Version2.0 2020-07-31T00:06:35Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 25-Jul-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE c1cc(cc(c1)S(=O)(=O)N2CCCC2)NC(=O)c3ccc4c(c3)NC(=O)CS4 C12696821 RHF 6-31G(d) (6D,7F) c1cc(cc(c1)S(=O)(=O)N2CCCC2)NC(=O)c3ccc4c(c3)NC(=O)CS4 C01[X(C19H19N3O4S2)] 135 C1 466 O=C1CSc2c(N1)cc(cc2)C(=O)Nc1cccc(c1)S(=O)(=O)N1CCCC1 O=C1CSc2c(N1)cc(cc2)C(=O)Nc1cccc(c1)S(=O)(=O)N1CCCC1 O=C1CSc2ccc(cc2N1)C(=O)Nc3cccc(c3)[S](=O)(=O)N4CCCC4 InChIKey=FDHVUWQGRBXSPB-UHFFFAOYSA-N InChI=1S/C19H19N3O4S2/c23-18-12-27-17-7-6-13(10-16(17)21-18)19(24)20-14-4-3-5-15(11-14)28(25,26)22-8-1-2-9-22/h3-7,10-11H,1-2,8-9,12H2,(H,20,24)(H,21,23) InChI=1/C19H19N3O4S2/c23-18-12-27-17-7-6-13(10-16(17)21-18)19(24)20-14-4-3-5-15(11-14)28(25,26)22-8-1-2-9-22/h3-7,10-11H,1-2,8-9,12H2,(H,20,24)(H,21,23)/f/h20-21H c1cc(cc(c1)S(=O)(=O)N2CCCC2)NC(=O)c3ccc4c(c3)NC(=O)CS4 C01[X(C19H19N3O4S2)] 135 C01 466 O=C1CSc2c(N1)cc(cc2)C(=O)Nc1cccc(c1)S(=O)(=O)N1CCCC1 O=C1CS[C]2[C]([CH][C]([CH][CH]2)C(=O)N[C]2[CH][CH][CH][C]([CH]2)S(=O)(=O)N2CCCC2)N1 O=C1CS[C]2[CH][CH][C]([CH][C]2N1)C(=O)N[C]3[CH][CH][CH][C]([CH]3)[S](=O)(=O)N4CCCC4 InChIKey=FDHVUWQGRBXSPB-UHFFFAOYSA-N InChI=1S/C19H19N3O4S2/c23-18-12-27-17-7-6-13(10-16(17)21-18)19(24)20-14-4-3-5-15(11-14)28(25,26)22-8-1-2-9-22/h3-7,10-11H,1-2,8-9,12H2,(H,20,24)(H,21,23) InChI=1/C19H19N3O4S2/c23-18-12-27-17-7-6-13(10-16(17)21-18)19(24)20-14-4-3-5-15(11-14)28(25,26)22-8-1-2-9-22/h3-7,10-11H,1-2,8-9,12H2,(H,20,24)(H,21,23)/f/h20-21H 2786.5288181450 -1988.3548365 1-A 21587.1425 109 357 466 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -92.20576 -91.97489 -20.55331 -20.55080 -20.54897 -20.54816 -15.62554 -15.62060 -15.59530 -11.38161 -11.37746 -11.31871 -11.30907 -11.29756 -11.28759 -11.27694 -11.27677 -11.27553 -11.27475 -11.27070 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574.8342 582.3269 590.0086 598.4290 621.0060 636.8546 648.9945 668.2362 698.1347 699.0758 744.4075 760.3190 767.6768 797.1985 813.0247 835.8169 848.0163 872.5268 908.1812 927.6754 931.1033 936.7959 957.4849 968.9490 976.9300 981.3454 1013.4177 1020.2747 1023.3296 1030.5374 1058.0709 1062.5965 1072.3382 1084.5645 1085.9873 1104.1968 1132.2852 1177.0045 1187.6231 1202.2413 1218.4893 1223.8752 1235.1778 1254.6390 1261.1524 1273.1945 1283.4818 1291.3739 1302.5213 1322.2387 1322.8270 1344.3533 1345.2537 1380.2696 1395.8384 1397.4894 1401.6350 1409.6964 1431.6457 1460.7411 1462.8095 1473.4741 1473.6960 1493.4669 1513.2407 1529.5447 1533.5105 1571.4371 1597.4888 1636.1662 1643.7092 1647.3656 1657.9313 1674.2060 1680.5506 1686.6456 1731.2491 1765.0393 