Version2.0 2020-07-18T05:56:43Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 20-May-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1ccc(cc1)[C@@H]2c3ccsc3CCN2C(=O)CN(C(=O)c4cccc5c4cccc5)C(C)(C)C C16500875 RHF 6-31G(d) (6D,7F) Cc1ccc(cc1)[C@@H]2c3ccsc3CCN2C(=O)CN(C(=O)c4cccc5c4cccc5)C(C)(C)C C01[X(C31H32N2O2S1)] 198 C1 608 Cc1ccc(cc1)[C@H]1N(CCc2c1ccs2)C(=O)CN(C(C)(C)C)C(=O)c1cccc2c1cccc2 Cc1ccc(cc1)[C@H]1N(CCc2c1ccs2)C(=O)CN(C(C)(C)C)C(=O)c1cccc2c1cccc2 Cc1ccc(cc1)[C@H]2N(CCc3sccc23)C(=O)CN(C(=O)c4cccc5ccccc45)C(C)(C)C InChIKey=NIVTTYTUDBDHFI-GDLZYMKVSA-N InChI=1S/C31H32N2O2S/c1-21-12-14-23(15-13-21)29-26-17-19-36-27(26)16-18-32(29)28(34)20-33(31(2,3)4)30(35)25-11-7-9-22-8-5-6-10-24(22)25/h5-15,17,19,29H,16,18,20H2,1-4H3/t29-/m1/s1 InChI=1/C31H32N2O2S/c1-21-12-14-23(15-13-21)29-26-17-19-36-27(26)16-18-32(29)28(34)20-33(31(2,3)4)30(35)25-11-7-9-22-8-5-6-10-24(22)25/h5-15,17,19,29H,16,18,20H2,1-4H3/t29-/m1/s1 Cc1ccc(cc1)[C@@H]2c3ccsc3CCN2C(=O)CN(C(=O)c4cccc5c4cccc5)C(C)(C)C C01[X(C31H32N2O2S1)] 198 C01 608 Cc1ccc(cc1)[C@H]1N(CCc2c1ccs2)C(=O)CN(C(C)(C)C)C(=O)c1cccc2c1cccc2 O=C(N1CCC2=[C]([CH]=CS2)[C@H]1[C]1[CH][CH][C]([CH][CH]1)C)CN(C(C)(C)C)C(=O)[C]1[CH][CH]=[CH][C]2[C]1[CH]=[CH][CH]=[CH]2 C[C]1[CH][CH][C]([CH][CH]1)[C@H]2N(CCc3sccc23)C(=O)CN(C(=O)[C]4[CH]C=C[C]5C=CC=C[C]45)C(C)(C)C InChIKey=NIVTTYTUDBDHFI-GDLZYMKVSA-N InChI=1S/C31H32N2O2S/c1-21-12-14-23(15-13-21)29-26-17-19-36-27(26)16-18-32(29)28(34)20-33(31(2,3)4)30(35)25-11-7-9-22-8-5-6-10-24(22)25/h5-15,17,19,29H,16,18,20H2,1-4H3/t29-/m1/s1 InChI=1/C31H32N2O2S/c1-21-12-14-23(15-13-21)29-26-17-19-36-27(26)16-18-32(29)28(34)20-33(31(2,3)4)30(35)25-11-7-9-22-8-5-6-10-24(22)25/h5-15,17,19,29H,16,18,20H2,1-4H3/t29-/m1/s1 4152.5238587695 -1848.705948 1-A 17119.5904 132 476 608 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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| 9.8804 18.4306 22.3769 27.9461 33.4777 38.1673 45.1811 49.5117 62.3364 75.7462 83.5860 94.1618 112.9680 132.6698 156.0795 164.8999 173.2829 181.0715 190.5445 211.6843 225.9382 233.1765 249.3006 253.6060 270.0637 295.5360 299.9086 320.2716 340.2059 344.7400 362.3220 379.8953 389.2560 393.3936 398.1577 420.1870 430.4377 451.6749 455.3868 483.2179 488.4917 496.4512 516.5621 521.0541 534.7669 537.3479 546.9007 560.5522 566.8886 572.0987 604.2822 619.8774 634.6506 643.2547 666.9620 694.8199 702.3549 710.1175 746.2641 766.6549 782.1829 785.9910 806.3314 819.6989 823.3721 830.0660 849.5442 859.9638 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358.69 364.88 388.56 425.21 431.50 460.80 489.48 496.00 521.30 546.58 560.05 566.01 572.86 604.56 619.30 649.86 655.20 695.24 702.83 714.28 743.22 749.68 769.41 773.12 786.87 806.51 815.63 823.12 869.43 891.87 913.12 925.50 959.61 999.69 1010.53 1021.70 1073.71 1103.05 1125.39 1130.87 1160.13 1179.36 1184.65 1194.28 1222.30 1237.30 1245.26 1257.15 1265.72 1295.25 1299.94 1315.54 1323.66 1339.12 1357.05 1380.21 1398.31 1420.12 1450.84 1459.46 1488.66 1493.61 1501.71 1523.94 1538.49 1545.31 1559.44 1563.06 1566.04 1566.95 1572.52 1594.28 1608.26 1610.84 1632.84 1649.08 1662.50 1671.77 1674.56 1686.70 1689.55 1723.58 1741.89 1759.10 1800.54 1820.86 1854.64 1864.59 1871.49 1883.71 1885.32 1886.75 1907.55 