Version2.0 2020-01-27T03:51:28Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 20-Oct-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCc1ccccc1NC(=O)C[NH+]2CCN(CC2)CC(=O)C3=c4ccccc4=[NH+][C@H]3c5ccccc5 C39726939 RHF 6-31G(d) (6D,7F) CCc1ccccc1NC(=O)C[NH+]2CCN(CC2)CC(=O)C3=c4ccccc4=[NH+][C@H]3c5ccccc5 C01[X(C30H34N4O2)] 204 C1 608 CCc1ccccc1NC(=O)C[NH+]1CCN(CC1)CC(=O)C1=c2ccccc2=[NH+][C@H]1c1ccccc1 CCc1ccccc1NC(=O)C[NH+]1CCN(CC1)CC(=O)C1=c2ccccc2=[NH+][C@H]1c1ccccc1 CCc1ccccc1NC(=O)C[NH+]2CCN(CC2)CC(=O)C3=C4C=CC=CC4=[NH+][C@H]3c5ccccc5 InChIKey=WKUHUKQUVCHWMJ-PMERELPUSA-P InChI=1S/C30H32N4O2/c1-2-22-10-6-8-14-25(22)31-28(36)21-34-18-16-33(17-19-34)20-27(35)29-24-13-7-9-15-26(24)32-30(29)23-11-4-3-5-12-23/h3-15,30H,2,16-21H2,1H3,(H,31,36)/p+2/t30-/m0/s1 InChI=1/C30H32N4O2/c1-2-22-10-6-8-14-25(22)31-28(36)21-34-18-16-33(17-19-34)20-27(35)29-24-13-7-9-15-26(24)32-30(29)23-11-4-3-5-12-23/h3-15,30H,2,16-21H2,1H3,(H,31,36)/p+2/t30-/m0/s1/fC30H34N4O2/h31-32,34H/q+2 CCc1ccccc1NC(=O)C[NH+]2CCN(CC2)CC(=O)C3=c4ccccc4=[NH+][C@H]3c5ccccc5 C01[X(C30H34N4O2)] 204 C01 608 CCc1ccccc1NC(=O)C[NH+]1CCN(CC1)CC(=O)C1=c2ccccc2=[NH+][C@H]1c1ccccc1 CCc1ccccc1NC(=O)C[NH]1CCN(CC1)CC(=O)C1=C2C=CC=C[C@H]2N[C@H]1c1ccccc1 CCc1ccccc1NC(=O)C[NH]2CCN(CC2)CC(=O)C3=C4C=CC=C[C@H]4N[C@H]3c5ccccc5 InChIKey=ALMYSLGZGCYQJX-VIZCGCQYSA-N InChI=1S/C30H35N4O2/c1-2-22-10-6-8-14-25(22)31-28(36)21-34-18-16-33(17-19-34)20-27(35)29-24-13-7-9-15-26(24)32-30(29)23-11-4-3-5-12-23/h3-15,26,30,32,34H,2,16-21H2,1H3,(H,31,36)/t26-,30+/m1/s1 InChI=1/C30H35N4O2/c1-2-22-10-6-8-14-25(22)31-28(36)21-34-18-16-33(17-19-34)20-27(35)29-24-13-7-9-15-26(24)32-30(29)23-11-4-3-5-12-23/h3-15,26,30,32,34H,2,16-21H2,1H3,(H,31,36)/t26-,30+/m1/s1/f/h31H 3560.0525287240 -1522.9049398 1-A 31167.1483 128 480 608 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865.3028 881.3443 904.4774 914.6064 920.1381 947.4630 954.8272 960.5501 970.0950 989.0725 995.6008 1008.2723 1039.7051 1043.7563 1053.1974 1056.3439 1078.5349 1083.6760 1088.4819 1089.3583 1100.1419 1110.1719 1114.8567 1120.5736 1129.5536 1131.9633 1133.8833 1135.7576 1151.1543 1152.9473 1156.0196 1161.1381 1179.2407 1182.0955 1186.1575 1193.9193 1203.0268 1213.2300 1222.5616 1229.4244 1244.3785 1254.3944 1269.8525 1286.8918 1294.2188 1295.5429 1305.9880 1307.0424 1314.0601 1320.8207 1322.2233 1328.5254 1340.0486 1341.2752 1365.9289 1384.4359 1397.6784 1399.5255 1414.2571 1434.2497 1445.4698 1449.4109 1460.6754 1469.6812 1479.0959 1484.8586 1496.3837 1497.9597 1519.0816 1528.4242 1547.6548 1562.4076 1566.2370 1569.7904 1579.6529 1582.2524 1587.6757 1599.6796 1621.1776 1623.3788 1624.1034 1627.8501 1630.9545 1632.0822 1635.1458 1640.9481 1646.5748 1649.5761 1654.8210 1661.5686 1663.7295 1667.5874 1671.0634 1726.9067 1750.6005 1782.9678 1784.1611 1785.8035 1799.8668 1812.1422 1851.2716 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1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 8621.7578 51213.2897 54780.3235 0.99998 -0.00501 -0.00287 0.00504 0.99992 0.01172 0.00281 -0.01174 0.99993 1 0.01005 0.00169 0.00158 0.20932 0.03524 0.03295 11.96 16.13 18.03 40.85 47.36 59.83 69.36 74.62 96.67 98.41 104.44 115.74 134.10 157.16 171.21 187.23 207.83 240.71 294.96 312.85 322.70 337.82 351.07 382.65 400.13 430.40 437.38 469.50 485.50 518.68 526.99 544.84 565.75 618.39 627.26 652.71 662.48 697.02 709.10 724.20 742.27 761.32 766.26 