Version2.0 2020-02-03T14:00:33Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 15-Oct-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCc1ccc(cc1)[C@@H]2CN3C(=O)CN(C(=O)[C@@]3([C@@H]4C2=c5ccccc5=[NH+]4)C)CCc6ccccc6 C63374693 RHF 6-31G(d) (6D,7F) CCc1ccc(cc1)[C@@H]2CN3C(=O)CN(C(=O)[C@@]3([C@@H]4C2=c5ccccc5=[NH+]4)C)CCc6ccccc6 C01[X(C31H32N3O2)] 198 C1 604 CCc1ccc(cc1)[C@@H]1CN2C(=O)CN(C(=O)[C@@]2([C@@H]2C1=c1ccccc1=[NH+]2)C)CCc1ccccc1 CCc1ccc(cc1)[C@@H]1CN2C(=O)CN(C(=O)[C@@]2([C@@H]2C1=c1ccccc1=[NH+]2)C)CCc1ccccc1 CCc1ccc(cc1)[C@@H]2CN3C(=O)CN(CCc4ccccc4)C(=O)[C@]3(C)[C@H]5[NH+]=C6C=CC=CC6=C25 InChIKey=MHXJQMYIOPYJSS-PYISFFCESA-O InChI=1S/C31H31N3O2/c1-3-21-13-15-23(16-14-21)25-19-34-27(35)20-33(18-17-22-9-5-4-6-10-22)30(36)31(34,2)29-28(25)24-11-7-8-12-26(24)32-29/h4-16,25,29H,3,17-20H2,1-2H3/p+1/t25-,29-,31-/m0/s1 InChI=1/C31H31N3O2/c1-3-21-13-15-23(16-14-21)25-19-34-27(35)20-33(18-17-22-9-5-4-6-10-22)30(36)31(34,2)29-28(25)24-11-7-8-12-26(24)32-29/h4-16,25,29H,3,17-20H2,1-2H3/p+1/t25-,29-,31-/m0/s1/fC31H32N3O2/h32H/q+1 CCc1ccc(cc1)[C@@H]2CN3C(=O)CN(C(=O)[C@@]3([C@@H]4C2=c5ccccc5=[NH+]4)C)CCc6ccccc6 C01[X(C31H32N3O2)] 198 C01 604 CCc1ccc(cc1)[C@@H]1CN2C(=O)CN(C(=O)[C@@]2([C@@H]2C1=c1ccccc1=[NH+]2)C)CCc1ccccc1 CCc1ccc(cc1)[C@@H]1CN2C(=O)CN(C(=O)[C@@]2([C@@H]2C1=C1C=CC=C[C@@H]1N2)C)CCc1ccccc1 CCc1ccc(cc1)[C@@H]2CN3C(=O)CN(CCc4ccccc4)C(=O)[C@]3(C)[C@H]5N[C@H]6C=CC=CC6=C25 InChIKey=UQJXUEJCXIKNQF-KNQVBONESA-N InChI=1S/C31H33N3O2/c1-3-21-13-15-23(16-14-21)25-19-34-27(35)20-33(18-17-22-9-5-4-6-10-22)30(36)31(34,2)29-28(25)24-11-7-8-12-26(24)32-29/h4-16,25-26,29,32H,3,17-20H2,1-2H3/t25-,26-,29-,31-/m0/s1 InChI=1/C31H33N3O2/c1-3-21-13-15-23(16-14-21)25-19-34-27(35)20-33(18-17-22-9-5-4-6-10-22)30(36)31(34,2)29-28(25)24-11-7-8-12-26(24)32-29/h4-16,25-26,29,32H,3,17-20H2,1-2H3/t25-,26-,29-,31-/m0/s1 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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| 14.2164 20.4393 22.6148 28.7258 33.2622 41.1711 48.7807 58.8511 66.2256 74.7206 86.0174 99.1352 105.2152 132.4772 133.9073 143.9022 179.2450 217.1511 224.9462 231.3270 247.1462 248.8958 264.0325 276.8315 285.4320 326.3335 338.8600 357.6875 366.7798 377.3965 393.0279 399.4806 404.4916 434.1421 452.9043 455.7000 457.0162 482.9082 496.9849 506.8498 522.1257 539.2050 556.5273 560.3724 574.3514 601.5273 617.3908 646.1180 651.2433 665.7434 681.0636 697.9048 701.7029 718.0542 742.6236 762.9186 773.8587 778.7972 789.7046 811.0522 827.2722 832.8799 841.3779 845.6366 852.0520 854.5350 860.6872 875.1832 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312.43 323.65 332.83 355.59 358.11 379.88 398.30 410.67 469.52 487.54 514.63 527.71 542.99 565.48 574.76 581.97 624.63 651.63 655.65 657.54 694.80 715.05 729.24 751.22 775.80 800.72 806.25 826.36 865.46 888.29 929.62 936.99 957.86 979.90 1004.13 1009.59 1033.12 1068.47 1097.67 1113.41 1120.52 1136.21 1166.92 1190.26 1198.33 1210.56 1216.68 1225.91 1229.49 1238.34 1259.19 1267.06 1294.14 1349.36 1359.88 1373.16 1379.23 1380.96 1391.30 1432.69 1488.11 1497.94 1507.52 1516.71 