1911.80 1921.09 1923.60 1946.55 1960.83 1973.53 1993.39 2013.31 2032.30 2050.06 2063.40 2094.34 2111.00 2128.71 2132.02 2165.08 2187.97 2206.06 2226.52 2235.81 2239.53 2244.24 2248.13 2253.19 2271.32 2276.18 2286.37 2308.06 2339.18 2342.57 2348.37 2352.73 2358.53 2362.17 2367.60 2376.61 2386.60 2387.59 2398.45 2403.44 2421.27 2423.04 2436.41 2556.42 2573.11 2592.10 2599.09 2626.12 2642.35 2766.53 2797.12 4589.88 4605.29 4611.01 4620.86 4625.73 4632.93 4673.00 4678.51 4685.61 4687.97 4715.99 4719.23 4735.02 4753.24 4756.83 4775.40 4810.75 4817.92 4821.69 4821.92 4822.23 4824.59 4832.98 4836.67 4850.57 4854.63 4863.77 4867.31 4871.80 4889.51 4912.71 4954.63 0.605897 0.636571 0.637515 0.540166 -1848.100051 -1848.069377 -1848.068433 -1848.165782 3.265101D-04 MUNgauss RevisionA2.0 retrievium 18-Jul-2020 DUDE Cc1ccc(cc1)[C@@H]2c3ccsc3CCN2C(=O)CN(C(=O)c4cccc5c4cccc5)C(C)(C)C C16500875 RHF 6-31G(d) (6D,10F) C1 496.218450 |X|Y|Z| 95.741679 74.577174 48.901401 70.416768 29 6 7 16 26 2 1 |36.858105| |12.607679|36.858105| |7.534789|13.757825|36.858105| |5.002851|7.890778|13.718118|36.858105| |4.405257|6.770988|7.900287|13.778464|36.858105| |5.015827|7.888254|6.917642|8.004777|13.693199|36.858105| |7.550393|13.670865|8.005824|6.922218|7.904791|13.808686|36.858105| |3.255991|4.389243|4.999300|7.542046|12.468146|7.479851|4.990756|36.858105| |3.045304|3.993368|4.832730|7.457423|8.993608|5.604040|4.207064|17.591461|0.500000| |2.941893|3.793173|4.104010|5.461643|7.663733|6.119373|4.366390|12.603122|0.249863|36.858105| |2.863059|3.588106|3.956191|5.023281|5.940751|4.896017|3.893747|7.305531|0.188274|13.211265|36.858105| |2.527833|3.034258|3.198500|3.776268|4.368159|3.988241|3.323944|5.082151|0.130294|8.229260|14.200165|36.858105| |2.333247|2.770509|2.809547|3.263571|3.964485|3.870865|3.170290|4.735611|0.114732|7.451177|7.451180|11.007094|388.023441| |2.623359|3.252743|3.334734|4.095584|5.504803|5.192245|3.855283|7.580024|0.162154|14.204086|8.227084|7.713854|78.199612|36.858105| |2.484450|3.035181|3.035826|3.634058|4.874118|4.903975|3.672003|6.406664|0.138285|7.664994|5.093472|4.821790|47.135281|12.743986|36.858105| |2.458924|3.025919|3.128267|3.862878|5.130517|4.741678|3.549743|7.434408|0.165879|6.820868|4.546379|3.999683|33.418840|7.788447|12.495131|36.858105| |2.885532|3.715671|3.988256|5.300142|7.620045|6.168796|4.331538|12.881354|0.254452|7.712419|4.972036|4.000856|29.819746|6.743303|7.647600|13.006504|53.358707| |2.801607|3.532029|3.872939|5.007614|6.202447|5.064863|3.908678|7.954557|0.208896|5.159451|3.861176|3.182324|23.008578|4.554367|5.073286|7.750363|18.946082|36.858105| |3.005342|3.818587|4.431590|5.881825|6.442167|4.921116|3.983753|7.230153|0.217859|4.636604|3.713718|3.008331|20.728228|3.893112|4.023638|5.364564|11.553706|15.889498|73.516695| |2.390322|2.867893|3.024271|3.607239|4.227451|3.844665|3.166787|4.994757|0.132675|3.868089|3.046526|2.654202|19.915718|3.729204|4.446784|6.689858|10.437826|12.419577|14.228466|36.858105| |2.250649|2.629499|2.797545|3.227698|3.524937|3.214257|2.794079|3.896911|0.109001|3.098581|2.576974|2.264017|16.574390|2.941269|3.327684|4.454757|6.926189|7.623269|12.328586|13.162552|53.358707| |2.326437|2.667756|2.781330|3.081091|3.290891|3.115780|2.812140