770.00 790.87 837.90 862.93 871.48 889.24 912.42 936.99 952.93 956.20 965.49 973.51 1006.65 1042.83 1105.27 1119.72 1145.95 1175.68 1180.57 1210.52 1218.98 1223.15 1238.27 1240.59 1244.98 1268.06 1301.34 1315.91 1323.87 1363.19 1373.78 1382.02 1395.75 1423.05 1432.45 1450.68 1495.90 1501.73 1515.32 1519.84 1551.77 1559.17 1566.08 1567.34 1582.86 1597.29 1604.03 1612.26 1625.18 1628.64 1631.41 1634.10 1656.25 1658.83 1663.25 1670.62 1696.66 1700.77 1706.62 1717.78 1730.89 1745.57 1758.99 1768.87 1790.38 1804.79 1827.03 1851.55 1862.09 1864.00 1879.03 1880.54 1890.64 1900.37 1902.38 1911.45 1928.03 1929.80 1965.27 1991.89 2010.95 2013.61 2034.80 2063.57 2079.71 2085.38 2101.59 2114.54 2128.09 2136.38 2152.96 2155.23 2185.62 2199.06 2226.73 2247.96 2253.47 2258.58 2272.77 2276.51 2284.31 2301.58 2332.51 2335.68 2336.72 2342.11 2346.58 2348.20 2352.61 2360.96 2369.05 2373.37 2380.92 2390.63 2393.74 2399.29 2404.29 2484.63 2518.72 2565.29 2567.01 2569.37 2589.61 2607.27 2663.57 2785.41 2899.56 4523.28 4532.74 4557.28 4597.50 4625.97 4636.00 4665.07 4677.97 4705.46 4705.77 4714.48 4728.06 4732.73 4737.82 4794.56 4796.65 4806.87 4829.31 4830.47 4837.52 4847.97 4865.29 4871.69 4880.44 4885.95 4886.40 4898.00 4902.13 4907.81 4915.30 4960.11 5135.20 5524.55 5533.50 0.641746 0.671988 0.672932 0.573986 -1522.263194 -1522.232952 -1522.232008 -1522.330954 3.318665D-04 MUNgauss RevisionA2.0 retrievium 27-Jan-2020 DUDE CCc1ccccc1NC(=O)C[NH+]2CCN(CC2)CC(=O)C3=c4ccccc4=[NH+][C@H]3c5ccccc5 C39726939 RHF 6-31G(d) (6D,10F) C1 482.268177 |X|Y|Z| 161.449895 59.139833 40.042830 72.579540 32 6 7 28 4 |36.858105| |12.410815|36.858105| |7.478020|12.571359|36.858105| |5.622005|7.566658|13.689031|36.858105| |4.134694|5.010598|7.866804|13.775959|36.858105| |3.724689|4.408498|6.788468|7.941819|13.747969|36.858105| |4.137461|4.974451|7.851928|6.906469|7.972158|13.793231|36.858105| |5.632278|7.462225|13.691416|8.018348|6.919957|7.955329|13.747572|36.858105| |5.405985|6.525439|7.792062|5.148663|4.543527|5.144937|7.830379|13.227398|53.358707| |4.077006|4.873115|5.430216|4.050031|3.755606|4.319944|6.161799|7.769831|19.537422|36.858105| |3.435944|4.200888|4.836445|3.864527|3.732838|4.383197|6.018184|6.603821|11.429235|15.816917|73.516695| |3.598708|3.946687|4.000211|3.144283|2.920335|3.251374|4.232566|5.002024|10.688593|12.391197|14.432893|36.858105| |2.905220|3.231565|3.271643|2.699582|2.556119|2.829023|3.511582|3.906537|7.117865|7.839904|13.245991|12.794633|53.358707| |2.795645|3.178487|3.346530|2.797518|2.702927|3.054572|3.820096|4.093838|7.164717|8.291668|17.234061|9.594933|25.501982|0.500000| |2.866182|3.248642|3.141721|2.610397|2.420273|2.587326|3.098974|3.527936|6.074865|6.012421|10.637441|7.658649|17.268593|0.260507|36.858105| |2.351454|2.639611|2.594821|2.244224|2.125337|2.268766|2.630881|2.864963|4.613882|4.314308|8.247849|4.992345|10.481507|0.199113|12.545600|36.858105| |2.114175|2.299133|2.267478|1.983724|1.898231|2.035725|2.344921|2.509706|4.035094|3.663059|6.753759|4.465669|9.065770|0.165172|7.834688|13.115073|53.358707| |2.117803|2.282881|2.305054|2.015550|1.956077|2.140293|2.497735|2.621747|4.267522|3.946655|7.265594|4.972529|10.473420|0.196177|6.649264|7.972278|17.884960|36.858105| |2.461991|2.631304|2.654220|2.261802|2.174596|2.399567|2.886372|3.094535|5.333397|5.111951|8.723591|7.610666|17.339904|0.255317|7.722160|6.651081|10.650013|12.516