1547.34 1557.91 1568.73 1571.18 1575.84 1586.14 1594.04 1602.60 1610.05 1613.82 1620.84 1624.74 1627.53 1631.29 1646.66 1664.65 1666.54 1703.83 1704.24 1722.30 1725.02 1741.09 1763.32 1779.54 1806.44 1835.13 1842.19 1845.24 1868.21 1874.59 1885.63 1896.52 1901.67 1905.02 1913.92 1918.54 1937.79 1946.70 1993.98 2007.44 2011.05 2021.80 2037.82 2073.92 2083.12 2085.18 2095.81 2118.58 2133.52 2139.02 2143.03 2151.57 2184.49 2201.54 2208.57 2232.30 2242.06 2249.40 2252.46 2262.46 2272.09 2291.46 2333.83 2336.90 2340.65 2350.80 2352.66 2357.73 2359.86 2365.99 2370.73 2380.14 2405.27 2406.46 2423.09 2436.90 2500.18 2542.36 2544.01 2569.89 2606.70 2615.68 2659.91 2722.04 2826.33 4616.77 4623.49 4630.26 4634.67 4647.33 4656.66 4672.20 4675.16 4682.80 4687.22 4702.33 4718.36 4720.43 4750.20 4769.95 4791.18 4813.25 4816.29 4817.05 4819.54 4843.81 4847.11 4851.67 4862.68 4865.26 4876.56 4882.15 4889.91 4907.14 4910.70 4916.75 5535.79 0.615243 0.644328 0.645272 0.551061 -1504.863074 -1504.833989 -1504.833045 -1504.927256 3.159852D-04 MUNgauss RevisionA2.0 retrievium 03-Feb-2020 DUDE CCc1ccc(cc1)[C@@H]2CN3C(=O)CN(C(=O)[C@@]3([C@@H]4C2=c5ccccc5=[NH+]4)C)CCc6ccccc6 C63374693 RHF 6-31G(d) (6D,10F) C1 478.249452 |X|Y|Z| 121.301090 73.395018 42.601787 72.385743 31 6 7 28 3 |36.858105| |12.418651|36.858105| |7.513460|12.587802|36.858105| |5.677502|7.528487|13.684935|36.858105| |4.171222|5.007817|7.891830|13.793548|36.858105| |3.734060|4.398480|6.760215|7.886851|13.678347|36.858105| |4.148076|4.996667|7.863957|6.899161|7.987281|13.730371|36.858105| |5.640115|7.533379|13.730301|8.011002|6.932624|7.909889|13.731796|36.858105| |2.896339|3.248509|4.377752|5.008297|7.566194|12.412079|7.406130|4.961257|36.858105| |2.816417|3.045529|3.986477|4.670299|6.871656|8.903268|5.862382|4.313463|17.563727|0.500000| |2.571001|2.832694|3.629565|3.791469|4.905970|7.300272|6.388013|4.360388|12.368470|0.248914|36.858105| |2.418982|2.731081|3.422594|3.455646|4.226717|5.901188|5.797170|4.165568|7.612250|0.156190|13.009610|53.358707| |2.337018|2.609912|3.166605|3.046484|3.504041|4.659063|5.165696|3.954990|5.217396|0.118053|7.880901|18.994125|36.858105| |2.412032|2.633175|3.163825|2.974181|3.350659|4.428013|5.178806|4.034926|4.751449|0.113055|7.024636|11.514722|15.934701|73.516695| |2.083090|2.335889|2.729811|2.613119|2.904229|3.597077|3.938553|3.287058|3.871681|0.090794|5.015459|10.513693|12.605178|14.485178|36.858105| |2.031175|2.318874|2.700720|2.631739|2.924520|3.512710|3.695906|3.149012|3.756551|0.087232|4.460782|9.239674|7.619916|9.488736|13.164734|53.358707| |2.058274|2.365220|2.802679|2.829808|3.243086|3.878518|3.825400|3.189994|4.334587|0.098531|4.938886|10.343747|6.624099|8.329611|7.830313|19.517229|36.858105| |1.946124|2.243296|2.612631|2.678036|3.027059|3.437354|3.312420|2.868193|3.759315|0.087910|3.970734|7.258333|4.672260|6.432851|5.350002|11.553624|15.735599|73.516695| |2.188907|2.491469|3.050832|3.175924|3.861061|4.879244|4.485559|3.494848|6.233743|0.134183|7.592149|17.755194|7.715359|9.480287|6.682711|10.504768|12.405053|14.426273|36.858105| |2.384