1792.3914 1803.3803 1809.7153 1952.9197 1995.1071 3194.2970 3223.5803 3232.9488 3243.4590 3250.3051 3274.0383 3284.5040 3298.1691 3329.3183 3342.9970 3374.6697 3379.3703 3391.4775 3392.5786 3399.6193 3414.7468 3470.1838 3850.2088 3892.8108 6.6329 5.5617 6.8909 5.7650 3.7090 4.3012 5.0601 7.8335 2.6434 4.9264 7.0099 3.9001 4.2006 7.9729 6.1389 5.6582 6.8976 1.9288 4.7944 4.9876 7.0211 6.1485 7.9416 8.8257 7.2724 5.2888 5.9948 5.1816 6.6417 3.5004 3.7719 5.4606 4.3383 6.7962 1.4014 1.4165 4.5323 1.9782 6.8665 6.8759 5.3114 2.9269 5.1343 6.6397 4.5165 2.9802 4.9189 5.5787 2.7886 3.7194 4.4463 1.3832 3.3013 2.0941 1.7768 1.9812 3.9816 5.2763 2.4445 1.5802 1.4665 1.9504 1.5534 1.3614 1.4518 3.5883 2.8936 1.7783 2.3471 1.3315 6.1102 2.7336 2.0258 2.5262 1.9826 3.7045 2.5942 2.0676 2.9908 1.4001 2.3230 1.8400 1.6611 1.5329 2.3969 1.6133 1.2103 1.3805 1.8064 1.7915 1.5969 2.0341 1.6583 1.3712 4.0383 4.8271 1.3592 1.4170 2.1482 1.4117 2.7714 1.0933 1.0947 2.8786 1.1052 2.3772 1.0920 2.2397 1.1015 2.0851 6.8682 4.1619 5.1398 5.1734 9.3599 8.9697 1.0733 1.0679 1.0638 1.0637 1.0669 1.0994 1.1052 1.1060 1.0952 1.1005 1.0892 1.0912 1.0922 1.0961 1.0926 1.0948 1.0937 1.0779 1.0779 0.0003 0.0008 0.0035 0.0054 0.0050 0.0098 0.0148 0.0380 0.0156 0.0300 0.0775 0.0530 0.0647 0.1641 0.1621 0.1734 0.2244 0.0786 0.2323 0.2657 0.4370 0.3847 0.5688 0.7273 0.6358 0.5157 0.6864 0.6197 0.8622 0.5076 0.5781 0.9461 0.7712 1.3231 0.2800 0.2905 0.9563 0.4495 1.6408 1.7063 1.3974 0.8405 1.4784 2.1678 1.5383 1.0348 1.8419 2.1727 1.1478 1.5759 1.9944 0.6722 1.6739 1.0697 0.9187 1.0702 2.2025 2.9669 1.3870 0.9562 0.8994 1.2034 0.9720 0.8980 0.9658 2.4311 2.0054 1.2356 1.6860 1.0058 4.9872 2.2716 1.7252 2.2099 1.7497 3.3300 2.4059 1.9375 2.8564 1.3589 2.2825 1.8393 1.7111 1.5804 2.5522 1.7202 1.3585 1.5847 2.0786 2.0737 1.8698 2.4564 2.0848 1.7287 5.1658 6.1766 1.7862 1.9118 2.9611 1.9559 4.0322 1.6438 1.7266 4.5822 1.7671 3.8499 1.8034 3.7269 1.8462 3.6822 12.6068 7.8779 9.8484 9.9827 21.0325 21.0359 6.4526 6.5383 6.5512 6.5927 6.6410 6.9434 7.0246 7.0885 7.1523 7.2460 7.3087 7.3423 7.4015 7.4328 7.4402 7.5213 7.7595 9.4146 9.6237 2.1556 1.1725 0.8768 2.0085 0.8803 1.1019 2.2122 3.3057 1.7427 0.3622 4.7497 6.1028 3.2770 2.4877 1.8730 1.2480 5.4526 0.1336 0.2409 3.8807 5.1414 2.3711 3.1409 10.8241 9.7101 2.4500 2.8116 0.9418 6.1313 1.9298 5.9190 11.2324 13.5479 18.7028 35.8477 121.5964 5.3017 16.1087 7.7410 168.0850 16.5192 108.3631 54.4087 9.8581 18.6736 58.2702 10.0740 6.0459 87.6931 47.9165 35.6861 31.5902 1.9950 2.6689 13.0421 3.7733 6.1844 58.0325 4.0073 3.7038 12.5298 12.5047 17.3461 4.1312 2.4284 