187|36.858105| |1.836410|1.986404|1.962832|1.753733|1.691331|1.800642|2.028190|2.136945|3.321106|2.905068|5.424707|3.343926|6.082184|0.118485|5.092328|7.843357|17.971367|7.864348|5.090768|36.858105| |1.770866|1.903976|1.845292|1.656071|1.581562|1.656724|1.844544|1.964858|3.021418|2.568537|4.709054|2.918389|4.984389|0.095337|4.403380|6.140017|10.536778|5.104600|3.952518|12.516397|36.858105| |1.889289|2.028163|1.930589|1.719780|1.622625|1.684877|1.879432|2.034356|3.147833|2.654367|4.779942|3.039640|5.085743|0.094672|4.749140|6.191626|9.457873|4.613384|3.888431|7.971155|16.043464|73.516695| |1.556684|1.662406|1.617940|1.474036|1.417262|1.478285|1.622216|1.708274|2.575849|2.144881|3.943295|2.376578|3.893342|0.076237|3.276543|4.220002|6.737112|3.835512|3.077059|7.330938|12.611417|14.551957|36.858105| |1.468237|1.552052|1.498526|1.371321|1.314578|1.361181|1.483968|1.566520|2.348748|1.922007|3.488128|2.123609|3.370004|0.065517|2.809970|3.397919|5.251179|3.136055|2.648486|4.994375|7.531241|11.702474|14.163438|36.858105| |1.487438|1.557065|1.484865|1.355322|1.289753|1.326915|1.446240|1.540034|2.315155|1.872600|3.344331|2.083673|3.235542|0.061922|2.710658|3.127453|4.747016|2.868638|2.528357|4.120507|5.931478|11.077172|7.406414|13.119718|36.858105| |1.365741|1.419984|1.354001|1.245383|1.187281|1.216406|1.315657|1.395667|2.078316|1.660035|2.957754|1.827002|2.779299|0.053571|2.285312|2.566543|3.818625|2.399953|2.159133|3.218849|4.207772|7.742974|5.147666|7.962305|14.250423|36.858105| |1.252117|1.304098|1.254024|1.162532|1.115669|1.144183|1.229954|1.293271|1.908585|1.521245|2.731964|1.653989|2.510783|0.049061|2.033572|2.294328|3.394980|2.180361|1.948454|2.900701|3.617274|6.309998|4.652414|6.852656|7.816739|13.073251|36.858105| |1.234834|1.294110|1.254794|1.166020|1.125057|1.158607|1.244544|1.300327|1.914068|1.535055|2.783918|1.660073|2.546249|0.050261|2.052305|2.361748|3.511103|2.260267|1.980677|3.096410|3.808653|6.301224|5.285019|7.583155|6.557227|7.687626|14.096571|36.858105| |1.327664|1.401624|1.363499|1.260571|1.216890|1.259468|1.361008|1.422512|2.106697|1.710464|3.123538|1.859214|2.910491|0.057523|2.367963|2.816244|4.260739|2.674778|2.277053|3.968297|5.104513|7.916264|8.419645|13.022408|7.584726|6.820858|8.091797|13.427719|36.858105| |1.317870|1.400004|1.375245|1.275101|1.238780|1.288619|1.391303|1.442890|2.129278|1.739997|3.216146|1.876135|2.966775|0.059501|2.390116|2.899818|4.387165|2.786908|2.321703|4.224869|5.055587|7.388268|8.308851|8.442155|5.286062|4.673276|5.280622|7.741363|14.627588|53.358707| |1.242648|1.319272|1.301732|1.214420|1.185003|1.232306|1.323028|1.363944|1.997770|1.624092|3.010871|1.734207|2.716204|0.054935|2.161035|2.582953|3.847197|2.509852|2.114794|3.585819|4.052106|6.100626|5.842781|5.910011|4.225643|3.958163|4.655940|6.830408|9.314194|25.945169|0.500000| |1.440372|1.542972|1.522019|1.401464|1.361860|1.425816|1.552366|1.611178|2.397058|1.991213|3.716523|2.159633|3.513192|0.070756|2.858078|3.647342|5.651382|3.467686|2.763968|6.015390|7.092721|9.175726|12.596080|8.130685|5.034367|4.088414|4.136592|5.165095|8.289545|17.761814|0.244080|36.858105| |1.423778|1.519766|1.510079|1.390205|1.358301|1.432041|1.563442|1.611865|2.405209|2.005419|3.744844|2.189101|3.578708|0.072374|2.825451|3.580310|5.792306|3.719359|2.892042|6.259360|6.321231|8.160523|8.945438|6.329117|4.339767|3.613240|3.655460|4.453356|6.440977|12.538