Version2.1 2021-01-07T03:40:43Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 02-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCOC(=O)c1c(c(sc1NC(=O)CSc2nnc(n2N)c3ccco3)c4ccccc4)C C11670212 RHF 6-31G(d) (6D,7F) CCOC(=O)c1c(c(sc1NC(=O)CSc2nnc(n2N)c3ccco3)c4ccccc4)C C01[X(C22H21N5O4S2)] 156 C1 545 CCOC(=O)c1c(NC(=O)CSc2nnc(n2N)c2ccco2)sc(c1C)c1ccccc1 CCOC(=O)c1c(NC(=O)CSc2nnc(n2N)c2ccco2)sc(c1C)c1ccccc1 CCOC(=O)c1c(C)c(sc1NC(=O)CSc2nnc(n2N)c3occc3)c4ccccc4 InChIKey=XGQXVSOVECYQMY-UHFFFAOYSA-N InChI=1S/C22H21N5O4S2/c1-3-30-21(29)17-13(2)18(14-8-5-4-6-9-14)33-20(17)24-16(28)12-32-22-26-25-19(27(22)23)15-10-7-11-31-15/h4-11H,3,12,23H2,1-2H3,(H,24,28) InChI=1/C22H21N5O4S2/c1-3-30-21(29)17-13(2)18(14-8-5-4-6-9-14)33-20(17)24-16(28)12-32-22-26-25-19(27(22)23)15-10-7-11-31-15/h4-11H,3,12,23H2,1-2H3,(H,24,28)/f/h24H CCOC(=O)c1c(c(sc1NC(=O)CSc2nnc(n2N)c3ccco3)c4ccccc4)C C01[X(C22H21N5O4S2)] 156 C01 545 CCOC(=O)c1c(NC(=O)CSc2nnc(n2N)c2ccco2)sc(c1C)c1ccccc1 CCOC(=O)[C]1[C](=C(S[C]1NC(=O)CS[C]1[N][N][C](N1N)C1=[CH][CH]=CO1)[C]1[CH][CH][CH][CH][CH]1)C CCOC(=O)[C]1[C](NC(=O)CS[C]2[N][N][C](N2N)c3occc3)SC(=C1C)[C]4[CH][CH][CH][CH][CH]4 InChIKey=XGQXVSOVECYQMY-UHFFFAOYSA-N InChI=1S/C22H21N5O4S2/c1-3-30-21(29)17-13(2)18(14-8-5-4-6-9-14)33-20(17)24-16(28)12-32-22-26-25-19(27(22)23)15-10-7-11-31-15/h4-11H,3,12,23H2,1-2H3,(H,24,28) InChI=1/C22H21N5O4S2/c1-3-30-21(29)17-13(2)18(14-8-5-4-6-9-14)33-20(17)24-16(28)12-32-22-26-25-19(27(22)23)15-10-7-11-31-15/h4-11H,3,12,23H2,1-2H3,(H,24,28)/f/h24H 3404.6513434091 -2211.9950392 1-A 31051.7654 126 419 545 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -91.97692 -91.97681 -20.63451 -20.61424 -20.56121 -20.55470 -15.66688 -15.62332 -15.62056 -15.57791 -15.57698 -11.39324 -11.38320 -11.33642 -11.33111 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1.5655 1.9274 1.2044 5.8013 1.5053 2.7600 2.1211 2.1203 1.9815 4.0979 2.3519 1.5340 1.1175 1.1540 2.2629 1.5844 3.9036 2.1466 7.5839 9.1832 1.3056 4.7980 1.5866 1.7494 2.3872 7.1650 3.8460 3.7463 2.2007 1.8941 2.6978 2.2667 11.7622 2.7638 3.2506 1.6300 1.7538 1.6646 1.6811 3.5192 1.8292 10.7337 13.2601 4.3219 10.9055 9.3658 10.8362 10.6907 8.3300 2.5970 22.1667 22.3903 6.3158 6.3898 6.6867 6.6760 7.0286 6.9800 7.0317 7.1601 7.2234 7.1996 7.2120 7.2711 7.3381 7.3912 7.4455 7.6353 