|3.395351|0.093303|2.739152|2.322130|2.056127|14.990470|2.606574|2.923508|3.670080|5.712854|5.768736|10.138676|7.827491|18.967493|36.858105| |2.201007|2.466329|2.586403|2.798422|2.879505|2.722085|2.530006|2.914869|0.081716|2.398558|2.088683|1.859794|13.382925|2.269080|2.482235|3.009305|4.640025|4.445726|8.331980|5.372679|11.460462|15.868744|73.516695| |2.479479|2.828306|2.825029|3.052217|3.353306|3.370644|3.078139|3.334185|0.087570|2.735332|2.300544|2.057849|15.264053|2.659235|3.056124|3.707462|5.641935|5.227307|8.681223|6.692351|10.433417|12.564547|14.549785|36.858105| |2.198154|2.464941|2.424350|2.601408|2.891653|2.970127|2.719223|2.935336|0.076421|2.514501|2.124863|1.941419|14.723975|2.525055|2.974569|3.526966|4.972805|4.277845|6.815003|5.669870|8.143606|7.696509|10.477722|13.992808|36.858105| |2.193986|2.414368|2.306963|2.417431|2.692911|2.876920|2.700237|2.666621|0.068419|2.349085|2.005913|1.858174|14.220954|2.395317|2.821744|3.164890|4.372974|3.527681|5.679642|4.252000|5.722428|5.025340|7.577021|7.886840|13.470059|36.858105| |2.471366|2.688695|2.500596|2.556133|2.831575|3.124929|3.030088|2.690332|0.068404|2.364456|2.032832|1.877220|14.225220|2.386440|2.755869|3.002239|4.276097|3.387711|5.600575|3.780982|5.023524|4.427049|6.887757|6.821545|7.938435|14.041781|36.858105| |2.926607|3.217819|2.975490|3.002230|3.282559|3.632921|3.592921|2.997573|0.076286|2.551109|2.190545|1.985511|14.723282|2.501455|2.819711|3.108528|4.687528|3.811474|6.533068|4.034800|5.432981|4.965310|7.739905|7.808516|6.831534|7.894163|13.417670|36.858105| |2.935965|3.338495|3.238826|3.374916|3.657839|3.820297|3.634365|3.389750|0.087759|2.763397|2.345835|2.086182|15.267989|2.646661|2.967042|3.441749|5.437027|4.799500|8.439455|5.162319|7.339408|7.442859|10.886469|13.345323|7.875154|6.781931|7.788575|13.500562|36.858105| |3.426219|3.944956|3.929670|4.009017|4.104376|4.141428|4.063676|3.607692|0.095490|2.858439|2.463618|2.150310|15.268139|2.638607|2.835599|3.266307|5.449082|4.885467|9.579703|4.669895|6.750287|6.398700|10.320479|7.618140|5.103024|4.502980|5.095682|7.811839|13.395007|36.858105| |4.183249|4.611299|4.347161|4.072346|4.009351|4.234507|4.555393|3.325844|0.087470|2.711096|2.395020|2.101276|14.742729|2.493617|2.615191|2.878483|4.730825|3.932444|7.699034|3.617901|5.021942|4.395490|7.432566|5.102893|3.940964|3.783040|4.521365|6.819113|7.888384|14.028576|36.858105| |4.148325|4.297906|3.757753|3.455308|3.522720|3.974699|4.463345|2.948721|0.075994|2.506628|2.227895|1.996509|14.236965|2.368376|2.509860|2.671903|4.206130|3.327012|6.161798|3.154243|4.261915|3.666859|6.157045|4.505283|3.786540|3.946556|5.129676|7.891573|6.799990|7.909085|13.462369|36.858105| |3.390177|3.577514|3.163834|3.039096|3.238464|3.703106|3.942380|2.827912|0.071983|2.442784|2.142304|1.946468|14.232447|2.372477|2.593308|2.756580|4.193351|3.292092|5.822721|3.276671|4.376799|3.810860|6.241078|5.095809|4.526496|5.130411|7.696169|13.414727|7.802777|6.832639|7.926896|14.035035|36.858105| |2.018834|2.325127|2.524977|2.908934|3.058735|2.726624|2.406787|3.436163|0.101163|2.816058|2.419673|2.136038|15.370205|2.647537|2.886663|3.748057|5.670121|5.704218|10.160196|7.418758|17.222829|7.696968|12.198515|4.925756|4.218736|3.222761|2.883872|3.076190|3