056|2.772919|3.480084|3.828332|4.889218|5.903747|4.852891|3.809960|7.409057|0.153039|6.585415|10.761805|5.247144|7.351858|4.571539|7.234734|7.757229|12.571237|12.215012|36.858105| |2.610875|3.138987|4.001063|4.325735|5.358601|6.393759|5.507360|4.402624|6.629644|0.136783|5.738077|9.574359|5.126393|7.287024|4.575405|7.403680|7.434502|12.311388|8.821324|17.564688|0.500000| |2.555997|2.915249|3.763725|4.404948|6.290126|7.668356|5.308999|4.024695|12.725600|0.250042|7.843476|9.335022|4.622031|7.016717|3.761017|5.389125|4.999197|8.115073|7.515544|12.731366|0.250550|36.858105| |2.318938|2.601296|3.222979|3.863004|5.217197|5.384332|3.979591|3.272447|7.296695|0.190621|5.274099|6.448764|3.538269|5.534866|3.055068|4.443111|4.070240|7.103422|5.453433|8.205169|0.175816|14.069465|36.858105| |2.238530|2.440500|2.953631|3.600389|4.708412|4.505467|3.407682|2.910182|5.677856|0.174351|4.250486|4.983769|2.907171|4.737948|2.529096|3.584063|3.122945|5.470809|3.936615|5.074938|0.120739|7.419285|13.195431|36.858105| |1.991812|2.156685|2.523259|3.014113|3.678892|3.466412|2.778202|2.457002|4.080985|0.121121|3.322550|4.091278|2.473960|4.044843|2.225061|3.191965|2.760825|4.985072|3.304937|4.103438|0.100161|5.137145|7.957957|14.209122|36.858105| |1.842793|2.019064|2.330106|2.719273|3.220675|3.087119|2.554705|2.282350|3.557057|0.099700|3.027524|3.935032|2.400286|3.862043|2.223814|3.278019|2.882093|5.406723|3.331629|4.155621|0.101353|4.652407|6.880851|7.858781|13.149254|36.858105| |1.871335|2.086118|2.424980|2.790165|3.314111|3.266901|2.725033|2.411015|3.781795|0.100638|3.271396|4.444358|2.671085|4.193622|2.511980|3.818312|3.483375|6.769664|3.988406|5.199838|0.123525|5.293801|7.642625|6.601821|7.704523|14.075832|36.858105| |2.086280|2.360459|2.832697|3.276394|4.079104|4.183005|3.370820|2.874238|5.092665|0.128273|4.249310|5.825189|3.308242|5.063377|3.031233|4.646015|4.439917|8.410114|5.493215|8.386831|0.178725|8.440627|13.161857|7.627228|6.807678|8.069977|13.420731|36.858105| |2.111719|2.427710|2.923685|3.262589|3.984737|4.312338|3.621939|3.054036|5.127831|0.120379|4.574879|6.963770|3.879092|5.688997|3.649915|5.931993|6.214768|12.398699|7.510414|13.198276|0.254801|8.295734|8.435979|5.289538|4.657073|5.262790|7.721927|14.546012|53.358707| |1.971026|2.266022|2.665774|2.904904|3.400238|3.642767|3.210960|2.783782|4.127232|0.098791|3.876853|6.128828|3.620242|5.304556|3.603253|6.142644|6.526220|15.308770|6.596155|8.910933|0.209035|5.851965|5.892494|4.212913|3.924801|4.599376|6.712321|9.169598|25.957521|0.500000| |1.901597|2.107566|2.509801|2.641132|3.167634|3.790880|3.443986|2.793353|4.979808|0.119616|6.097018|10.414528|5.697468|7.819490|5.264466|7.735154|7.679785|11.222704|12.367373|7.380377|0.151836|5.965955|5.090557|3.891527|3.375434|3.447640|4.086155|5.289333|8.785299|0.163525|36.858105| |1.861892|2.119394|2.387700|2.304941|2.480666|2.852717|3.021566|2.717075|2.947270|0.070700|3.325198|6.078696|4.978955|7.114643|7.628641|17.649857|7.888756|12.354838|4.974168|3.993809|0.116432|3.115393|2.698597|2.244288|2.051149|2.135721|2.472700|2.881266|4.867014|0