800|0.206032|17.523550|0.500000| |1.457211|1.580844|1.570050|1.453762|1.417811|1.483585|1.606786|1.659235|2.441239|2.033637|3.868833|2.151554|3.504101|0.072249|2.874362|3.720478|5.340515|3.299933|2.659289|5.351151|5.749443|8.013073|7.377617|5.412984|3.894856|3.294624|3.338494|4.015209|5.524103|10.436515|0.188420|12.524657|0.247231|36.858105| |1.422258|1.547115|1.558286|1.451494|1.430762|1.508789|1.629218|1.659519|2.424274|2.025155|3.906015|2.115086|3.442315|0.072601|2.732862|3.488274|4.978827|3.260930|2.615250|4.767051|4.497269|6.457274|5.114780|3.997463|3.088188|2.692847|2.746234|3.239295|4.131818|7.479519|0.150133|7.584561|0.205682|13.728655|36.858105| |1.408998|1.545160|1.567117|1.472696|1.459252|1.535835|1.643300|1.662268|2.393515|1.989194|3.886483|2.027421|3.253677|0.069771|2.577277|3.209417|4.337630|2.894604|2.400533|3.842591|3.627917|5.518989|3.892765|3.217156|2.618008|2.330362|2.373111|2.732528|3.304765|5.579650|0.115092|5.021991|0.133702|7.919259|13.727002|36.858105| |1.429070|1.576629|1.588224|1.497277|1.474866|1.536306|1.634106|1.664706|2.379589|1.962716|3.831188|1.978318|3.137740|0.066971|2.545539|3.130816|4.060275|2.649889|2.258605|3.485404|3.465318|5.483487|3.679847|3.128886|2.599778|2.327834|2.359661|2.680229|3.183441|5.154805|0.105221|4.434809|0.111194|6.864750|7.940857|13.769849|36.858105| |1.464457|1.612301|1.600586|1.499701|1.460610|1.509592|1.611295|1.664254|2.395321|1.970128|3.795488|2.007681|3.183593|0.066679|2.658237|3.294728|4.248084|2.669783|2.286147|3.693880|3.949400|6.343111|4.302804|3.683474|3.028599|2.684536|2.704577|3.072651|3.704522|5.878183|0.116152|5.009288|0.116521|7.928270|6.872719|7.930527|13.712744|36.858105| |1.479329|1.614541|1.591207|1.477410|1.432123|1.483922|1.597984|1.661453|2.425928|2.004775|3.813272|2.092188|3.358494|0.069116|2.828990|3.596663|4.840723|2.947012|2.468067|4.485593|5.150081|7.895094|6.157092|5.011882|3.830983|3.284566|3.298530|3.850344|4.998270|8.228899|0.152211|7.514794|0.155150|13.678763|7.921913|6.862529|7.932815|13.783382|36.858105| |17.516446|8.699394|6.719103|4.955091|3.907716|3.726462|4.326592|5.900812|8.422684|4.478684|6.430825|4.050629|4.266200|0.082813|2.994198|2.423523|3.004039|2.245773|2.670133|1.897990|1.813675|3.428764|1.586926|1.493440|1.512498|1.385260|1.267945|1.250669|1.347241|1.820654|0.034985|1.465717|0.040476|1.473013|1.440217|1.418068|1.426738|1.458482|1.482520|0.500000| |17.580328|8.771985|6.792151|5.919802|4.356951|3.768473|3.966075|5.040509|6.141811|3.487312|5.394782|3.073263|3.458833|0.068859|2.488263|2.093428|2.586938|1.914027|2.195476|1.672418|1.613090|3.037059|1.433389|1.356445|1.371706|1.267552|1.169234|1.154682|1.236146|1.673233|0.032342|1.336647|0.036758|1.354799|1.328363|1.321304|1.339903|1.366979|1.374791|0.302965|0.500000| |17.562841|8.776865|5.470111|4.419082|3.403693|3.095322|3.393205|4.398695|6.056867|3.600393|5.472993|3.337888|3.757467|0.072744|2.797095|2.307549|2.834049|2.055880|2.370010|1.817705|1.777532|3.405340|1.564802|1.486706|1.519884|1.399006|1.276636|1.251495|1.340410|1.799187|0.034559|1.437984|0.039306|1.448515|1.402739|1.384966|1.410148|1.456615|1.477298|0.301569|0.301542|0.500000| |8.821417|17.540562|8.874951|5.697523|4.216295|3.951870|4.657427|6.967783|9.873684|5.717942|8.523803|4.662852|5.146988|0.101456|3.916298|3.063543|3.555449|2.559193|2.979572|2.219681|2.129208|4.073475|1.831949|1.701486|1.708679|1.544879