.896146|3.824586|3.036966|2.595798|2.608392|36.858105| |2.103593|2.411552|2.689919|3.079228|3.073157|2.680389|2.415315|3.331729|0.101713|2.700624|2.385616|2.080770|14.517596|2.462595|2.579165|3.217297|5.097270|5.019942|10.348218|5.332591|10.284730|6.241597|11.557504|4.221542|3.491008|2.796368|2.613437|2.881887|3.655653|3.896531|3.152325|2.613555|2.532542|12.391077|36.858105| |1.773108|1.992899|2.121896|2.369989|2.477995|2.282145|2.061043|2.718128|0.078459|2.328303|2.041179|1.844933|13.416867|2.243250|2.459818|3.055010|4.375830|4.024513|7.027859|5.210450|10.479117|6.355488|11.441629|4.396822|4.082143|3.140066|2.737870|2.817474|3.432681|3.251647|2.647906|2.332066|2.385742|12.392926|7.532692|36.858105| |1.919369|2.225053|2.432126|2.862914|3.059011|2.679114|2.319773|3.651653|0.109979|3.071612|2.633201|2.331152|16.840268|2.903559|3.142793|4.177114|6.025074|5.641549|9.434866|6.798411|10.370366|5.043533|7.914615|3.830181|3.476283|2.795161|2.520866|2.640841|3.186076|3.136310|2.606665|2.280365|2.292012|12.397909|7.681267|7.698685|36.858105| |17.535106|8.836044|5.941644|4.319215|3.954636|4.565984|6.608861|3.020727|0.078109|2.843608|2.830594|2.554454|16.719601|2.572180|2.408087|2.327127|3.628029|2.535439|4.741268|2.185564|2.780852|2.091256|3.513308|2.228627|2.014162|2.027782|2.268569|2.614520|2.585103|2.914920|3.435046|3.499613|2.994990|1.846344|1.906329|1.635030|1.777777|0.500000| |17.545849|8.836284|5.807182|4.264737|3.948220|4.622280|6.806562|3.006402|0.077651|2.701910|2.574562|2.302583|15.517260|2.464264|2.397834|2.386628|3.770347|2.729271|5.154197|2.383258|3.079697|2.385136|4.023569|2.597588|2.306856|2.338323|2.693691|3.235777|3.153665|3.667427|4.705527|4.981466|3.931305|2.007697|2.077736|1.779869|1.884493|0.302357|0.500000| |17.575564|8.834624|7.218428|4.733644|3.942817|4.169305|5.569594|3.008462|0.080540|2.706782|2.677586|2.360215|15.290599|2.395648|2.259591|2.268355|3.624168|2.635645|5.127622|2.258669|2.947270|2.240954|3.828798|2.340895|2.066572|2.041442|2.273726|2.684029|2.741753|3.251778|3.948916|3.776027|3.066309|1.974248|2.093481|1.738029|1.872094|0.301902|0.301686|0.500000| |6.969331|8.925283|17.699269|8.935669|5.640683|4.973877|5.667483|4.090805|0.115227|3.465523|3.456316|2.856414|17.706069|2.866372|2.619120|2.714190|4.582962|3.362285|6.938484|2.706469|3.506140|2.578285|4.363089|2.574171|2.217480|2.106908|2.272151|2.684267|2.923700|3.569789|3.980056|3.425711|2.864282|2.381955|2.595069|2.022645|2.286482|0.154410|0.149303|0.220883|0.500000| |4.087970|5.636064|8.932188|17.713340|8.938727|5.671058|4.977666|7.013607|0.230940|5.131919|4.917822|3.666206|22.053974|3.818549|3.367992|3.680816|6.793552|4.931696|10.880010|3.557074|4.431907|3.046301|4.988253|2.902148|2.474118|2.264097|2.350774|2.724950|3.113256|3.688412|3.635981|3.050392|2.711110|3.046374|3.325060|2.452119|3.040386|0.100189|0.098816|0.112925|0.216807|0.500000| |4.100926|5.634922|4.975638|5.671482|8.898455|17.721797|8.974163|6.927133|0.140214|6.254195|4.730695|4.053063|30.337007|5.968375|6.080035|5.453542|8.854766|5.009927|8.014973|3.981265|4.382858|3.094922|4.735320|3.430554|3.120542|3.071322|3.311286|3.713751|3.795066|3.858622|3.830914|3.740047|3.688114|2.695059|2.569501|2.280932|2.675452|0.107601|0.109366|0.096083|0.