5.5466 6.8691 4.0668 46.4856 1.5848 12.3540 67.9160 86.9625 8.3718 83.7388 46.9479 68.8801 57.1014 185.2160 14.6901 26.8433 15.5357 35.0772 13.5106 47.2785 63.3264 7.5699 23.0543 109.9052 3.1432 14.2567 279.9691 310.4416 3.1037 227.5494 198.4622 0.4855 1.7204 4.1541 16.3468 63.3999 15.6010 3.0601 242.7284 2.4592 201.9149 0.9716 3.4523 3.0096 690.2248 36.7099 21.1392 143.8208 19.2384 251.4533 750.2876 36.7162 19.4106 36.4698 39.3206 11.3428 20.6314 22.8303 68.3404 18.7244 0.3644 9.0089 14.4293 4.1773 10.2085 1.3803 1.6469 4.6128 58.6299 30.0389 2.1749 0.3917 1.2400 0.4494 1.8703 0.2401 2.4248 0.8576 0.6069 2.0698 1.0851 1.6005 3.4737 1.4783 0.3231 3.4951 1.1296 0.4007 2.5884 3.3574 2.1443 0.3290 1.4218 2.1108 3.8030 2.3246 1.0421 3.9598 3.3318 0.2427 0.9722 1.8532 2.2866 2.6566 1.5481 1.8875 1.3651 0.4459 1.6330 4.5253 7.2831 1.8440 0.6311 9.4687 8.4221 3.6687 0.5995 1.5569 4.0876 4.2814 9.4673 2.1690 5.5546 2.1147 2.7214 3.0370 5.4366 2.0142 9.7074 1.4133 2.7739 2.6042 3.0370 1.3658 1.8307 1.7269 44.6853 14.6765 9.2145 0.8281 41.4978 5.7339 6.9028 5.3854 2.6637 8.4186 3.6378 0.9657 7.3829 10.0045 0.3530 2.1098 5.3977 4.9001 8.7272 6.2746 8.3602 39.2689 16.8326 5.4254 20.2953 104.7800 14.2566 0.8889 5.2594 2.8558 1.0007 3.4353 0.8884 2.9114 7.0138 12.1604 18.9859 44.9851 10.5052 11.1746 1.3712 6.8756 9.2853 46.1674 6.4791 55.3360 80.5160 208.0006 131.4699 34.4015 45.2727 46.9326 90.6339 116.2932 91.7860 98.4497 93.1174 82.2143 74.8105 133.2388 52.7764 100.4584 33.7164 106.0036 59.0503 94.5072 56.9758 62.0591 59.0803 0.7497 0.7415 0.6619 0.7396 0.7499 0.6664 0.7249 0.7129 0.7175 0.7303 0.5852 0.5985 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7 6 8 6 16 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 31.97207 15.99491 15.99491 14.00307 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 14.00307 12.00000 15.99491 12.00000 31.97207 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 4416.4343 36902.7117 38812.0719 0.99996 0.00397 -0.00824 -0.00405 0.99994 -0.01019 0.00820 0.01022 0.99991 1 0.01961 0.00235 0.00223 0.40864 0.04891 0.04650 12.33 22.27 42.39 57.54 68.56 89.41 101.40 130.47 143.81 146.23 197.07 218.44 232.64 268.90 304.59 328.15 338.10 378.39 412.64 432.62 467.66 468.83 501.63 538.10 554.25 585.30 634.28 648.24 675.37 713.79 733.83 780.22 790.30 827.06 837.84 848.89 861.01 893.49 916.29 933.76 961.44 1004.46 1005.81 1071.04 1093.93 1104.52 1146.99 1169.76 1202.55 1220.11 1255.37 1306.67 1334.72 1339.65 1347.84 1377.61 1394.10 1405.58 1411.94 1458.08 1467.95 1472.34 1482.71 1522.33 1528.84 1542.86 1560.45 1562.49 1588.69 1629.11 1693.45 