|1.408829|1.396589|1.521576|2.064648|0.039482|1.683560|0.045919|1.722992|1.675077|1.664763|1.700722|1.750859|1.762855|0.208068|0.172828|0.212811|0.500000| |8.879977|17.578402|8.964466|7.266541|4.779016|3.994092|4.210881|5.646208|6.640443|3.980407|6.445403|3.316756|3.877632|0.078402|2.940672|2.460414|2.911039|2.095793|2.357797|1.877663|1.820434|3.452816|1.604037|1.504776|1.511396|1.385083|1.275686|1.265152|1.365003|1.854235|0.035748|1.493482|0.040641|1.538732|1.503093|1.510644|1.555008|1.594550|1.585764|0.172650|0.211733|0.213714|0.305209|0.500000| |5.527764|7.068625|8.937873|17.715774|8.949693|5.654014|4.969265|5.681749|5.673265|3.410569|5.805632|2.769285|3.294521|0.068925|2.390472|2.079432|2.510410|1.852885|2.056207|1.646598|1.573390|2.917386|1.409542|1.320009|1.310617|1.210120|1.130332|1.130468|1.216203|1.668788|0.032478|1.339163|0.036748|1.388992|1.380857|1.402983|1.435117|1.444224|1.420231|0.127694|0.171068|0.125631|0.145647|0.220863|0.500000| |3.531485|4.097795|5.621530|8.937658|17.730282|8.912582|5.660482|4.977394|4.922773|3.108870|5.560574|2.509597|3.054329|0.065762|2.145241|1.918930|2.350775|1.773273|1.943805|1.558076|1.464843|2.665039|1.324846|1.233969|1.210523|1.120081|1.057153|1.066719|1.149135|1.593209|0.031220|1.279694|0.035428|1.334837|1.349764|1.382633|1.400696|1.383976|1.351116|0.092061|0.105721|0.083397|0.097389|0.113619|0.216396|0.500000| |3.096232|3.530911|4.909470|5.644671|8.895960|17.736942|8.936072|5.655065|5.682436|3.712982|6.866708|2.907654|3.533338|0.078440|2.362501|2.116864|2.616739|2.036334|2.252035|1.718904|1.575822|2.826021|1.417286|1.305047|1.266896|1.164819|1.101569|1.119256|1.215266|1.699245|0.033297|1.378505|0.038606|1.436995|1.472655|1.504680|1.498295|1.460652|1.431342|0.086734|0.087590|0.073452|0.090053|0.090885|0.124246|0.214200|0.500000| |3.537596|4.066040|5.616524|4.971111|5.657504|8.921215|17.738543|8.929397|9.843507|6.455472|11.596777|4.508312|5.134496|0.116794|3.185851|2.727438|3.354207|2.693538|3.136923|2.122004|1.899246|3.405668|1.667663|1.516939|1.469787|1.333752|1.249170|1.268717|1.392457|1.946260|0.037781|1.602958|0.045191|1.655415|1.691007|1.699650|1.671728|1.637087|1.629274|0.105444|0.093467|0.083105|0.110537|0.096918|0.107829|0.124233|0.215031|0.500000| |6.200896|6.547937|6.828051|4.653957|4.031168|4.378502|6.056190|9.107964|26.008558|9.516230|10.837906|7.576377|6.600507|0.128048|4.185583|3.174959|3.876773|3.005150|3.813239|2.348694|2.161634|4.036922|1.846321|1.698800|1.691946|1.523546|1.392928|1.387993|1.519888|2.075588|0.039688|1.705348|0.047538|1.717306|1.693471|1.659356|1.648314|1.670055|1.704652|0.221126|0.138360|0.140965|0.200016|0.132999|0.108900|0.091501|0.101190|0.157802|0.500000| |3.337689|3.502241|3.631305|2.932455|2.786378|3.153174|4.087217|4.579354|9.236506|8.837075|11.440071|17.607188|12.329721|0.210971|5.641119|4.178873|5.475177|4.757457|7.497104|3.101198|2.689195|4.899800|2.230800|2.006680|1.969373|1.740591|1.584535|1.591298|1.772754|2.437901|0.046200|2.046877|0.058314|2.019990|2.002425|1.912099|1.846467|1.859824|1.942102|0.106817|0.081025|0.085555|0.109464|0.082253|0.071755|0.067005|0.079711|0.125601|0.193326|0.500000| |3.942059|4.197152|3.961925|3.082965|2.782663|2.992132|3.773682|4.636219|9.608718|8.653282|10.758758|17.630792|12.281239|0.185638|7.406347|4.717460|5.770965|4.422505|6.380637|3.213957|2.915501|5.560642|2.368924|2.147059|2.146317|1.883145|1.686