107886|0.124350|0.500000| |7.010865|8.900725|5.671693|4.975702|5.637921|8.962588|17.693044|4.078200|0.096573|3.752799|3.380567|3.019084|21.174691|3.506266|3.439929|3.242588|5.099248|3.400761|6.011989|2.892349|3.496758|2.620681|4.210257|2.939436|2.661878|2.725153|3.122687|3.642163|3.492222|3.751871|4.275880|4.549606|4.141990|2.209848|2.191764|1.929591|2.124300|0.185170|0.196122|0.140607|0.124288|0.107913|0.217621|0.500000| |2.989946|3.744912|4.342806|5.564972|5.861199|4.610972|3.841289|6.555555|0.188876|8.560177|17.743745|8.928134|37.676243|5.728266|4.071043|3.868108|6.025369|3.659997|6.572121|2.873029|3.399749|2.269082|3.676490|2.221853|2.028996|1.908471|1.943798|2.117836|2.284274|2.450237|2.404985|2.210446|2.090343|2.379547|2.407927|2.003110|2.565728|0.081750|0.073365|0.079188|0.107711|0.159388|0.117041|0.091099|0.500000| |2.363479|2.758627|2.900590|3.306553|3.637002|3.375418|2.945754|4.026527|0.107065|5.681529|8.784047|17.789805|55.253859|5.420799|3.828260|3.273497|4.462914|2.719644|4.650283|2.317317|2.748700|1.851196|3.011743|1.848891|1.751287|1.684812|1.705108|1.798070|1.878123|1.940945|1.913139|1.827047|1.776230|1.927936|1.894836|1.686043|2.095119|0.067168|0.059685|0.061945|0.073659|0.090329|0.094035|0.075371|0.204059|0.500000| |2.659411|3.246541|3.124278|3.627301|4.921990|5.495031|4.103360|5.710215|0.122051|6.321221|4.487933|4.271833|40.088100|8.902962|17.538911|8.825871|9.131810|4.737839|6.809557|4.230417|4.382051|2.929310|4.415256|3.187209|3.127223|3.057091|3.048887|3.105592|3.173490|2.988407|2.792522|2.742667|2.875992|2.728440|2.454234|2.353948|2.861099|0.071791|0.072133|0.066038|0.074038|0.090480|0.209749|0.109914|0.102820|0.096909|0.500000| |2.187609|2.596253|2.590839|3.020957|3.821391|3.855309|3.064981|4.797863|0.111958|5.714636|4.300386|4.350489|45.256514|8.874867|17.561627|8.933366|7.622751|4.170932|6.026855|3.928660|4.123848|2.666165|4.069644|2.774731|2.777493|2.657702|2.554175|2.548591|2.649544|2.501286|2.310882|2.240918|2.338727|2.685301|2.375472|2.347482|2.964884|0.059388|0.059015|0.055747|0.063396|0.079286|0.128093|0.081523|0.097431|0.099471|0.303003|0.500000| |2.345048|2.828663|2.865775|3.411088|4.364630|4.259249|3.322216|5.562461|0.130384|4.997319|3.641513|3.298999|27.528701|5.649718|8.962361|17.657254|12.463221|7.228565|8.847958|7.759470|6.684019|4.055747|5.759080|4.235625|4.189368|3.717750|3.411475|3.427718|3.776755|3.408625|2.943679|2.766275|2.937962|3.928353|3.238033|3.273763|4.231982|0.061456|0.064375|0.060054|0.069705|0.089826|0.137583|0.086437|0.088797|0.077454|0.220460|0.213241|0.500000| |2.216976|2.680152|2.825211|3.476818|4.343497|3.880341|3.033826|6.340258|0.159010|6.188649|4.419724|3.955939|32.638277|6.902404|8.927199|17.511031|12.295618|6.631607|8.711768|6.063582|5.811966|3.418581|5.086700|3.305903|3.170652|2.817142|2.637972|2.710354|3.014876|2.895002|2.557144|2.361048|2.417553|3.835324|3.260976|3.132824|4.606651|0.058560|0.059490|0.057663|0.069621|0.095677|0.118210|0.077142|0.105365|0.090977|0.174538|0.223006|0.302145|0.500000| |2.434500|2.901436|2.954077|3.424776|4.097744|3.979238|3.295447|4.598209|0.116040|3.693974|2.904983|2.575557|19.785312|3.693158|4.617463|6.575935|9.460627|8.957310|11.122947|17.675533|12.513562|7.452849|9.017636|8.076804