1708.72 1729.76 1753.13 1760.88 1777.15 1805.15 1814.52 1831.84 1846.64 1858.00 1874.04 1902.41 1903.25 1934.22 1935.52 1985.90 2008.30 2010.68 2016.64 2028.24 2059.82 2101.68 2104.66 2120.00 2120.32 2148.77 2177.22 2200.67 2206.38 2260.95 2298.43 2354.08 2364.93 2370.19 2385.39 2408.81 2417.94 2426.71 2490.88 2539.50 2578.85 2594.66 2603.78 2809.82 2870.51 4595.88 4638.01 4651.49 4666.61 4676.46 4710.61 4725.67 4745.33 4790.15 4809.83 4855.40 4862.16 4879.58 4881.16 4891.29 4913.06 4992.82 5539.59 5600.89 0.393833 0.417096 0.418041 0.336343 -1987.961003 -1987.937740 -1987.936796 -1988.018494 2.740164D-04 MUNgauss RevisionA2.0 retrievium 31-Jul-2020 DUDE c1cc(cc(c1)S(=O)(=O)N2CCCC2)NC(=O)c3ccc4c(c3)NC(=O)CS4 C12696821 RHF 6-31G(d) (6D,10F) C1 417.081700 |X|Y|Z| 43.107124 28.673433 137.501761 55.391824 24 6 7 16 19 3 2 |36.858105| |13.740254|36.858105| |7.937945|13.697108|36.858105| |6.911073|7.933522|13.692156|36.858105| |8.013820|6.887371|7.927070|13.783169|36.858105| |13.782477|7.883209|6.811760|7.900599|13.737469|36.858105| |4.737026|4.193207|4.723505|6.976491|10.716974|6.940010|388.023441| |4.397126|3.688690|3.849301|5.017929|7.362640|6.411106|94.779570|73.516695| |3.849648|3.706593|4.452580|6.578416|7.371968|4.956946|94.672434|13.564203|73.516695| |4.075385|3.645499|3.992646|5.336694|6.982023|5.491561|83.660957|13.807341|13.816732|53.358707| |3.895014|3.338739|3.416706|4.169834|5.417615|5.110246|50.044516|11.587865|8.858152|17.705364|36.858105| |3.122411|2.816265|2.918806|3.433969|4.026992|3.762266|34.796551|7.851295|7.207025|11.181793|12.481156|36.858105| |3.191361|3.011883|3.245481|3.852716|4.238603|3.743978|34.760229|7.094117|7.708257|11.014718|7.956335|12.436674|36.858105| |3.541369|3.387545|3.852895|4.988710|5.487188|4.333807|50.191958|8.846858|11.601320|17.646448|7.789003|7.872796|12.412561|36.858105| |5.121494|7.701599|13.525910|8.001628|5.205465|4.532752|26.549108|5.511496|6.739097|4.477111|2.831984|2.533038|2.865876|3.349844|53.358707| |4.308217|6.264251|7.630481|5.161562|3.898563|3.661694|21.096847|4.573133|5.304416|3.667588|2.407448|2.196274|2.452360|2.750257|19.041808|36.858105| |4.504133|6.605838|6.536782|4.454513|3.615729|3.614708|19.503850|4.347083|4.759205|3.419464|2.308435|2.098906|2.299851|2.517037|11.459593|15.887473|73.516695| |3.232569|4.211387|5.028319|3.999918|3.135577|2.898000|18.204893|3.971815|4.727436|3.218304|2.111327|1.972100|2.214441|2.468057|10.715409|12.666524|14.377972|36.858105| |2.890650|3.599988|4.440740|3.853079|3.016650|2.702925|18.214862|3.912504|4.864835|3.272390|2.116640|2.011006|2.301124|2.584829|8.904439|7.466916|9.445