Version2.2 2021-02-06T16:52:13Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 19-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE C[C@@H](CNC(=O)[C@@H]1CN(CC12CC[NH2+]CC2)C(=O)c3cccn3C)Oc4ccc(cc4)F C39596126 RHF 6-31G(d) (6D,7F) C[C@@H](CNC(=O)[C@@H]1CN(CC12CC[NH2+]CC2)C(=O)c3cccn3C)Oc4ccc(cc4)F C01[X(C24H32F1N4O3)] 186 C1 544 C[C@H](Oc1ccc(cc1)F)CNC(=O)[C@@H]1CN(CC21CC[NH2+]CC2)C(=O)c1cccn1C C[C@H](Oc1ccc(cc1)F)CNC(=O)[C@@H]1CN(CC21CC[NH2+]CC2)C(=O)c1cccn1C C[C@@H](CNC(=O)[C@@H]1CN(CC12CC[NH2+]CC2)C(=O)c3cccn3C)Oc4ccc(F)cc4 InChIKey=XCEMNMWEHXGRTF-PXNSSMCTSA-O InChI=1S/C24H31FN4O3/c1-17(32-19-7-5-18(25)6-8-19)14-27-22(30)20-15-29(16-24(20)9-11-26-12-10-24)23(31)21-4-3-13-28(21)2/h3-8,13,17,20,26H,9-12,14-16H2,1-2H3,(H,27,30)/p+1/t17-,20-/m0/s1 InChI=1/C24H31FN4O3/c1-17(32-19-7-5-18(25)6-8-19)14-27-22(30)20-15-29(16-24(20)9-11-26-12-10-24)23(31)21-4-3-13-28(21)2/h3-8,13,17,20,26H,9-12,14-16H2,1-2H3,(H,27,30)/p+1/t17-,20-/m0/s1/fC24H32FN4O3/h26-27H/q+1 C[C@@H](CNC(=O)[C@@H]1CN(CC12CC[NH2+]CC2)C(=O)c3cccn3C)Oc4ccc(cc4)F C01[X(C24H32F1N4O3)] 186 C01 544 C[C@H](Oc1ccc(cc1)F)CNC(=O)[C@@H]1CN(CC21CC[NH2+]CC2)C(=O)c1cccn1C C[C@H](O[C]1[CH][CH][C]([CH][CH]1)F)C[NH][C](=O)[C@@H]1CN(CC21CC[NH2]CC2)C(=O)[C]1[CH][CH][CH][N]1C C[C@@H](CNC(=O)[C@@H]1CN(CC12CC[NH2]CC2)C(=O)[C]3[CH][CH][CH]N3C)O[C]4[CH][CH][C](F)[CH][CH]4 InChIKey=UGYDFFCNULTEEO-PXNSSMCTSA-N InChI=1S/C24H32FN4O3/c1-17(32-19-7-5-18(25)6-8-19)14-27-22(30)20-15-29(16-24(20)9-11-26-12-10-24)23(31)21-4-3-13-28(21)2/h3-8,13,17,20H,9-12,14-16,26H2,1-2H3,(H,27,30)/t17-,20-/m0/s1 InChI=1/C24H32FN4O3/c1-17(32-19-7-5-18(25)6-8-19)14-27-22(30)20-15-29(16-24(20)9-11-26-12-10-24)23(31)21-4-3-13-28(21)2/h3-8,13,17,20H,9-12,14-16,26H2,1-2H3,(H,27,30)/t17-,20-/m0/s1/f/h27H 3267.5772727807 -1469.1085513 1-A 19179.9974 118 426 544 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3.7531 7.0830 3.4228 0.0812 0.5292 4.8760 13.6249 18.7585 7.8354 5.3744 5.4971 27.7737 1.5668 64.7888 9.1828 1.4335 3.2816 0.3146 35.2845 13.5539 8.8588 9.1379 22.0977 10.2958 78.2198 22.0050 14.7459 22.0626 11.3473 4.9249 0.5068 17.3653 9.4325 1.4094 29.5477 7.7272 54.8690 3.4668 3.3122 7.7339 22.4564 11.3515 13.8754 1.3630 12.4104 0.2055 42.0721 13.2277 5.7939 6.6954 0.9010 7.1072 10.6836 49.6923 15.3143 10.5136 10.1170 23.6413 0.7374 4.5807 16.6887 81.4219 1.6779 23.0212 24.4477 4.2596 20.7044 10.0734 11.3799 14.6044 2.0730 57.6743 291.5412 72.8972 26.2675 89.0084 5.7774 45.7081 152.2403 15.7370 12.5553 10.2380 12.2063 13.9399 3.3195 93.8164 1.3304 37.4143 34.6283 72.4478 359.2135 2.2849 98.7922 16.5818 102.4926 63.2643 53.7237 42.8137 14.1676 68.5216 19.2528 7.6753 7.8933 0.3716 3.9174 3.8575 16.7340 15.8201 36.1604 23.2418 16.3626 2.5379 3.3788 454.5429 444.9264 69.8966 0.0503 4.3276 117.8901 250.5667 487.4399 5.5404 9.7663 27.9137 6.2352 21.6161 45.4023 11.5558 32.0468 9.7079 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0.1509 