|7.294997|5.364973|4.629208|4.794595|5.993685|4.911674|3.802500|3.429827|3.715206|5.549658|4.266753|4.446878|5.015385|0.061996|0.068409|0.063045|0.072779|0.090749|0.118774|0.085477|0.075277|0.062532|0.128782|0.113515|0.239966|0.153193|0.500000| |2.157803|2.558723|2.697896|3.211061|3.751564|3.412924|2.819453|4.643492|0.125126|3.828247|3.027579|2.684901|20.540545|3.813010|4.636198|7.263770|9.464988|8.852539|10.924391|17.689849|12.500001|5.841532|7.863382|5.094593|4.783428|3.749146|3.286783|3.371441|4.052467|3.695209|3.007417|2.693014|2.808200|6.995232|4.828365|5.208599|7.858779|0.055597|0.059399|0.056814|0.067701|0.089204|0.099763|0.072236|0.078317|0.065128|0.117042|0.118431|0.239480|0.204472|0.307473|0.500000| |1.985151|2.220307|2.212214|2.396370|2.653515|2.674036|2.428994|2.773106|0.073163|2.410397|2.045958|1.882371|14.351375|2.440830|2.885493|3.461566|4.716002|4.044852|6.376409|5.658222|8.396874|7.177541|10.068300|9.011372|17.700266|8.839406|5.661296|4.929287|5.607975|4.131980|3.286076|3.130695|3.604749|4.519528|3.553333|4.646629|3.744045|0.050954|0.057248|0.052218|0.056646|0.064292|0.078170|0.065770|0.054162|0.047290|0.082407|0.076387|0.115355|0.089016|0.191728|0.141599|0.500000| |1.980592|2.157609|2.062302|2.158220|2.398858|2.559154|2.406816|2.406125|0.061950|2.171181|1.870453|1.755896|13.571384|2.246876|2.655007|2.920502|3.905202|3.073211|4.933621|3.690962|4.930109|4.115464|6.405783|5.639503|8.834157|17.718106|8.999303|5.613456|4.904834|3.590515|3.129362|3.291718|4.150981|2.900070|2.506716|2.903761|2.579966|0.051476|0.058367|0.051326|0.052637|0.056487|0.076490|0.067998|0.049259|0.044452|0.079617|0.071038|0.095449|0.073321|0.125791|0.094560|0.214423|0.500000| |2.387608|2.541745|2.327544|2.343838|2.582595|2.894408|2.867828|2.438278|0.061939|2.193771|1.910737|1.785625|13.582255|2.234411|2.558953|2.699587|3.783305|2.910022|4.840895|3.165172|4.168101|3.541983|5.679598|4.924377|5.632204|9.001268|17.706043|8.838427|5.581684|4.149001|3.943382|4.713839|7.082975|2.483070|2.278307|2.380942|2.218025|0.061671|0.072925|0.060777|0.059025|0.059727|0.085700|0.084196|0.050712|0.045345|0.079317|0.066610|0.084089|0.066328|0.104794|0.078585|0.124201|0.216026|0.500000| |3.235306|3.778938|4.004845|4.238358|4.198419|3.956175|3.772613|3.791769|0.104138|2.933175|2.536202|2.187115|15.317129|2.655527|2.813086|3.322734|5.689578|5.428797|11.671465|5.052247|7.774550|7.274604|12.135543|6.967205|4.661399|3.913409|4.138551|5.587199|8.810951|17.762070|9.033358|5.632296|4.934532|4.485567|4.836965|3.650194|3.555426|0.076724|0.093033|0.087380|0.102921|0.112829|0.100780|0.094119|0.070853|0.054827|0.080224|0.068933|0.094676|0.083440|0.137099|0.109657|0.110514|0.089300|0.095659|0.500000| |4.695846|5.053195|4.932589|4.379062|4.024461|4.106613|4.559819|3.266331|0.087813|2.667380|2.408131|2.098159|14.409702|2.408201|2.459247|2.685065|4.448788|3.661642|7.452881|3.265902|4.555334|3.841151|6.685365|4.135245|3.287616|3.129478|3.602641|4.924958|5.618870|9.029895|17.728863|8.826485|5.655085|2.871357|3.088034|2.492652|2.496741|0.103437|0.144528|0.128717|0.130475|0.109520|0.099680|0.115499|0.068412|0.053418|0.071987|0.060425|0.074645|0.067206|0.092297|0.076786|0.078862|0.074051|0.089883|0.217980|0.500000| |4.600698|4.391