.107105|4.156300|36.858105| |1.626920|1.816302|2.020109|1.974500|2.127292|2.407575|2.496181|2.257130|2.546539|0.062740|2.884438|5.016413|4.047009|6.034488|5.801751|10.359547|5.855789|9.934888|4.149272|3.341361|0.092895|2.704719|2.421802|2.056122|1.911702|2.006954|2.307548|2.610703|4.286447|0.095273|3.905205|12.426928|36.858105| |1.506964|1.675588|1.825206|1.774622|1.875981|2.076160|2.161243|2.008968|2.148888|0.053720|2.366832|3.931022|3.134614|4.898479|4.135190|6.766140|4.156523|7.491767|3.168428|2.724508|0.077036|2.269891|2.074334|1.797102|1.693956|1.784576|2.029173|2.237835|3.581828|0.079841|3.003210|7.574582|12.583726|36.858105| |1.448655|1.595745|1.718411|1.653124|1.729558|1.910213|2.015208|1.895881|1.957098|0.049379|2.162842|3.517201|2.872455|4.647757|3.719426|5.552458|3.377652|5.888906|2.719336|2.358977|0.066935|2.021861|1.847659|1.624559|1.530572|1.594348|1.783483|1.955654|3.063760|0.066871|2.584950|5.646776|7.542877|13.710676|36.858105| |1.350313|1.480729|1.572898|1.512780|1.566431|1.704735|1.793660|1.713435|1.730224|0.044049|1.879035|2.982801|2.393170|3.940771|2.950745|4.358030|2.771805|4.938427|2.297422|2.053867|0.058529|1.787071|1.653830|1.471517|1.398277|1.459086|1.620161|1.751264|2.704054|0.058994|2.194698|4.166201|5.009374|7.896699|13.747721|36.858105| |1.307367|1.437921|1.521390|1.473750|1.522370|1.637590|1.704937|1.636695|1.659038|0.042323|1.772639|2.792929|2.186245|3.578276|2.634317|4.000498|2.641468|4.864312|2.189161|1.999861|0.057106|1.735934|1.625294|1.448850|1.388628|1.462674|1.629360|1.742023|2.685085|0.059248|2.096925|3.775236|4.426108|6.826858|7.936012|13.755420|36.858105| |1.349139|1.494842|1.593186|1.557067|1.618441|1.737458|1.789530|1.706835|1.769898|0.044932|1.878457|2.984789|2.293621|3.686256|2.768259|4.386805|2.965545|5.654338|2.402123|2.206875|0.062961|1.884183|1.772124|1.566362|1.506388|1.604592|1.809384|1.931492|3.011793|0.067675|2.300715|4.215649|5.013876|7.897683|6.889982|7.953666|13.746572|36.858105| |1.447114|1.613303|1.744774|1.711173|1.800059|1.956311|2.009151|1.886788|2.014751|0.050625|2.161696|3.519922|2.704675|4.245097|3.372227|5.610762|3.746004|7.229078|2.897127|2.598807|0.073787|2.165334|2.016715|1.754609|1.675387|1.789548|2.045336|2.216228|3.533777|0.080374|2.762513|5.769290|7.554046|13.700453|7.966291|6.888358|7.934801|13.756696|36.858105| |17.563403|8.791287|5.487462|4.435901|3.419402|3.100008|3.405948|4.418130|2.494465|0.067486|2.251965|2.925230|2.096395|3.837954|1.903319|2.538202|1.879536|3.185837|1.970203|2.130032|0.064576|2.250020|2.069133|2.005491|1.812590|1.693305|1.718388|1.891677|2.608609|0.050202|1.728783|1.735055|1.526463|1.428670|1.380530|1.296618|1.258905|1.294560|1.377970|0.500000| |17.556505|8.758260|6.799145|5.998563|4.396105|3.765004|3.950678|5.008799|2.950977|0.081594|2.564081|3.217718|2.247130|4.106397|1.990002|2.648101|1.995938|3.368426|2.152676|2.370497|0.071154|2.601566|2.396297|2.361702|2.099964|1.916739|1.920525|2.128359|2.882012|0.054499|1.890614|1.773808|1.562915|1.443718|1.382629|1.288594|1.251002|1.295115|1.390590|0.301384|0.500000| |17.559482