0.6418 0.8569 0.7896 0.8425 0.8001 0.6103 0.8571 0.7905 0.8368 0.6579 0.8543 0.3743 0.3033 0.8561 0.8400 0.2041 0.1972 0.7045 0.2368 298.150 1.00000 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 6 6 1 6 7 6 8 6 1 6 7 6 6 6 6 7 1 1 6 6 6 8 6 6 6 6 7 6 8 6 6 6 6 6 6 9 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 1.00783 12.00000 14.00307 12.00000 15.99491 12.00000 1.00783 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 14.00307 1.00783 1.00783 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 18.99840 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 12491.1924 24297.4484 33192.8694 0.99995 -0.00007 -0.00986 0.00009 1.00000 0.00159 0.00986 -0.00160 0.99995 1 0.00693 0.00356 0.00261 0.14448 0.07428 0.05437 8.43 20.84 36.69 40.96 55.68 61.80 75.19 98.90 102.04 115.79 135.20 146.19 203.64 217.71 242.52 257.97 283.44 293.47 309.28 329.39 346.31 353.65 360.33 369.64 380.01 403.32 424.05 501.73 528.41 537.71 550.28 582.37 622.04 630.68 649.93 676.59 686.02 694.27 705.53 726.97 744.52 775.26 798.97 815.11 879.90 899.97 927.17 965.74 983.00 996.68 1009.30 1031.88 1101.36 1114.64 1149.57 1188.36 1205.78 1216.33 1225.60 1242.82 1256.43 1264.94 1313.62 1333.98 1356.27 1367.86 1376.45 1379.54 1394.68 1396.86 1411.28 1454.73 1461.92 1468.13 1489.46 1524.36 1532.15 1548.74 1567.76 1576.90 1589.48 1598.17 1600.40 1628.52 1632.67 1641.44 1664.90 1686.23 1694.00 1694.71 1751.56 1760.22 1784.06 1793.58 1801.30 1810.19 1821.25 1829.27 1830.99 1832.82 1869.80 1902.85 1917.14 1940.82 1953.81 1964.17 1978.33 1992.09 2011.91 2023.54 2035.45 2054.46 2056.76 2078.00 2086.29 2092.44 2099.48 2117.23 2145.16 2163.33 2182.69 2197.51 2201.93 2213.72 2227.44 2230.99 2243.64 2253.18 2254.42 2257.81 2259.52 2268.29 2276.24 2308.57 2349.21 2349.25 2359.66 2365.70 2369.56 2370.85 2372.63 2375.95 2390.82 2392.48 2412.31 2432.34 2438.35 2482.18 2495.42 2585.12 2625.62 2626.25 2732.24 2737.57 4602.47 4626.95 4629.51 4640.68 4651.39 4658.89 4670.54 4688.02 4688.21 4711.96 4717.45 4722.92 4732.25 4737.98 4746.74 4749.50 4768.96 4797.95 4799.84 4801.26 4808.36 4819.94 4858.00 4880.34 4898.58 4904.38 4939.79 4961.53 4976.58 5266.21 5365.97 5586.76 0.589804 0.618023 0.618967 0.525956 -1468.518747 -1468.490528 -1468.489584 -1468.582595 3.119604D-04 MUNgauss RevisionA2.1 retrievium 06-Feb-2021 DUDE C[C@@H](CNC(=O)[C@@H]1CN(CC12CC[NH2+]CC2)C(=O)c3cccn3C)Oc4ccc(cc4)F C39596126 RHF 6-31G(d) (6D,10F) C1 443.245844 |X|Y|Z| 109.701055 77.289543 34.231279 66.209182 27 6 7 8 22 4 1 |36.858105| |12.527575|36.858105| |8.867021|17.549753|0.500000| |7.566431|12.522547|0.247610|36.858105| |5.021822|7.800801|0.195674|13.116943|53.358707| |3.881901|5.250633|0.143402|7.736558|19.402499|36.858105| |3.687027|4.626717|0.127675|6.756279|11.563479|15.741490|73.516695| |3.083143|3.996129|0.112011|4.996588|10.701790|12.467814|14.163840|36.858105| |3.041394|3.976378|0.117022|4.617866|9.387278|9.055518|11.504592|17.500099|0.500000| |2.881844|3.665337|0.098812|4.382244|8.786972|7.323649|9.353223|12.384364|0.247494|36.858105| |2.367150|2.879076|0.079079|3.312527|5.978054|5.096120|7.420745|8.117892|0.192139|13.071267|53.358707| |2.234637|2.684289|0.075349|3.101339|5.461575|5.012989|7.822936|8.070963|0.200775|7.892537|17.833999|36.858105| |2.536897|3.088297|0.086707|3.762149|6.829925|7.290595|11.750145|12.314917|0.248176|7.857977|11.010241|12.394115|36.858105| |2.409441|2.875861|0.083328|3.402800|5.770941|5.907537|10.985666|7.477332|0.200675|5.016737|6.976438|7.429161|12.381597|36.858105| |2.054656|2.366236|0.067805|2.747167|4.399357|4.160262|7.997960|4.859766|0.128808|3.834787|5.669326|5.917048|7.442916|12.513736|36.858105| |2.035142|2.306890|0.064663|2.737197|4.280659|4.025193|8.073884|4.399179|0.109218|3.632915|5.247355|5.025977|6.483582|7.732122|12.658485|53.358707| |1.847149|2.061287|0.057756|2.402241|3.673168|3.320877|6.570509|3.580816|0.091103|3.085977|4.509647|4.181976|4.903155|5.691964|9.156057|25.693915|0.500000| |2.165124|2.441125|0.068355|2.940484|4.508676|4.282229|9.182501|4.347626|0.107418|3.497088|4.795195|4.356125|5.910669|7.175555|9.210282|25.649772|0.327403|0.500000| |2.076259|2.369288|0.065084|2.851453|4.552318|4.264458|8.109934|4.848185|0.113080|4.285632|6.379507|5.953229|7.426627|6.486391|7.627574|17.220560|0.254395|0.255656|36.858105| |2.442795|2.878975|0.078300|3.605471|6.128277|6.208657|11.240844|7.433778|0.152510|6.213599|8.505382|7.528571|12.306407|7.519931|6.471360|10.485647|0.157804|0.198252|12.506766|36.858105| |2.110072|2.511312|0.069044|2.775136|4.749593|3.790218|5.724384|5.237213|0.137686|7.509741|18.879462|7.923038|5.217275|3.892165|3.395106|4.290743|0.078359|0.079938|3.725885|4.436463|36.858105| |1.890888|2.213911|0.061597|2.415605|4.018410|3.236183|5.069781|4.323993|0.118270|5.330520|11.662528|7.278646|4.639146|3.725637|3.407083|4.214674|0.078518|0.077094|3.569873|3.955133|15.799273|73.516695| |2.122726|2.506989|0.067781|2.713846|4.532230|3.397287|5.113573|4.298884|0.113278|6.320819|10.587247|5.061556|3.974077|3.101891|2.733503|3.554470|0.065852|0.067921|3.050480|3.606811|12.954353|14.433962|36.858105| |2.267331|2.665522|0.070225|2.903839|4.778019|3.447310|5.168399|4.095287|0.104220|6.117167|8.428442|4.221691|3.652170|2.851904|2.512301|3.365050|0.062355|0.065511|2.912678|3.502066|7.365621|9.368215|13.866213|36.858105| |2.089043|2.398108|0.063221|2.527128|3.981893|2.810482|4.316778|3.193276|0.084008|4.293885|5.881223|3.266558|2.885804|2.368701|2.127229|2.849051|0.053634|0.055804|2.406056|2.784905|5.159424|7.470211|8.484633|13.550362|36.858105| |1.903170|2.177369|0.058540|2.263166|3.561802|2.555715|3.963320|2.958450|0.080182|3.834213|5.581656|3.196649|2.732482|2.291153|2.076904|2.733564|0.051822|0.053083|2.273632|2.572373|5.286770|8.172928|8.629298|8.586972|13.937738|36.858105| |1.915175|2.220439|0.060491|2.334615|3.765770|2.776845