347|13.711394|36.858105| |2.392064|2.862614|3.367045|3.044682|2.495040|2.264284|15.637674|3.420141|4.200718|2.838801|1.857293|1.788174|2.028313|2.244879|6.069130|5.007033|7.165276|7.945580|13.780439|36.858105| |2.199358|2.609473|2.946912|2.633946|2.214374|2.057302|13.891232|3.100704|3.681562|2.513816|1.670641|1.604534|1.788725|1.953718|5.127288|4.446352|6.813103|6.846604|7.913559|13.746552|36.858105| |2.339140|2.816389|3.100226|2.678240|2.259336|2.139099|13.880562|3.128673|3.618675|2.488262|1.667702|1.584329|1.746835|1.901237|5.410686|5.073220|8.126011|7.906213|6.850234|7.932031|13.660953|36.858105| |2.802332|3.515620|3.885996|3.186370|2.628777|2.500300|15.609405|3.496340|4.023713|2.767633|1.849253|1.734147|1.913342|2.096696|7.167168|7.740382|12.106398|13.748872|7.943841|6.902892|7.931130|13.748095|36.858105| |2.085817|2.453445|2.611739|2.284826|1.980453|1.906427|12.307908|2.820014|3.183172|2.212461|1.501451|1.428936|1.556062|1.675322|4.321110|3.918722|6.737237|5.177422|4.558350|5.163516|7.833515|13.619227|7.924370|53.358707| |1.828452|2.103913|2.236905|2.008282|1.765420|1.696206|11.193265|2.581890|2.911719|2.018767|1.373192|1.314234|1.424916|1.529659|3.603846|3.106110|5.319328|3.912318|3.701976|4.362202|6.366722|7.675777|5.177760|18.987123|36.858105| |1.695255|1.926223|2.014030|1.816770|1.620044|1.571935|10.323149|2.403841|2.668082|1.865726|1.279167|1.224956|1.317969|1.405568|3.168917|2.698981|4.737943|3.232094|3.030607|3.431798|4.564129|5.363982|4.128510|11.596338|15.962056|73.516695| |1.750563|2.000459|2.169117|1.989010|1.743161|1.650594|11.221043|2.574536|2.960684|2.027131|1.368399|1.316671|1.434891|1.548815|3.500963|2.912127|4.821629|3.713359|3.796224|4.817890|7.079647|6.580160|4.505372|10.617435|12.587141|14.249019|36.858105| |1.826734|2.100477|2.320785|2.138173|1.851579|1.731962|11.939974|2.699696|3.168446|2.183786|1.465146|1.422809|1.574179|1.698674|3.813078|3.147156|5.055520|4.185238|4.716613|6.933346|10.762522|6.939130|4.723721|8.594931|6.885362|8.899605|10.529462|388.023441| |17.724902|8.967360|5.657292|4.972447|5.678532|8.946564|27.795609|6.820371|5.730204|4.763418|3.515062|2.870640|2.863080|3.059436|5.647325|3.743566|7.260996|2.890586|2.572012|2.172534|2.032608|2.179472|2.586218|2.692633|1.741545|2.899033|1.653698|12.158738|0.500000| |8.921738|17.834445|8.916103|5.649950|4.968620|5.635054|24.142175|5.461120|5.483186|4.147456|2.857429|2.482303|2.647136|2.894485|9.504649|6.848908|15.247700|4.456866|3.626378|2.902532|2.707753|3.006583|3.842270|3.594998|2.231539|3.643987|2.081062|15.401206|0.216535|0.500000| |4.973776|5.634814|8.869281|17.736447|8.967368