999|3.709664|3.270855|3.258103|3.706710|4.390131|2.700399|0.069943|2.347746|2.129892|1.922945|13.595400|2.216899|2.308066|2.404310|3.741965|2.889886|5.373776|2.710361|3.646785|3.051884|5.209985|3.591735|3.132200|3.293042|4.153212|5.615319|4.913770|5.646846|8.823361|17.712949|9.010622|2.286104|2.324985|2.071041|2.043094|0.107351|0.164305|0.116089|0.095740|0.080089|0.095923|0.128200|0.059095|0.049322|0.069982|0.057596|0.068273|0.059558|0.080700|0.065674|0.074083|0.079025|0.111782|0.124261|0.213685|0.500000| |3.172676|3.242846|2.827664|2.695659|2.877374|3.331288|3.595017|2.538640|0.064539|2.255584|2.000136|1.844543|13.589969|2.223306|2.428623|2.518539|3.726575|2.849537|4.981290|2.853849|3.779117|3.204509|5.303340|4.148637|3.947760|4.715881|7.085981|8.840237|5.587446|4.929993|5.626411|8.994819|17.704005|2.302143|2.224602|2.140226|2.058668|0.079939|0.103094|0.079346|0.071657|0.067024|0.093910|0.109003|0.054012|0.047058|0.075376|0.061631|0.074571|0.061727|0.089746|0.069693|0.089950|0.111728|0.215683|0.107193|0.124068|0.216318|0.500000| |2.123433|2.398458|2.647435|2.941641|2.896291|2.582731|2.380223|3.015984|0.090063|2.463932|2.194027|1.926244|13.450300|2.259607|2.371522|2.887981|4.560751|4.394406|9.096669|4.697057|9.222488|6.732039|14.621102|4.462437|3.606421|2.887987|2.722174|3.041905|3.914405|4.249208|3.397022|2.777703|2.673267|8.750286|17.673144|6.867744|5.540529|0.053110|0.058888|0.059009|0.071589|0.086841|0.068474|0.060426|0.061691|0.049001|0.063836|0.060727|0.081769|0.079586|0.110668|0.114939|0.100287|0.071303|0.065652|0.149787|0.092447|0.068298|0.064765|0.500000| |1.916686|2.170406|2.422358|2.748919|2.717770|2.377996|2.159822|2.965621|0.091452|2.481060|2.237726|1.971538|13.681826|2.273135|2.351355|2.874101|4.416525|4.089258|8.170552|4.286887|7.520620|4.698566|8.847048|3.436207|2.970948|2.444243|2.286288|2.478717|3.029655|3.201929|2.693844|2.283233|2.214841|8.853449|17.532435|6.905019|7.171973|0.048693|0.052353|0.053325|0.065752|0.083365|0.063503|0.054752|0.063077|0.050341|0.061713|0.060996|0.079621|0.082727|0.098150|0.114338|0.085231|0.062023|0.056252|0.106384|0.074209|0.057340|0.054871|0.301589|0.500000| |2.320419|2.712974|3.111979|3.667858|3.593021|3.019951|2.690508|3.909705|0.123674|3.056863|2.691841|2.297478|15.750672|2.707633|2.779919|3.486879|5.818178|5.889151|13.626741|5.506015|9.391415|5.673305|9.850178|4.095720|3.329030|2.720717|2.599729|2.923982|3.717718|4.140490|3.381298|2.749299|2.612315|8.790435|17.620767|5.487333|6.952956|0.058013|0.062908|0.064288|0.083186|0.113154|0.078888|0.066565|0.076341|0.057757|0.073088|0.069878|0.094590|0.097512|0.120531|0.135060|0.091611|0.067339|0.063159|0.146710|0.093701|0.068091|0.063392|0.301290|0.300552|0.500000| |1.707210|1.916603|2.014417|2.246840|2.392998|2.236890|2.010024|2.649006|0.075093|2.308965|2.010701|1.837429|13.599833|2.271018|2.541635|3.159862|4.345646|3.878403|6.455344|5.275657|9.610034|5.790874|9.677368|4.361738|4.338659|3.322771|2.812111|2.805187|3.334008|3.046532|2.503235|2.253933|2.350798|8.778704|5.480578|17.534732|6.996488|0.044018|0.047729|0.046140|0.052950|0.063803|0.063127|0.052732|0.054171|0.046572|0.067546|0.068353|0.096570|0.090427|0.129693|0.155229|0.145815|0.087118|0.068078|0.091932|0.064760|0.055642|0.