|4.279378|3.364912|0.092115|4.434632|7.029828|3.913041|3.158201|2.613960|2.357528|3.048286|0.057482|0.058429|2.543035|2.883450|7.680394|11.851751|13.849052|8.579613|8.576495|14.145730|53.358707| |1.736331|1.995130|0.055231|2.074821|3.306101|2.471163|3.879202|2.989036|0.084312|3.662436|5.947171|3.636063|2.893109|2.490353|2.286552|2.902387|0.055332|0.055247|2.365185|2.598935|6.271323|11.931537|7.484713|5.229465|5.264340|7.707767|17.804417|36.858105| |7.813025|13.413238|0.258359|8.151236|9.619032|4.740910|7.029491|3.950574|0.109547|3.934320|4.144460|2.724300|3.008439|2.710023|2.242485|2.963935|0.054262|0.062759|2.284485|2.785103|2.712272|4.184059|2.802235|3.044078|2.769014|2.480951|3.389028|2.198637|73.516695| |6.245075|7.949733|0.202740|5.251247|6.651746|3.687900|5.635359|3.290856|0.094525|3.321623|3.670988|2.429593|2.598521|2.390268|2.010843|2.627821|0.048657|0.055164|2.006052|2.381682|2.485267|3.899092|2.598906|2.779974|2.617772|2.398908|3.246902|2.140481|24.723111|36.858105| |4.859059|6.155095|0.189464|4.416079|6.003865|3.519569|5.391762|3.266923|0.098246|3.228338|3.653854|2.456847|2.593052|2.435921|2.039012|2.608816|0.048372|0.054436|1.963943|2.309054|2.495783|3.970179|2.569418|2.653398|2.500856|2.362065|3.255134|2.194440|14.129441|13.750369|36.858105| |3.833510|4.346825|0.130774|3.356122|4.553715|2.817306|4.433366|2.692490|0.080855|2.696506|3.174866|2.151340|2.222756|2.113618|1.809084|2.313318|0.043365|0.048005|1.734606|1.995987|2.227340|3.607207|2.313011|2.368987|2.295983|2.210297|3.015858|2.069903|9.258366|7.935452|13.754725|36.858105| |3.616350|3.827026|0.108513|3.008913|3.980901|2.476233|3.949003|2.358091|0.069079|2.406054|2.860679|1.927943|1.982973|1.874494|1.630508|2.113265|0.039866|0.043863|1.594836|1.820195|2.029400|3.292849|2.142743|2.233261|2.212025|2.114845|2.823807|1.929058|8.230704|6.938382|8.007196|13.825161|36.858105| |4.065589|4.137391|0.110221|3.222471|4.138077|2.525234|4.030388|2.361392|0.067590|2.438715|2.864277|1.911662|1.981535|1.849944|1.613355|2.119780|0.039964|0.044161|1.614449|1.851562|2.021313|3.248746|2.157551|2.304486|2.290093|2.140326|2.816779|1.891382|9.300259|7.937980|6.865401|7.907717|13.822198|36.858105| |5.365422|5.605384|0.139297|4.125679|5.136657|2.994818|4.711562|2.721132|0.076827|2.810257|3.200550|2.116491|2.230796|2.055294|1.770581|2.340566|0.043787|0.049023|1.794471|2.093194|2.214845|3.505614|2.359763|2.561536|2.490700|2.275345|3.006937|1.984128|14.274702|13.757817|7.936513|6.864893|8.007008|13.758672|36.858105| |2.936947|3.035423|0.086543|2.490529|3.320039|2.125841|3.437783|2.053981|0.060187|2.097340|2.552862|1.735274|1.766242|1.684416|1.485261|1.923792|0.036552|0.039795|1.446404|1.627747|1.835474|3.018841|1.937346|2.000811|2.009877|1.951470|2.597356|1.801785|6.223102|4.677035|5.309394|8.171352|14.350313|8.165705|5.308175|97.533100| |17.593580|8.824142|0.212796|5.503589|5.646454|3.312326|5.562766|2.752440|0.076913|2.608