|5.644054|47.731215|8.305234|13.712643|7.122565|3.909253|3.347424|3.865501|5.257807|10.013360|4.824995|7.102534|4.032962|4.118948|3.263375|2.753354|2.725455|3.174440|3.132450|2.040292|3.258203|2.057169|15.920140|0.107890|0.123942|0.500000| |8.886060|5.618135|4.924094|5.633063|8.898243|17.760640|46.984304|12.892568|8.096250|7.435551|5.592056|3.927003|3.664733|4.092831|4.916107|3.042375|5.400096|2.492330|2.347770|2.010096|1.843983|1.911251|2.196693|2.349364|1.551712|2.575752|1.512102|11.224370|0.214340|0.123938|0.124329|0.500000| |4.586644|3.770775|3.702223|4.369391|5.794229|6.040089|44.419914|10.435541|7.845976|12.233003|17.511672|8.793003|6.757282|6.346714|4.073399|2.556872|4.425835|2.200594|2.172264|1.890733|1.708136|1.721622|1.927395|2.110987|1.409310|2.336287|1.392812|10.582899|0.115987|0.089074|0.108490|0.187934|0.500000| |3.583820|3.035001|3.061924|3.682815|4.797241|4.692678|46.184339|12.896918|8.283587|12.359776|17.660571|8.675622|5.693862|5.771966|3.485448|2.203221|3.781795|1.944739|1.939688|1.718442|1.560164|1.562436|1.724463|1.929727|1.303447|2.168233|1.298546|9.799785|0.091965|0.072962|0.096346|0.151423|0.300410|0.500000| |2.953834|2.652764|2.680396|3.039546|3.513163|3.444163|28.294359|6.656766|5.933275|7.917389|8.730859|17.585254|8.676970|5.638593|3.189297|2.070810|3.566232|1.861403|1.884871|1.685337|1.524728|1.512122|1.652024|1.868179|1.263329|2.101976|1.259854|9.659976|0.077336|0.066024|0.081136|0.101062|0.218204|0.194892|0.500000| |2.737301|2.495915|2.607689|3.068205|3.542568|3.273130|32.047263|7.484048|6.972923|9.512749|8.865174|17.560358|8.802632|6.761917|3.134918|2.009261|3.402473|1.829868|1.877883|1.688926|1.519669|1.493582|1.620487|1.840983|1.252604|2.079332|1.261408|9.670409|0.070333|0.061641|0.084975|0.095380|0.174273|0.219303|0.301214|0.500000| |3.437187|3.267239|3.467333|3.973603|4.284016|3.907875|31.648596|6.516223|6.922219|8.978701|6.829820|8.835034|17.552156|8.818088|4.149972|2.626745|4.413563|2.344563|2.417556|2.111436|1.861821|1.827794|2.016779|2.210780|1.477125|2.427059|1.477593|11.567982|0.085840|0.080117|0.107519|0.104272|0.189579|0.137928|0.217805|0.174022|0.500000| |2.724506|2.625985|2.842259|3.295641|3.488469|3.103417|28.376171|5.960948|6.704229|7.963657|5.673369|8.671232|17.588685|8.719482|3.532793|2.258847|3.755596|2.085594|2.197842|1.967686|1.734355|1.677336|1.814137|2.039123|1.380944|2.272130|1.399251|10.979473|0.068761|0.065342|0.094118|0.084340|0.136996|0.125849|0.195958|0.216255|0.302111|0.500000| |3.041068|2.953954|3.384988|4.318849|4.577575|3.645851|43.908810|8.116106|11.805667|12.376618|6.018263|6.395719|8.696570|17.616526