|8.761600|6.801543|5.044990|3.977284|3.766769|4.364627|5.936218|2.943919|0.079685|2.676714|3.403385|2.454511|4.599390|2.165149|2.820431|2.075206|3.444382|2.216322|2.363675|0.071330|2.535700|2.271059|2.184437|1.931847|1.783050|1.813814|2.033126|2.816357|0.053607|1.927902|1.889832|1.652505|1.525281|1.474527|1.369794|1.316741|1.351869|1.452176|0.301336|0.301698|0.500000| |8.846669|17.550955|8.923584|7.117450|4.723352|3.960792|4.215250|5.683862|3.018407|0.079026|2.602594|3.441744|2.389145|4.216070|2.172808|2.991707|2.268979|3.896870|2.371151|2.686816|0.084591|2.810139|2.569423|2.428762|2.177265|2.052867|2.115567|2.362743|3.280770|0.062819|2.021886|2.030072|1.749747|1.625216|1.541036|1.438307|1.408765|1.471599|1.582019|0.213269|0.210548|0.172925|0.500000| |8.848460|17.555854|8.925921|5.665308|4.217769|3.962553|4.724384|7.148104|3.010795|0.077301|2.719537|3.669625|2.640609|4.749823|2.404563|3.244617|2.386244|4.014367|2.456099|2.676684|0.084873|2.728073|2.417744|2.238438|1.992732|1.892082|1.976231|2.235174|3.185274|0.061468|2.067189|2.207714|1.877008|1.743103|1.670189|1.552807|1.503729|1.555620|1.673564|0.213278|0.172912|0.210677|0.304090|0.500000| |5.579335|6.976925|8.902233|17.706845|8.962234|5.632215|4.964888|5.672139|4.102736|0.110304|3.190574|3.997277|2.613709|4.532167|2.296067|3.178372|2.515029|4.319246|2.778744|3.345008|0.103076|3.811324|3.547515|3.440096|2.971730|2.682504|2.703188|3.070260|4.069616|0.074799|2.374746|2.084061|1.810176|1.645787|1.535740|1.417570|1.390394|1.469758|1.602510|0.125760|0.174871|0.129784|0.212221|0.143337|0.500000| |3.568734|4.096863|5.639622|8.984817|17.692202|8.875261|5.656606|4.981205|7.054422|0.196071|4.512815|5.245951|3.156466|5.314010|2.663530|3.698660|3.071727|5.210028|3.692161|4.815454|0.138798|6.628124|6.165362|5.956415|4.489447|3.759483|3.747685|4.560156|5.671650|0.097095|3.150610|2.322492|2.027894|1.793165|1.646358|1.496527|1.463306|1.562612|1.735296|0.083878|0.107159|0.093756|0.112318|0.097244|0.218262|0.500000| |3.554842|4.100549|5.642577|4.969839|5.650046|8.861178|17.760482|8.996718|6.778230|0.149367|7.266922|9.453137|6.753053|12.765042|4.744488|5.674301|4.132218|6.106989|4.837719|4.730080|0.144312|4.910988|3.672938|3.128155|2.581955|2.402343|2.581475|3.183112|4.756255|0.087292|3.677749|3.316593|2.717691|2.318299|2.173379|1.911313|1.793522|1.871145|2.114706|0.083672|0.093225|0.106493|0.097450|0.112766|0.107796|0.123733|0.500000| |5.516463|6.983274|8.924106|5.672087|4.982309|5.647544|8.961792|17.708140|4.056786|0.099751|3.839006|5.173992|3.836300|7.171760|3.275385|4.191197|3.008647|4.795592|3.184640|3.323038|0.105504|3.388456|2.809826|2.517652|2.168209|2.038997|2.157350|2.531714|3.695979|0.070152|2.580981|2.713692|2.250674|2.023019|1.935214|1.753599|1.663486|1.717332|1.886701|0.124826|0.128361|0.171380|0.143997|0.214159|0.124313|0.107991|0.219320|0.500000| |2.708063|2.926923|3.732266|3.741772|4.627024|6.837601|6.873860|4.664600|8.792569|0.207643|17.724715|12.552799|7.771677|15.118946|4.812008|5.496983|4.170433|6.042108|5.615898|4.942522|0.129010|5.645957|4.171750|3.586088|2.882