035|2.969769|2.060137|2.291646|2.195081|1.888627|2.523448|0.047088|0.054344|1.883202|2.184921|1.978214|3.175938|2.003836|2.127707|1.991979|1.832775|2.498280|1.677261|12.394982|6.741232|5.309144|4.330531|4.177932|4.742494|6.139176|7.531660|0.500000| |17.563317|8.834683|0.173454|6.884199|6.355574|3.647237|6.168480|2.930319|0.078538|2.817848|3.156325|2.164369|2.440506|2.279971|1.968223|2.693454|0.050069|0.058367|2.047671|2.405923|2.078137|3.297387|2.116424|2.300776|2.131950|1.917721|2.596816|1.714634|12.560946|5.571159|4.197017|3.425049|3.361555|3.931522|5.254903|6.225878|0.301074|0.500000| |17.554927|8.846413|0.212512|6.877118|6.279111|3.782389|6.712878|2.965623|0.081190|2.697212|3.062896|2.169432|2.497324|2.426042|2.083439|2.821623|0.052375|0.061987|2.083212|2.422998|1.995830|3.210570|1.978451|2.089781|1.918159|1.760920|2.430381|1.633475|10.052667|4.730355|4.035538|3.304952|3.094690|3.359935|4.141336|5.844964|0.301903|0.300266|0.500000| |6.791060|8.855324|0.215859|17.657781|12.559880|7.421951|13.850226|4.686165|0.121119|3.890038|4.177378|2.992370|3.731058|3.537361|2.872213|3.923722|0.070180|0.088136|2.920161|3.622720|2.566453|4.046559|2.459254|2.582858|2.257657|2.050466|2.901200|1.924059|10.301396|4.251684|3.786117|2.989643|2.684814|2.825291|3.469896|5.109027|0.139722|0.166725|0.201786|0.500000| |7.039998|8.897798|0.174587|17.559111|12.425783|6.284118|10.141935|4.403556|0.109564|4.139203|4.312099|2.913107|3.465778|3.068601|2.554370|3.554996|0.064233|0.077731|2.783444|3.494459|2.688490|4.143595|2.682011|2.951555|2.583957|2.271655|3.138773|2.026368|12.872856|4.792416|3.876123|3.054381|2.841304|3.135396|4.045376|5.338877|0.142658|0.210942|0.173955|0.301590|0.500000| |4.715691|7.313353|0.183208|9.136136|26.051113|9.383944|10.835895|7.472232|0.191935|7.280865|6.407105|4.047083|4.696280|3.872079|2.998092|3.920871|0.069456|0.082299|3.108184|4.120685|3.816035|5.608622|3.758566|4.017163|3.325740|2.945807|4.220380|2.673593|14.625105|5.631333|5.035438|3.725628|3.228710|3.357578|4.221693|5.971760|0.112845|0.123528|0.115258|0.180851|0.207299|0.500000| |2.954593|3.690856|0.095745|4.578264|8.797294|6.976487|9.292685|8.777629|0.175314|17.575323|12.276619|6.133274|6.539544|4.359381|3.507720|4.790477|0.083702|0.095575|4.305780|6.344557|6.183432|8.082844|5.816945|6.458193|4.458845|3.760850|5.621507|3.334572|7.062066|3.270877|3.056266|2.559481|2.334548|2.420706|2.826526|4.574663|0.073303|0.082299|0.076540|0.111306|0.127163|0.196566|0.500000| |3.006141|3.894123|0.105302|4.388123|8.667969|6.219900|8.018576|8.674662|0.222611|17.617509|12.312340|5.964972|5.685820|4.168581|3.261728|4.150718|0.073636|0.082330|3.454934|4.609642|6.971471|8.893752|6.738769|6.618886|4.751841|4.244950|6.603252|3.923808|7.880133|3.807095|3.735933|3.083749|2.720809|2.741913|3.169047|5.274990|0.076658|0.081195|0.076487|0.104739|0.114001|0.227217|0.302736|0.500000| |2.011231|2.358921|0.065775|2.706951|4.564569|4.