1.825878|1.762022|1.569991|1.461011|1.490425|1.658267|2.283480|0.043356|1.852275|3.221911|1.364062|2.397644|2.378040|2.090476|2.111256|2.376447|0.079460|0.097418|0.097654|0.096012|0.134918|0.104828|0.119937|0.186880|0.136654|0.218301|0.174114|0.500000| |3.055676|3.631293|3.407278|0.093864|3.872012|4.851503|5.247824|6.126830|6.200294|4.851503|6.024051|0.133558|5.746591|8.668547|17.638617|16.655312|3.664049|0.070734|2.492829|2.131813|2.079136|1.809359|1.732241|1.542007|1.441319|1.478444|1.650083|2.290033|0.043552|1.871868|3.281423|1.357458|2.395300|2.448912|2.117648|2.069224|2.293467|0.072984|0.084303|0.085245|0.095268|0.125660|0.106931|0.138722|0.137702|0.126956|0.192480|0.219298|0.300582|0.500000| |5.067092|6.827751|7.437851|0.147179|6.816598|10.648781|6.959486|5.736858|6.306551|3.570908|3.313834|0.096857|2.615094|2.452950|2.771464|6.107592|12.243456|0.206470|17.753618|8.931218|7.232048|4.706236|3.819219|3.029139|2.811277|3.083752|3.972490|5.794473|0.099513|5.597835|8.800416|2.643962|5.611986|4.694038|3.492765|3.288529|4.087215|0.147448|0.116530|0.120226|0.241298|0.147142|0.095377|0.086511|0.068414|0.068268|0.060263|0.067221|0.072632|0.075766|0.500000| |3.899881|4.766722|6.167779|0.136448|6.089065|9.385239|6.703229|5.599393|6.036136|3.467632|3.032124|0.087599|2.454212|2.271403|2.455952|5.304088|12.268395|0.185599|17.722541|8.872112|5.752208|4.205305|3.307437|2.757491|2.699328|3.095145|3.981099|6.502597|0.115255|7.113481|13.101628|2.777348|7.410773|6.516548|4.541246|3.943130|4.670729|0.114864|0.097651|0.092329|0.141818|0.110372|0.097036|0.085415|0.063694|0.066122|0.056016|0.063360|0.063648|0.066848|0.304575|0.500000| |5.146003|5.262507|4.612205|0.106186|3.869507|5.424555|4.282547|3.816932|4.162148|2.625918|2.613600|0.078387|2.169954|2.045337|2.309923|4.840888|7.438504|0.168732|7.052772|9.067963|17.680077|8.834406|7.067272|4.697766|3.961560|4.153418|5.625505|6.838379|0.110522|5.574513|7.612024|3.219572|4.010492|3.226758|2.702986|2.732706|3.377204|0.173305|0.113306|0.132729|0.182039|0.116166|0.071265|0.064884|0.058926|0.056420|0.051743|0.054935|0.063208|0.062827|0.217243|0.145414|0.500000| |3.562131|3.328788|2.942299|0.073282|2.587801|3.596360|3.070019|2.815450|2.999420|1.984211|2.015522|0.059970|1.751449|1.672963|1.865007|3.732019|4.462349|0.100869|3.745236|4.691946|7.006475|8.875690|17.713664|8.953630|5.646625|4.896732|5.620499|5.731210|0.097947|3.902707|5.569895|3.527142|2.746655|2.318779|2.069797|2.130108|2.502487|0.115938|0.084346|0.100458|0.105020|0.080569|0.054161|0.050267|0.048400|0.045803|0.043317|0.044805|0.052098|0.050985|0.108293|0.088902|0.213646|0.500000| |2.519461|2.354540|2.182098|0.056248|1.970414|2.731716|2.415168|2.246220|2.362370|1.597519|1.612951|0.047574|1.440701|1.380170|1.505668|2.944087|3.297516|0.073085|2.680980|3.280847|4.129612|5.639252|8.959501|17.744060|8.875965|5.609244|4.950375|4.958168|0.091174|3.115436|4.645058|4.081061|2.177354|1.890619|1.754197|1.811025|2.043346|0.079442|0.063187|0.070721|0.070850|0.058962|0.044090|0.041114|0.039991|0.038171|0.036188|0.037161|0.042121|0.041220|0.074609|0.067402|0.111148|0.214767|0.500000| |2.169408|2.058150|1.999132|0.052179|1.821588|2.526545|2.251982