688|1.674539|1.863864|2.526471|0.047482|2.116403|0.059016|2.088877|2.020923|1.929269|1.900695|1.956574|2.051874|0.124464|0.090971|0.104426|0.142425|0.097370|0.076902|0.066843|0.073853|0.106871|0.214192|0.300882|0.500000| |2.914148|3.201862|2.987135|2.479365|2.270913|2.391337|2.833345|3.269813|5.643387|5.166870|8.490624|6.992985|12.379785|0.182051|17.631434|8.857893|9.634467|5.847754|7.020328|4.789969|4.440548|9.041446|3.287585|2.890424|2.876909|2.415591|2.109754|2.094638|2.396407|3.222299|0.059107|2.783215|0.075964|2.722910|2.537979|2.366679|2.347702|2.491356|2.692602|0.085065|0.069697|0.080767|0.107761|0.080528|0.063860|0.056194|0.060574|0.079975|0.113695|0.149237|0.221349|0.500000| |3.166429|3.758817|3.612189|2.952460|2.693535|2.850473|3.425830|4.010146|6.820575|6.763564|12.386280|7.167548|12.380938|0.228993|17.649760|8.828662|7.682189|4.981445|5.634225|4.172950|3.767085|7.252380|2.930452|2.553121|2.472491|2.118109|1.900907|1.917623|2.188853|3.012684|0.056145|2.608457|0.070854|2.690403|2.575590|2.494109|2.514465|2.620653|2.715150|0.090028|0.075600|0.085250|0.129989|0.094684|0.074825|0.065721|0.071190|0.095410|0.125810|0.143191|0.194442|0.298525|0.500000| |2.280648|2.561307|2.467766|2.153565|2.021785|2.119695|2.414285|2.647506|4.164735|3.722068|7.009926|4.153815|7.648981|0.145849|9.036746|17.655392|12.442727|5.725426|4.970328|7.269846|6.941286|13.677369|4.649295|3.748745|3.468594|2.803963|2.476355|2.535525|3.039934|4.199992|0.075545|3.868381|0.100990|3.991230|3.570912|3.291719|3.324433|3.655112|4.047212|0.064367|0.056471|0.063040|0.082692|0.067481|0.056182|0.051080|0.054872|0.068304|0.080433|0.097635|0.114511|0.217254|0.213684|0.500000| |2.273908|2.589818|2.614578|2.289315|2.200587|2.372965|2.740082|2.915350|4.576765|4.323563|8.889622|4.627200|9.385378|0.209911|8.852796|17.426746|12.236355|7.117098|5.803892|6.815701|5.169432|8.722192|3.866341|3.105435|2.799552|2.343924|2.145123|2.241493|2.667733|3.837491|0.070910|3.564626|0.098116|3.830065|3.759770|3.566523|3.452610|3.506013|3.687486|0.064726|0.056788|0.061235|0.082341|0.067418|0.058580|0.055275|0.061967|0.079577|0.085273|0.109449|0.116065|0.173456|0.215520|0.301423|0.500000| |1.941987|2.057340|2.071517|1.831183|1.784479|1.945143|2.241538|2.333235|3.742578|3.326985|6.005376|4.136163|7.645009|0.143778|4.971276|5.720479|12.448389|17.601682|9.016724|7.286001|4.916722|7.710144|3.867543|3.204999|2.929118|2.461862|2.244807|2.330077|2.751779|3.893097|0.071539|3.517121|0.108230|3.211251|3.174033|2.760321|2.493024|2.510045|2.806868|0.057341|0.049144|0.052624|0.063260|0.052703|0.047050|0.045278|0.051798|0.067110|0.074461|0.115178|0.105376|0.131061|0.109311|0.127562|0.144145|0.500000| |2.049765|2.234625|2.304235|2.036056|2.004410|2.218393|2.580823|2.645970|4.217130|3.930028|7.627859|4.600664|9.343032|0.205347|5.772692|7.080868|12.208475|17.426349|8.851631|6.823908|4.476533|7.051871|3.551061|2.892945|2.600986|2.209354|2.047108|2.150583|2.541504|3.690092|0.068874|3.389228|0.102053|3.356992|3.467123|3.130821|2.813159|2.752375|2.970748|0.060052|0.051876|0.054751|0.068888|0.057206|0.051732|0.050565|0.059192|0.078339|0.080690|0.123164|0.109805|0.133746|0.129990|0.143843|0.210524|0.301794|0.500000| |2.402487|2.539168|2.619869|2.250240|2.197150|2.465319|2.982204|3.112464|5.324465|4.999674|8.497047|7.068974|12.372482|0.222352|5.623733|4.982319|7.679712|8.824664|17.624593|4.176231|3.309117