|4.153307|2.534599|4.096776|2.331807|2.480328|2.190887|1.904396|1.833930|1.995719|2.204748|1.491835|2.436855|1.524870|11.906247|0.073955|0.071285|0.132877|0.096758|0.135142|0.138624|0.132237|0.176709|0.175099|0.220184|0.500000| |3.855209|3.854306|4.610577|6.108059|6.071359|4.577891|47.115189|8.061396|11.549987|12.209189|5.982663|5.755972|8.727415|17.581316|5.483749|3.208502|5.108373|2.854659|3.021389|2.564390|2.192618|2.125699|2.367453|2.513252|1.670984|2.708864|1.692229|13.331390|0.090282|0.090483|0.184982|0.113565|0.153254|0.129003|0.127664|0.137361|0.225243|0.191208|0.301931|0.500000| |4.299297|5.750056|9.365593|7.707557|4.948916|4.082480|26.967810|5.493833|7.247662|4.522463|2.788429|2.522086|2.889193|3.462797|26.096670|9.476193|10.904751|7.646979|7.498154|4.974297|3.991431|4.010348|5.049187|4.291694|2.673280|4.138906|2.670011|21.025644|0.098318|0.143299|0.235584|0.092594|0.079892|0.070160|0.064079|0.064460|0.083775|0.073535|0.089689|0.116960|0.500000| |3.047301|3.767407|4.867321|4.396555|3.350815|2.913303|20.323236|4.257661|5.502284|3.684356|2.339077|2.231461|2.609348|2.981344|9.658670|6.799197|8.630815|8.846989|17.732612|8.980513|5.652781|4.942339|5.634593|4.936684|3.072592|4.608076|3.185600|27.831767|0.074058|0.101572|0.135767|0.069794|0.066280|0.058861|0.057535|0.057674|0.076144|0.069195|0.079398|0.099367|0.248046|0.500000| |2.209934|2.586006|3.039323|2.850779|2.367592|2.130707|15.226871|3.322173|4.139677|2.796889|1.824122|1.777081|2.028869|2.243345|5.247145|4.071164|5.974655|5.649652|8.933819|17.730596|8.950508|5.648591|4.968550|5.691262|3.786404|5.451142|4.387817|47.164770|0.055815|0.071721|0.086409|0.052993|0.051105|0.046872|0.046418|0.046923|0.058241|0.055322|0.061610|0.070933|0.121426|0.217106|0.500000| |2.889149|3.629676|3.815067|3.073727|2.586906|2.522269|15.205857|3.454487|3.857228|2.683390|1.813502|1.688337|1.839503|2.001822|6.669281|7.285616|13.571879|8.964076|5.659447|4.969579|5.639190|8.912789|17.742712|9.866401|4.824057|7.250042|3.974564|27.746895|0.075287|0.114425|0.082874|0.061746|0.052898|0.047224|0.044914|0.043749|0.053970|0.048193|0.052637|0.062190|0.124333|0.124075|0.107823|0.500000| |2.121019|2.494112|2.593848|2.243485|1.961997|1.915348|12.101542|2.792046|3.095048|2.174387|1.486837|1.409968|1.525801|1.633874|4.219692|3.885623|7.016005|4.815828|4.040274|4.281982|5.773627|9.233930|7.374073|25.997319|9.553770|14.090311|5.722583|34.022808|0.056442|0.075882|0.061856|0.048257|0.042905|0.039071|0.037774|0.036981|0.044393|0.040652|0.043645|0.049844|0.083490|0.091663|0.098272|0.220879|0.500000| 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