|2.099929|2.200393|1.493838|1.480288|0.043501|1.331263|1.266855|1.357489|2.653280|3.102934|0.067889|2.520626|3.135871|3.615699|4.972789|5.677369|8.917289|17.720280|9.006905|5.682934|5.723351|0.112885|3.297695|5.003143|7.039072|2.148268|1.880222|1.789330|1.841700|2.021793|0.068177|0.055856|0.059031|0.060623|0.051578|0.041795|0.038646|0.036793|0.035746|0.033223|0.034380|0.037615|0.037082|0.067441|0.065431|0.090193|0.124450|0.215899|0.500000| |2.091730|2.068928|2.135084|0.055636|1.984118|2.790804|2.488454|2.297934|2.388206|1.601292|1.534547|0.044718|1.372680|1.297862|1.371033|2.706001|3.458657|0.072996|2.897219|3.660317|3.681582|4.550183|3.941138|4.270382|5.879490|8.808805|6.639579|8.923039|0.224988|4.572787|7.261183|17.530872|2.528445|2.249702|2.177689|2.170447|2.299521|0.065083|0.054552|0.054819|0.060398|0.051549|0.045385|0.041579|0.037400|0.037374|0.033760|0.035690|0.037314|0.037482|0.073777|0.079408|0.085925|0.089877|0.099282|0.152995|0.500000| |2.219249|2.132645|2.201879|0.058301|1.994373|2.735657|2.426331|2.274248|2.404349|1.634422|1.578119|0.046526|1.414521|1.322307|1.391060|2.752289|3.599081|0.078006|2.881019|3.658167|3.674194|4.546018|3.936970|4.267378|5.878024|8.806940|6.634142|8.917466|0.223282|4.567958|7.253742|17.528923|2.676948|2.319712|2.290959|2.365910|2.519810|0.070125|0.058593|0.057808|0.061098|0.052839|0.046781|0.042136|0.038826|0.038565|0.034447|0.036129|0.038040|0.037672|0.072221|0.077290|0.085592|0.089760|0.099207|0.152994|0.300962|0.500000| |1.997145|1.926663|1.945242|0.051238|1.788851|2.481444|2.224879|2.078831|2.172675|1.477182|1.437867|0.042101|1.297067|1.226731|1.296540|2.539499|3.082265|0.066327|2.496032|3.093061|3.263059|4.158092|3.961770|4.744564|7.281544|8.885025|5.556813|6.548562|0.147175|3.582160|5.663172|17.612771|2.231533|1.974995|1.925813|1.966763|2.096887|0.062299|0.052348|0.053107|0.055889|0.048313|0.041820|0.038356|0.035650|0.035221|0.032111|0.033528|0.035600|0.035349|0.064699|0.066890|0.078671|0.090218|0.113404|0.225360|0.302976|0.302849|0.500000| |3.909091|4.168304|5.555141|0.146847|4.625845|5.809067|4.695038|4.441353|5.112698|3.303205|2.933140|0.088488|2.437605|2.159530|2.253291|4.808597|12.551920|0.223499|7.614536|6.786531|4.729254|3.848843|3.043790|2.630951|2.662613|3.122932|3.923060|6.765784|0.126099|7.202436|15.705615|2.910875|17.693017|8.986510|7.246245|6.969891|8.906293|0.119926|0.105842|0.089613|0.110329|0.096958|0.100029|0.080145|0.064662|0.067182|0.053879|0.059376|0.059299|0.059480|0.149718|0.217294|0.114778|0.079778|0.064238|0.065227|0.080850|0.086046|0.069610|0.500000| |3.216998|3.790550|5.344883|0.140147|5.798345|7.657516|6.565842|6.185023|6.789020|4.099611|3.262416|0.092318|2.691806|2.418268|2.473968|5.301955|8.733187|0.137118|5.949315|4.463041|3.436329|2.844420|2.383346|2.096180|2.097262|2.374399|2.834301|4.593278|0.088803|4.415104|9.494389|2.255684|8.671486|17.608203|8.663650|5.594690|5.614784|0.090371|0.087650|0.076405|0.101225|0.094870|0.124523|0.102346|0.068428|0.075795|0.059262|0.068879|0.062812|0.066265|0.136967|0.214336|0.089798|0.064303|0.052551|0.052544|0.064445|0.064709|0.055546|0.216210|0.500000| 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