073585|6.688927|5.715168|0.143043|5.832719|12.423087|17.614793|8.603375|6.214605|5.930964|7.211382|0.126631|0.121362|6.650457|7.099361|7.118098|13.178372|4.677531|3.915699|3.097452|3.060763|5.078748|3.537736|4.245661|2.150055|2.161332|1.921946|1.745229|1.736843|1.907401|3.569369|0.051712|0.054579|0.054537|0.073283|0.071975|0.093249|0.140958|0.129226|0.500000| |2.158710|2.591053|0.074229|2.903276|5.036298|4.476799|7.036703|6.849099|0.202695|6.353993|12.330478|17.536885|8.749171|7.148225|5.685523|6.045834|0.105766|0.108284|4.750644|5.506761|7.050107|12.908511|4.655800|3.782277|3.044370|3.078191|5.192053|3.732151|4.676260|2.396289|2.483115|2.194929|1.946663|1.901195|2.079616|3.964119|0.055927|0.057446|0.058279|0.078152|0.074594|0.104747|0.135994|0.150619|0.304080|0.500000| |2.348826|2.815632|0.083352|3.204693|5.418392|5.199875|9.102831|6.746886|0.213547|4.729458|6.695334|7.004618|8.789145|17.566598|8.993790|7.646165|0.127089|0.145188|4.882554|5.483547|3.894188|6.784680|3.091566|2.781022|2.337872|2.302472|3.611451|2.581277|4.764543|2.412945|2.519711|2.200774|1.928977|1.876431|2.063441|3.913667|0.060277|0.061109|0.065351|0.091393|0.079305|0.104051|0.110139|0.114914|0.158601|0.222808|0.500000| |2.636766|3.149015|0.091974|3.806630|6.311831|6.699297|14.218013|7.006924|0.186676|4.569482|5.862818|5.485955|8.849855|17.598353|8.916052|9.471813|0.145569|0.210944|5.648811|6.682827|3.346921|5.600565|2.792252|2.643207|2.222978|2.127004|3.234330|2.246617|5.092449|2.494133|2.526468|2.170744|1.921505|1.903140|2.130297|3.864710|0.065976|0.068646|0.074985|0.114457|0.093483|0.112213|0.114443|0.108160|0.130847|0.145813|0.303432|0.500000| |1.895483|2.174952|0.062117|2.482123|3.977826|3.633092|6.666567|4.413163|0.118703|3.724509|5.871960|6.386865|6.637519|8.712302|17.618900|12.434545|0.222150|0.181045|7.053066|5.747084|3.633586|6.756218|2.855768|2.564954|2.175364|2.153999|3.375377|2.444235|3.735530|1.906290|1.940761|1.739301|1.573187|1.552401|1.690958|3.243414|0.048812|0.050689|0.052912|0.070744|0.064739|0.077256|0.093841|0.088656|0.195647|0.175871|0.212668|0.172986|0.500000| |1.973488|2.243097|0.064941|2.561240|3.986101|3.659432|7.178432|4.045071|0.111265|3.233503|4.656125|4.533221|5.441194|8.773998|17.626136|12.355009|0.224061|0.222122|5.588636|4.861917|2.889583|5.193429|2.392446|2.214861|1.911160|1.875526|2.867738|2.065577|3.738178|1.904489|1.944495|1.738511|1.566881|1.543256|1.682522|3.228105|0.050681|0.052210|0.056140|0.075448|0.065850|0.075246|0.082825|0.078912|0.125089|0.126960|0.212089|0.216200|0.300996|0.500000| |1.910366|2.174758|0.059970|2.553694|4.080873|3.693331|6.720006|4.391692|0.105969|4.112440|6.629905|6.399242|6.597384|5.734803|7.044069|12.450212|0.222981|0.181162|17.634971|8.701787|4.027214|7.136568|3.207953|2.979913|2.465815|2.367451|3.660011|2.534598|3.790754|1.899956|1.874420|1.671973|1.539981|1.551752|1.709491|3.161524|0.048649|0.052356|0.052865|0.071576|0.069293|0