059155|0.140079|0.141220|0.122858|0.500000| |1.655042|1.847824|1.979852|2.204975|2.275825|2.083645|1.893008|2.502565|0.073262|2.178769|1.942394|1.764371|12.728375|2.093517|2.256302|2.751443|3.913709|3.486726|6.198921|4.214883|7.585827|4.747866|8.806178|3.529912|3.313410|2.665874|2.369149|2.437545|2.898787|2.812772|2.357000|2.087597|2.114399|8.823348|6.894487|17.548021|7.146624|0.042599|0.045903|0.045359|0.052945|0.064117|0.057582|0.049223|0.053282|0.045120|0.059545|0.060294|0.080187|0.079815|0.100835|0.120424|0.102733|0.069503|0.058249|0.087549|0.062665|0.052212|0.053209|0.170459|0.207689|0.140972|0.301310|0.500000| |1.779347|1.978839|2.092004|2.295341|2.374330|2.215565|2.033895|2.530640|0.072433|2.166641|1.912352|1.731269|12.548085|2.084221|2.277698|2.768921|4.014670|3.669762|6.559224|4.618410|9.382042|6.896375|14.401059|4.688333|4.303626|3.290460|2.872837|2.969603|3.644608|3.437676|2.779281|2.442180|2.501704|8.735888|6.836274|17.659059|5.542089|0.045389|0.050031|0.048592|0.055691|0.065470|0.061211|0.053184|0.052376|0.044132|0.061542|0.060160|0.082642|0.077143|0.115050|0.121723|0.134357|0.083851|0.069052|0.106997|0.072308|0.059993|0.062097|0.203785|0.169483|0.140025|0.300571|0.301750|0.500000| |2.064924|2.436403|2.709541|3.292304|3.545428|2.996693|2.541287|4.444123|0.139351|3.634865|3.070667|2.657354|18.923188|3.339491|3.534381|4.836440|7.299388|6.874771|11.505448|7.070975|9.272407|4.647212|7.182359|3.682755|3.280923|2.695281|2.485050|2.643621|3.183085|3.212122|2.698086|2.343712|2.326751|8.681954|6.935875|5.523748|17.576752|0.053082|0.055700|0.055853|0.070197|0.098804|0.082412|0.063691|0.083184|0.065572|0.087468|0.090670|0.128514|0.151862|0.141001|0.222704|0.094943|0.068673|0.060989|0.101673|0.072478|0.058523|0.057921|0.140551|0.175838|0.206491|0.141825|0.143834|0.122533|0.500000| |1.777689|2.033907|2.231998|2.591211|2.701658|2.373111|2.090715|3.163264|0.096611|2.736328|2.420105|2.163467|15.434401|2.581458|2.727354|3.453847|4.937451|4.379875|7.695903|4.912998|7.577114|4.153172|6.944921|3.231081|2.970198|2.448558|2.229489|2.329214|2.760102|2.756268|2.342371|2.060276|2.056404|8.919632|7.179602|7.106683|17.585996|0.045930|0.048366|0.048589|0.059185|0.077393|0.065361|0.053380|0.066304|0.054744|0.069210|0.072403|0.095818|0.106305|0.108585|0.151866|0.088728|0.063522|0.055189|0.086603|0.063175|0.051868|0.051734|0.145623|0.223518|0.174385|0.172766|0.219195|0.144520|0.303600|0.500000| |1.822842|2.102823|2.256819|2.632371|2.875409|2.579857|2.226626|3.456850|0.100559|3.008022|2.558386|2.308671|17.135905|2.944688|3.287607|4.399302|5.861918|5.159434|8.052977|6.734570|9.265133|4.653183|7.150997|3.736097|3.566027|2.878293|2.543235|2.594335|3.058408|2.910842|2.439941|2.182709|2.234065|8.674320|5.516103|7.031326|17.557127|0.047269|0.049925|0.049023|0.058568|0.076145|0.073135|0.057317|0.068026|0.057565|0.082556|0.088302|0.128346|0.138388|0.144546|0.251598|0.110155|0.075061|0.062402|0.088754|0.064200|0.054396|0.056295|0.122595|0.144842|0.140662|0.211064|0.178160|0.141769|0.299321|0.303533|0.500000| 1847.066742 -12638.351549 5017.584758 -227.530136 -6001.230185 4152.524158 -1848.706028 2.000888 40B3B00000000031 45318507E177B00E 44B0FD1EEA267C2D 4274ACC94D6FFFFC 37FE7D42A4998E00 44A6D4BB12086041