|5.713905|2.699028|2.356884|2.249169|1.955523|1.787908|1.822508|2.072104|2.892450|0.054439|2.492206|0.073261|2.409150|2.416332|2.239839|2.092544|2.087280|2.226904|0.073163|0.060168|0.063485|0.078208|0.062901|0.056437|0.054563|0.064916|0.092426|0.105884|0.228406|0.157006|0.143284|0.126903|0.109308|0.130648|0.213500|0.216280|0.500000| |2.487994|2.599683|2.554612|2.171690|2.062388|2.240040|2.668022|2.913299|5.031521|4.557808|7.406037|6.971948|12.403915|0.180211|7.000462|5.821625|9.574402|8.832285|17.628684|4.771745|3.959619|7.183003|3.075397|2.706856|2.652756|2.261705|2.010476|2.014218|2.296604|3.124703|0.057768|2.689133|0.077517|2.530260|2.437361|2.222200|2.110451|2.169335|2.366921|0.075437|0.061303|0.067527|0.082034|0.064708|0.055377|0.051382|0.058139|0.079042|0.103978|0.193554|0.186790|0.209982|0.143295|0.130390|0.133809|0.217258|0.173348|0.299663|0.500000| |1.773681|1.938028|1.937367|1.747353|1.698690|1.812590|2.026582|2.109446|3.222852|2.819519|5.417529|3.118040|5.601951|0.115104|4.619516|7.167820|12.194208|6.580795|4.442415|17.448091|8.912072|10.985536|6.696906|4.558162|3.660126|2.950192|2.746727|3.004213|3.862732|5.919939|0.104753|6.503503|0.188236|6.581502|6.174794|4.841317|4.228999|4.351295|5.235235|0.050593|0.045127|0.048500|0.059779|0.051202|0.045547|0.043621|0.048339|0.058986|0.062482|0.080253|0.081851|0.115425|0.110633|0.186980|0.203998|0.164579|0.185627|0.105493|0.111436|0.500000| |1.723580|1.840384|1.827252|1.641687|1.593200|1.701951|1.910833|1.994577|3.090824|2.669530|4.928144|3.093957|5.450185|0.106166|4.234051|5.703162|12.537605|7.580307|4.871041|17.540554|9.018702|11.041086|6.836414|4.897146|4.028052|3.203444|2.926631|3.146847|4.014888|5.857821|0.102048|5.966144|0.192957|4.891844|4.521448|3.572690|3.152919|3.269629|3.944268|0.049776|0.043860|0.047343|0.056531|0.048229|0.042829|0.040910|0.045419|0.055899|0.061224|0.082240|0.082394|0.113418|0.097712|0.144579|0.143892|0.236296|0.182133|0.115723|0.128967|0.303266|0.500000| |1.605072|1.676862|1.585516|1.435880|1.357632|1.395140|1.529439|1.643406|2.493521|2.019528|3.572163|2.276781|3.534330|0.066555|3.012652|3.424650|5.195216|3.076040|2.755884|4.315758|6.317783|13.443523|6.545404|8.703399|17.792192|9.017979|5.561109|4.791469|5.471276|5.834654|0.098014|4.397135|0.108418|3.562963|2.889907|2.487855|2.481613|2.869766|3.540963|0.045423|0.040859|0.045761|0.051488|0.045060|0.038544|0.035250|0.036810|0.043082|0.050874|0.059386|0.066002|0.091163|0.075602|0.106650|0.082777|0.086461|0.075866|0.067154|0.081830|0.102969|0.114638|0.500000| |1.357980|1.402080|1.328718|1.222409|1.161453|1.185212|1.279971|1.362596|2.027496|1.605870|2.838725|1.768041|2.650744|0.050852|2.172881|2.381373|3.503060|2.228660|2.049032|2.853069|3.612515|6.869913|4.106939|5.628396|9.075517|17.754542|8.754575|5.584495|4.931102|5.035562|0.090099|3.344681|0.084117|2.802908|2.351112|2.074408|2.084289|2.379875|2.825484|0.038236|0.035032|0.038847|0.042298|0.038044|0.033102|0.030462|0.031475|0.035923|0.041525|0.046873|0.051053|0.064492|0.056247|0.072004|0.060231|0.063375|0.056832|0.051747|0.060183|0.072480|0.078714|0.215307|0.500000| |1.183694|1.227293|1.179379|1.097808|1.054161|1.078079|1.153972|1.211656|1.779496|1.407806|2.521375|1.523003|2.284987|0.044730|1.835809|2.038045|2.985667|1.948708|1.765960|2.495426|3.010850|5.313503|3.685362|4.943550|5.641391|8.768157|17.724470|9.101836|5.706652|5.729169|0.108655