.079490|0.112383|0.093333|0.229687|0.141806|0.129039|0.131886|0.215364|0.144757|0.500000| |2.007616|2.249534|0.061113|2.709796|4.185392|3.784866|7.327922|4.037940|0.095065|3.705261|5.333323|4.560489|5.435541|4.877078|5.590123|12.358241|0.224008|0.222383|17.626646|8.786590|3.242213|5.502179|2.767737|2.713067|2.276740|2.132009|3.182282|2.164130|3.845769|1.898938|1.839532|1.632152|1.515498|1.545660|1.718264|3.100207|0.050494|0.055588|0.056183|0.077457|0.075020|0.079178|0.107657|0.085048|0.139565|0.104779|0.107593|0.127031|0.144730|0.126492|0.301379|0.500000| |2.683474|3.151685|0.084757|4.122442|6.828094|7.171328|14.758822|6.951935|0.143401|5.517256|6.776200|5.523319|8.782430|6.641953|5.605218|9.401161|0.144930|0.208394|8.935817|17.623524|3.709261|5.864433|3.183053|3.195834|2.594951|2.370379|3.531206|2.333509|5.264375|2.483112|2.373737|2.033297|1.858071|1.905035|2.176406|3.718257|0.065564|0.073594|0.074812|0.118447|0.111654|0.120843|0.164083|0.118935|0.141505|0.123020|0.136745|0.191341|0.131551|0.125897|0.173221|0.218027|0.500000| |2.394142|2.810543|0.075072|3.489650|5.914588|5.524991|9.300343|6.668317|0.137436|6.841303|9.601382|7.184482|8.753785|5.489877|4.891212|7.645615|0.127241|0.144619|9.026859|17.579899|5.004383|7.615939|4.131303|4.114445|3.172047|2.866183|4.356934|2.802503|4.973009|2.391591|2.290293|1.986243|1.828582|1.875441|2.124570|3.678977|0.059647|0.066492|0.065013|0.094268|0.096855|0.114799|0.215115|0.137456|0.196092|0.142426|0.123209|0.137232|0.129963|0.107606|0.214253|0.212251|0.303132|0.500000| |2.458772|2.905816|0.075159|3.267339|5.424412|3.898516|5.791636|4.516181|0.109581|6.983586|8.626295|4.328317|3.954743|3.010188|2.629207|3.596058|0.066024|0.070682|3.172902|3.946854|6.392461|8.240122|8.718206|17.811257|8.622798|5.856846|7.963095|4.104361|5.871214|2.914572|2.714273|2.379370|2.245824|2.351814|2.671255|4.481006|0.063112|0.070025|0.062866|0.079918|0.094158|0.126005|0.238067|0.196184|0.110663|0.103904|0.079655|0.078450|0.073367|0.063995|0.088182|0.082854|0.101435|0.133314|0.500000| |2.081618|2.350523|0.061266|2.456294|3.765240|2.612716|4.059053|2.861999|0.075095|3.705379|4.897257|2.828339|2.583193|2.153990|1.946760|2.635655|0.049861|0.052101|2.212410|2.541822|4.051881|6.068731|5.801810|8.565410|17.802033|8.742033|7.972550|4.144066|4.856767|2.595817|2.434483|2.251273|2.212057|2.329589|2.531303|4.533240|0.055308|0.059742|0.052854|0.060803|0.070891|0.086786|0.109937|0.112754|0.074919|0.073290|0.058755|0.056935|0.054856|0.048983|0.062349|0.058989|0.067044|0.079988|0.197359|0.500000| |1.762492|1.989255|0.053717|2.038674|3.147684|2.250925|3.537707|2.558348|0.070190|3.175842|4.585882|2.751246|2.384589|2.049424|1.878196|2.469526|0.047212|0.048082|2.025638|2.251710|4.194064|6.873649|5.918802|5.824895|8.623301|17.799700|12.332280|7.024030|4.014042|2.222949|2.204108|2.103786|2.034870|2.049515|2.140154|4.287862|0.047574|0.049318|0.045389|0.051649|0.056810|0.071