7.7712 7.9131 8.6299 9.0699 9.5822 0.9004 1.7474 0.5895 0.0147 0.0723 0.0795 2.4995 1.2312 1.3246 0.4014 0.5365 3.3572 0.3235 11.7045 2.1739 0.1226 0.8094 15.8609 2.6585 2.1120 1.2304 0.3122 0.1846 0.6247 1.7285 3.5183 1.1845 7.5526 8.8892 19.8724 16.6620 16.4452 4.8951 7.8321 7.6924 3.6045 2.9183 9.9984 0.0128 1.0709 22.2909 3.7609 7.4523 19.8566 11.4965 23.3654 13.9645 0.1242 2.3161 0.5284 0.5913 11.0997 3.6451 4.2327 72.6655 50.0975 1.5547 16.0491 10.7431 21.2799 26.1469 59.9108 24.3672 33.5608 16.1053 0.0213 18.3560 8.0319 9.5069 0.8745 28.8981 206.4084 7.2287 8.5762 2.2727 4.1188 1.3164 88.7718 22.9525 0.0260 42.9554 6.4169 0.3886 0.4204 23.1058 0.6606 7.1980 13.3422 64.3737 13.8392 1.6038 22.6543 12.6242 143.8152 5.5063 0.2011 1.0480 2.0970 2.5004 170.3628 14.5008 948.3965 16.0463 1.3590 195.5301 7.9748 10.3688 175.8898 17.6039 185.8085 1.9587 52.7072 7.8536 38.8530 48.0622 59.8879 71.1548 70.1668 4.0393 38.0884 5.3357 1.0664 8.2076 9.4878 96.6601 77.0758 1048.7463 4.4005 88.3983 42.7242 21.1588 2.2412 54.8890 380.0487 144.3628 21.4437 35.0501 8.5066 17.3939 8.0372 55.3174 19.8648 26.3817 46.4753 0.0056 1.8377 3.0431 28.5070 35.6218 20.4603 6.6899 0.2830 2.9852 7.8095 187.8391 17.4966 0.6432 2.5097 0.8941 5.0025 2.4783 3.7531 4.6602 4.6345 1.0253 0.6065 0.8239 1.2816 0.3249 0.2964 1.3001 1.9886 0.8110 1.3472 0.4753 1.0264 0.7388 0.8482 1.0708 0.7284 2.4562 1.0469 0.3614 2.6796 1.4566 2.3486 0.8259 1.7246 2.2999 0.4682 1.9028 1.0449 2.1149 0.5878 0.9074 0.7340 2.0572 3.8891 12.1899 0.9507 2.0985 3.7913 1.8277 3.7536 1.8929 6.3577 3.1224 2.1702 1.3064 3.8976 3.3894 1.3550 5.1189 15.1358 5.3766 1.4602 1.6576 1.9822 0.7867 0.8245 29.3245 4.3836 6.3957 3.4810 7.7551 14.3648 3.6062 2.3125 5.5822 1.5031 3.7624 2.1545 42.1464 11.4454 8.8544 0.1093 17.6306 8.0170 0.3870 5.4845 5.3234 2.8451 35.1154 1.1099 7.1649 10.9961 8.5705 9.9913 17.1608 4.9001 1.0928 10.6251 3.9854 9.5039 1.0193 15.4588 5.4328 16.0762 7.6513 13.9661 42.2038 3.9812 4.3141 44.1497 2.5205 70.0436 26.8025 31.3165 14.1410 113.0656 41.5066 12.4717 96.2214 34.0323 20.2929 19.9363 15.1636 18.5879 5.1014 4.4328 330.5843 22.6809 214.2220 165.3086 21.5345 28.4436 210.4735 589.3792 102.6687 22.8852 41.8526 114.3750 144.7826 88.5917 57.4974 80.0054 98.0124 72.7136 65.1782 18.8086 29.8597 27.7134 123.3032 74.2863 