|3.386834|0.085232|2.846706|2.410049|2.124509|2.121887|2.402059|2.838586|0.033253|0.030815|0.033580|0.036654|0.033433|0.029738|0.027828|0.028870|0.032495|0.036161|0.040682|0.043211|0.052935|0.048012|0.060704|0.053229|0.055715|0.051063|0.045376|0.050668|0.066069|0.070068|0.123735|0.215721|0.500000| |1.159766|1.214689|1.182815|1.105127|1.070484|1.102168|1.178294|1.224666|1.791401|1.431057|2.602500|1.535372|2.340133|0.046528|1.866207|2.131868|3.142018|2.060733|1.814892|2.739141|3.227842|5.324230|4.290586|5.458768|4.788883|5.505748|8.948891|17.755621|8.748537|9.249792|0.192992|4.523034|0.111912|3.705423|3.098597|2.653790|2.595596|2.922374|3.548572|0.032593|0.030251|0.032586|0.036227|0.033053|0.029795|0.028288|0.029680|0.033379|0.036035|0.041048|0.042839|0.052527|0.048778|0.062981|0.056960|0.059028|0.055125|0.046843|0.050949|0.075198|0.077727|0.104814|0.123051|0.216483|0.500000| |1.389860|1.502565|1.520752|1.416276|1.402520|1.488045|1.610358|1.630602|2.389606|1.997754|3.839417|2.102983|3.423369|0.072256|2.645287|3.330057|4.945683|3.371933|2.666176|4.746844|4.244966|6.042856|4.781129|3.781811|2.948976|2.588020|2.648007|3.120323|3.935220|7.111271|0.144971|7.037364|0.228433|8.887079|17.695842|8.926404|5.651542|4.950270|5.629751|0.039315|0.036120|0.037977|0.045041|0.040345|0.037313|0.036744|0.040507|0.046771|0.046482|0.055991|0.055482|0.068384|0.068442|0.091757|0.099197|0.093618|0.100731|0.069302|0.068754|0.167284|0.133452|0.076772|0.063003|0.064876|0.083535|0.500000| |1.368714|1.500020|1.535933|1.452126|1.451423|1.535275|1.635162|1.635837|2.339188|1.938740|3.808569|1.958210|3.115591|0.067563|2.410314|2.931749|3.970221|2.746638|2.301419|3.406176|3.127233|4.824383|3.284207|2.773968|2.310244|2.081297|2.122526|2.419031|2.853709|4.717777|0.098733|4.099838|0.114545|5.641260|8.919076|17.734805|8.915326|5.640556|4.947953|0.038314|0.035809|0.037194|0.044604|0.040697|0.038343|0.038314|0.042082|0.047207|0.044918|0.051714|0.051362|0.061214|0.065079|0.081569|0.091487|0.073085|0.084048|0.060603|0.058765|0.116821|0.090005|0.061404|0.052017|0.053411|0.065951|0.215872|0.500000| |1.402214|1.552708|1.572227|1.495251|1.479525|1.536566|1.619617|1.640429|2.316783|1.896231|3.718594|1.881719|2.940976|0.063230|2.365149|2.827696|3.608892|2.400524|2.090824|2.986183|2.945701|4.782291|3.060958|2.673998|2.287619|2.077650|2.104900|2.354438|2.716287|4.272693|0.088019|3.547692|0.091045|4.949011|5.647704|8.926069|17.733864|8.909253|5.647529|0.038718|0.036683|0.038347|0.046245|0.042770|0.039905|0.039226|0.041774|0.045866|0.044426|0.048830|0.050145|0.060472|0.065938|0.082743|0.087191|0.062555|0.071138|0.054301|0.054213|0.098152|0.075647|0.061180|0.052368|0.053301|0.063897|0.124294|0.214912|0.500000| |1.463109|1.614644|1.593672|1.499525|1.454282|1.490108|1.580854|1.639678|2.342753|1.908183|3.661342|1.927225|3.008932|0.062798|2.531524|3.049978|3.849925|2.427121|2.130106|3.225685|3.508278|5.890511|3.738732|3.344435|2.862547|2.578006|2.585097|2.870583|3.337851|5.040873|0.099837|4.084470|0.096317|5.643120|4.953154|5.644222|8.902361|17.733887|8.939885|0.040211|0.037988|0.040572|0.048636|0.044716|0.040358|0.038393|0.039953|0.044259|0.045418|0.049404|0.052570|0.066410|0.070511|0.095289|0.089194|0.063183|0.068919|0.054094|0.056562|0.101716|0.079431|0.076023|0.064364|0.064569|0.076054|0.107500|0.124071|0.214848|0.500000| 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