639|0.086436|0.096982|0.073871|0.074809|0.057540|0.053157|0.054154|0.047617|0.058600|0.053094|0.058129|0.068677|0.123630|0.197097|0.500000| |1.794090|2.080389|0.058306|2.151303|3.461622|2.600236|4.058832|3.198026|0.092930|3.834910|6.243454|3.908938|3.070694|2.675472|2.423849|3.008894|0.057073|0.057236|2.413280|2.665591|6.419931|12.616696|6.727015|4.702604|4.494276|5.917945|12.371341|17.649204|4.060962|2.234939|2.334275|2.199767|2.017956|1.951879|2.043389|4.233946|0.048235|0.048732|0.046945|0.055535|0.057554|0.077919|0.093552|0.115765|0.102881|0.116538|0.078710|0.066607|0.072076|0.060958|0.071586|0.060584|0.066405|0.078270|0.106511|0.100889|0.149998|0.500000| |1.631378|1.860386|0.051489|1.954816|3.098027|2.355866|3.753742|2.850151|0.079453|3.423393|5.763874|3.660688|2.865178|2.479698|2.330310|2.971081|0.057125|0.055976|2.434390|2.612893|6.076798|12.986300|6.478959|4.655706|4.552433|6.097797|12.357796|17.664719|3.589179|1.949909|1.989211|1.874104|1.751793|1.724044|1.811712|3.693205|0.043627|0.044831|0.042965|0.050873|0.053199|0.068412|0.087600|0.097756|0.103109|0.103676|0.070931|0.061603|0.070287|0.058320|0.073833|0.061930|0.064476|0.078435|0.105398|0.102514|0.156994|0.301721|0.500000| |1.650483|1.875916|0.051887|1.923962|3.010433|2.217390|3.507839|2.606124|0.073762|3.122431|4.825370|3.024015|2.501355|2.194855|2.027718|2.590454|0.049717|0.049721|2.088830|2.277553|4.677385|8.646833|5.651964|4.485067|4.922584|7.500278|12.582347|17.634993|3.692592|2.053060|2.107760|2.021838|1.905671|1.864738|1.930574|4.049613|0.044633|0.045374|0.043048|0.049560|0.052397|0.067584|0.080509|0.093826|0.081852|0.086219|0.063181|0.055785|0.059730|0.051508|0.061631|0.053713|0.057711|0.067811|0.099812|0.112393|0.227051|0.300898|0.299590|0.500000| |4.618982|6.269281|0.214875|4.702152|6.747710|3.999327|6.034578|3.734925|0.116679|3.557068|3.996331|2.723210|2.901382|2.754228|2.258530|2.843759|0.052356|0.059328|2.121795|2.513378|2.684414|4.274366|2.694484|2.722364|2.510147|2.391884|3.372888|2.291144|12.841214|8.918592|17.722993|8.922534|5.676641|4.948606|5.646893|9.607444|0.133053|0.108782|0.111118|0.113678|0.109551|0.156270|0.090864|0.114424|0.065561|0.077383|0.080282|0.079628|0.059400|0.059836|0.056123|0.054594|0.071569|0.068308|0.077295|0.066699|0.061503|0.068655|0.057806|0.060398|0.500000| |3.283845|3.702610|0.114286|2.982351|4.126239|2.636685|4.186572|2.570751|0.078464|2.549257|3.065454|2.104978|2.154552|2.078610|1.787018|2.261755|0.042541|0.046752|1.681836|1.916143|2.167677|3.558572|2.226625|2.235899|2.169695|2.127977|2.935114|2.052923|7.456316|5.631716|8.859538|17.744229|8.965662|5.647962|4.950168|16.724493|0.101185|0.081565|0.081443|0.075549|0.075042|0.092506|0.066325|0.080422|0.052345|0.060501|0.060905|0.059000|0.047925|0.047987|0.045271|0.043790|0.053826|0.052656|0.061701|0.058578|0.056647|0.061227|0.051674|0.055870|0.213230|0.500000| 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