771|2.619723|2.777522|3.453117|4.997893|0.089446|4.711394|3.106937|2.702878|2.251873|2.098616|1.831019|1.713701|1.792863|2.041575|0.065525|0.074506|0.080174|0.073162|0.078459|0.086898|0.114515|0.240396|0.116772|0.500000| |2.284723|2.468458|3.058824|3.239124|4.100903|5.442938|4.731502|3.521958|8.868397|0.227009|17.564339|12.376197|6.369859|10.348011|4.474774|5.468233|4.483708|6.589435|6.809118|5.740892|0.132221|6.930879|5.225903|4.377555|3.449222|3.119111|3.322312|4.221190|5.958978|0.103582|6.723039|3.068928|2.771798|2.276986|2.081574|1.812373|1.712300|1.814891|2.085140|0.056275|0.063926|0.065859|0.063842|0.065750|0.078238|0.110533|0.144136|0.087955|0.304640|0.500000| |2.128038|2.386050|2.741576|2.554074|2.759526|3.367216|3.851396|3.340861|3.440735|0.081901|4.260457|8.011081|9.129234|13.572524|17.643311|12.523772|5.872069|7.910947|5.030403|3.851298|0.111455|3.271961|2.699924|2.281534|2.021852|2.014236|2.249312|2.666001|4.282046|0.086735|4.067965|7.230141|5.366012|4.114205|3.885645|3.091369|2.708274|2.780354|3.315953|0.054293|0.055773|0.061862|0.061196|0.069442|0.062401|0.069481|0.130059|0.095765|0.119418|0.104650|0.500000| |1.886744|2.078516|2.393774|2.315800|2.570315|3.117498|3.327191|2.820727|3.440254|0.083395|4.482819|8.510631|9.052383|12.464226|17.531454|12.317478|6.338739|8.324465|5.697740|3.948403|0.105749|3.361064|2.818634|2.379501|2.118124|2.121069|2.376438|2.809421|4.500727|0.091290|5.204237|6.533609|5.986514|4.199803|3.841724|3.007845|2.646754|2.753597|3.349947|0.048197|0.050416|0.054554|0.053989|0.059115|0.057282|0.066634|0.109017|0.078144|0.120420|0.118518|0.303584|0.500000| |2.362774|2.528354|3.077521|3.788640|5.022303|4.748893|3.543778|3.021138|5.957378|0.206287|4.352426|4.841676|2.865940|4.788188|2.446468|3.380127|2.867697|4.915242|3.609552|4.422045|0.108606|6.551573|8.706681|17.743010|9.027532|5.583144|4.811551|5.488067|5.833040|0.097788|3.536777|2.117255|1.938211|1.700103|1.553479|1.409517|1.380230|1.479145|1.647918|0.058342|0.070170|0.064409|0.069220|0.063710|0.100331|0.179907|0.089678|0.072192|0.104948|0.124829|0.061873|0.064068|0.500000| |1.906172|2.030030|2.335871|2.774115|3.291224|3.064194|2.506537|2.254960|3.507163|0.106586|2.919961|3.572911|2.212507|3.676899|1.997216|2.831494|2.396384|4.306645|2.814263|3.355583|0.083998|4.102650|5.627277|9.048480|17.755599|8.764391|5.586107|4.923581|5.021727|0.089445|2.889599|1.841619|1.729790|1.548102|1.410930|1.297058|1.288417|1.389631|1.532197|0.048450|0.056282|0.051330|0.057072|0.051962|0.077267|0.110627|0.064849|0.055704|0.072210|0.084585|0.050905|0.053187|0.215587|0.500000| |1.696894|1.843571|2.087742|2.406186|2.767073|2.640145|2.238861|2.034820|2.966390|0.083580|2.591661|3.396582|2.122980|3.447941|1.994162|2.932239|2.530910|4.779161|2.839462|3.400407|0.085111|3.685395|4.957563|5.655125|8.794006|17.722396|9.099452|5.699044|5.718189|0.107551|2.964040|1.946280|1.851633|1.668322|1.497099|1.381099|1.391769|1.525436|1.685842|0.043695|0.049050|0.045542|0.052336|0.048162|0.066795|0.088309|0.058797|0.051048|0.063521|0.074294|0.050603|0.053250|0.124007|0.215633|0.500000| |1.741496|1.942576|2.220440|2.503519|2.885375|2.859339|2.462183|2.212092|3.220266|0.084902|2.889510|4.045582|2.494645|3.910789|2.412804|3.730395|3.385889|6.838530|3.665232|4.546843|0.111727|4.296463|5.489288|4.812576|5.517678|8.950024|17.754890|8.750282|9.242899|0.189445|3.786535|2.476275|2.342419|2.081936|1.816023|1.657898|1.684388|1.889189|2.133136|0.044806|0.049310|0.046865|0.054943|0.051639|0.067720|0.088254|0.065440|0.055726|0.069198|0.081209|0.060285|0.063765|0.105159|0.123128|0.216778|0.500000| |1.808493|1.983893|2.331580|2.403299|2.817407|3.376228|3.196821|2.624214|4.265592|0.105048|5.553117|9.593670|6.075771|8.413394|5.882438|7.959136|6.836354|9.662757|8.824231|5.429118|0.123192|4.641754|4.004858|3.255665|2.873035|2.906303|3.332271|4.066301|6.486809|0.126393|17.574232|4.298342|4.221562|3.171831|2.758216|2.308341|2.169347|2.352334|2.833615|0.045883|0.049696|0.051379|0.052534|0.054516|0.060127|0.076804|0.097519|0.068708|0.127422|0.173123|0.122749|0.177534|0.084701|0.070183|0.071192|0.087541|0.500000| |1.914568|2.098120|2.510917|2.692996|3.295854|3.919380|3.427436|2.761954|5.498207|0.138461|6.575214|9.242919|4.976823|7.298593|4.307654|5.993227|5.536443|8.583603|8.708742|6.775629|0.137944|6.590472|5.858076|4.553099|3.850409|3.797291|4.344043|5.619368|8.259868|0.144541|17.594587|3.387951|3.201075|2.566578|2.259688|1.953798|1.873827|2.036529|2.389977|0.048165|0.053460|0.053933|0.055925|0.056459|0.067503|0.093133|0.099937|0.070069|0.137383|0.228296|0.096873|0.118770|0.115226|0.090942|0.089327|0.107467|0.302279|0.500000| |1.777127|1.973046|2.313124|2.445850|2.882468|3.308263|3.009349|2.520677|4.128697|0.101559|4.620441|7.581472|4.490197|6.386005|4.484855|7.091074|7.238531|12.418593|8.761082|6.607970|0.140262|5.158796|4.812443|3.725882|3.380942|3.631764|4.479328|5.569311|9.501807|0.193141|17.629542|4.098645|3.998642|3.106319|2.617029|2.235021|2.169005|2.422410|2.932017|0.045236|0.049125|0.049634|0.053214|0.053854|0.062084|0.080809|0.087343|0.064989|0.104133|0.137484|0.099860|0.124127|0.091616|0.080104|0.087539|0.119889|0.301762|0.301371|0.500000| |1.879961|2.165448|2.427228|2.358178|2.518833|2.835516|2.964485|2.710029|2.882155|0.069089|3.117652|5.541958|4.252725|6.184780|5.700625|12.524425|7.518708|13.990871|4.710734|4.087950|0.122943|3.126970|2.747117|2.273761|2.095178|2.210740|2.591082|3.003147|5.150404|0.116968|3.886254|17.672251|8.831114|6.906121|5.030911|3.981209|3.826330|4.482742|6.174977|0.048811|0.049753|0.052424|0.058306|0.062693|0.059642|0.065795|0.087786|0.074565|0.080122|0.079634|0.151768|0.135904|0.059021|0.052074|0.056047|0.072974|0.106571|0.089274|0.109905|0.500000| |1.904308|2.164291|2.409746|2.275915|2.406187|2.766325|3.024323|2.774809|2.782558|0.067175|3.140579|5.589919|4.834297|7.257065|7.359224|12.538017|5.893259|9.156140|4.226094|3.503542|0.104109|2.845392|2.458432|2.078424|1.895898|1.949871|2.218591|2.564571|4.210294|0.090489|3.535343|17.598400|8.803406|6.905595|5.975348|4.405891|3.829271|4.042542|5.150859|0.049473|0.049912|0.054044|0.057131|0.063516|0.057043|0.061842|0.093372|0.078867|0.084058|0.079663|0.233693|0.172255|0.055168|0.047697|0.049582|0.061311|0.102400|0.082908|0.094697|0.302843|0.500000| |1.596885|1.763740|1.962732|1.911780|2.065154|2.358950|2.461247|2.211226|2.519670|0.062564|2.931082|5.061507|4.259243|6.466394|6.279571|9.457706|5.219373|8.307162|4.004797|3.142512|0.086032|2.616525|2.332662|2.000441|1.851654|1.920286|2.177441|2.462548|3.962133|0.085800|3.891672|8.829713|17.540890|8.900081|7.174457|4.735065|3.977295|4.209188|5.654991|0.041576|0.042652|0.045406|0.046868|0.050561|0.048565|0.054603|0.075578|0.061578|0.077361|0.079144|0.161102|0.202758|0.052883|0.046787|0.049240|0.060755|0.122851|0.089423|0.107303|0.173534|0.210737|0.500000| |1.585200|1.767929|1.976173|1.963402|2.138668|2.405508|2.433496|2.182673|2.595892|0.064155|2.914704|5.031637|3.850056|5.678930|5.159854|9.483145|6.264427|11.447768|4.413943|3.549311|0.096017|2.833586|2.576793|2.173895|2.036603|2.168440|2.527056|2.844756|4.719937|0.107454|4.369345|8.892251|17.562715|8.884093|5.681523|4.218275|3.974222|4.713681|7.102126|0.041251|0.042621|0.044507|0.047606|0.050252|0.050227|0.057349|0.072662|0.059594|0.074323|0.079122|0.125631|0.149330|0.056278|0.050909|0.055562|0.072057|0.129901|0.097462|0.130866|0.213276|0.173809|0.302795|0.500000| |1.473618|1.614435|1.742519|1.666489|1.746003|1.946609|2.073379|1.942464|1.997983|0.050466|2.243812|3.651060|3.068818|5.037650|4.037808|5.665151|3.346591|5.624372|2.749715|2.346089|0.066313|2.031788|1.840896|1.622412|1.518499|1.566548|1.740982|1.921183|2.994166|0.064401|2.615570|5.479240|6.989174|8.903675|17.690471|8.934465|5.649397|4.958783|5.652147|0.038932|0.039009|0.041958|0.042985|0.046992|0.042801|0.045954|0.062915|0.055437|0.061158|0.059994|0.120256|0.119058|0.043384|0.038952|0.040747|0.048785|0.078885|0.063715|0.072135|0.127861|0.169925|0.216102|0.144274|0.500000| |1.304756|1.420691|1.499060|1.435294|1.478763|1.606318|1.698478|1.632638|1.623638|0.041575|1.764163|2.765386|2.233023|3.742604|2.706169|3.867383|2.466845|4.340343|2.094157|1.880043|0.053555|1.659378|1.536858|1.378464|1.309689|1.358115|1.495051|1.611812|2.462683|0.053187|2.005826|3.543274|4.088658|5.631323|8.923788|17.719432|8.913851|5.650678|4.960160|0.034921|0.034542|0.036885|0.038248|0.041473|0.037419|0.039195|0.050340|0.046704|0.048200|0.047326|0.079782|0.077025|0.036889|0.033909|0.035786|0.042307|0.058776|0.050143|0.056237|0.093224|0.106348|0.112441|0.097234|0.216046|0.500000| |1.237998|1.355329|1.422149|1.377438|1.414497|1.509749|1.570127|1.519254|1.522565|0.039080|1.614654|2.508989|1.953285|3.231358|2.302885|3.443432|2.308104|4.252037|1.953111|1.807891|0.051655|1.588274|1.496780|1.345824|1.295747|1.363366|1.508082|1.599173|2.437533|0.053524|1.877242|3.131788|3.541637|4.928445|5.643850|8.911224|17.723033|8.907795|5.643636|0.033272|0.032921|0.034587|0.036995|0.039384|0.036289|0.037847|0.045636|0.042961|0.043529|0.043401|0.065915|0.064174|0.035702|0.033557|0.036219|0.043338|0.053708|0.047123|0.053863|0.088721|0.088786|0.090532|0.090477|0.124236|0.214719|0.500000| 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