12.2244 328.9703 122.3702 45.8999 149.1602 78.1939 75.0757 43.1480 0.7498 0.7496 0.7499 0.7285 0.7235 0.7148 0.6249 0.7283 0.7302 0.6420 0.6979 0.6681 0.7429 0.7319 0.2902 0.7011 0.6533 0.4164 0.7461 0.6147 0.2904 0.4346 0.5592 0.6921 0.3622 0.5534 0.6093 0.7368 0.6660 0.6190 0.7091 0.6168 0.2001 0.6706 0.3393 0.5198 0.7297 0.6660 0.4087 0.6155 0.3005 0.7045 0.2366 0.7444 0.2491 0.3763 0.6785 0.7236 0.6836 0.7456 0.6141 0.6368 0.3419 0.2018 0.1999 0.3144 0.2716 0.1034 0.6149 0.3962 0.1367 0.6188 0.7352 0.6944 0.3236 0.4801 0.6923 0.7039 0.7342 0.2120 0.1028 0.7450 0.7296 0.7500 0.2060 0.4402 0.1320 0.3099 0.3591 0.5685 0.4074 0.3881 0.4068 0.1270 0.7499 0.6487 0.4198 0.5646 0.4155 0.5479 0.7377 0.1212 0.4165 0.6867 0.7499 0.7486 0.2610 0.2251 0.4432 0.1523 0.2789 0.5578 0.6192 0.7499 0.6658 0.5627 0.5998 0.1494 0.7266 0.6452 0.6426 0.3653 0.7374 0.2237 0.2706 0.5700 0.1362 0.1111 0.7500 0.7371 0.7429 0.7425 0.2692 0.6231 0.2767 0.5168 0.2755 0.3347 0.4245 0.4770 0.4471 0.3133 0.4267 0.3614 0.2138 0.0383 0.0442 0.1947 0.0206 0.7456 0.5239 0.7230 0.7136 0.7500 0.7497 0.7253 0.7473 0.7249 0.6727 0.1125 0.5839 0.2521 0.1645 0.0769 0.1255 0.7499 0.8570 0.8569 0.8571 0.8429 0.8396 0.8337 0.7692 0.8428 0.8441 0.7820 0.8221 0.8011 0.8525 0.8452 0.4499 0.8243 0.7903 0.5879 0.8546 0.7614 0.4501 0.6059 0.7173 0.8180 0.5318 0.7125 0.7572 0.8484 0.7995 0.7647 0.8298 0.7630 0.3335 0.8028 0.5067 0.6841 0.8437 0.7995 0.5802 0.7620 0.4621 0.8266 0.3827 0.8535 0.3988 0.5468 0.8085 0.8396 0.8121 0.8543 0.7609 0.7781 0.5095 0.3359 0.3332 0.4784 0.4272 0.1874 0.7616 0.5675 0.2406 0.7645 0.8474 0.8197 0.4889 0.6487 0.8182 0.8262 0.8467 0.3499 0.1864 0.8539 0.8436 0.8571 0.3417 0.6113 0.2332 0.4732 0.5285 0.7249 0.5789 0.5592 0.5783 0.2254 0.8571 0.7869 0.5914 0.7217 0.5870 0.7079 0.8491 0.2162 0.5881 0.8143 0.8571 0.8562 0.4140 0.3675 0.6142 0.2643 0.4361 0.7161 0.7648 0.8571 0.7994 0.7201 0.7498 0.2599 0.8417 0.7844 0.7824 0.5352 0.8489 0.3656 0.4259 0.7261 0.2397 0.2000 0.8571 0.8487 0.8525 0.8523 0.4241 0.7678 0.4334 0.6815 0.4320 0.5016 0.5960 0.6459 0.6179 0.4772 0.5982 0.5309 0.3523 0.0738 0.0846 0.3260 0.0404 0.8543 0.6876 0.8392 0.8328 0.8571 0.8570 0.8408 0.8554 0.8405 0.8043 0.2022 0.7373 0.4027 0.2825 0.1427 0.2230 0.8571 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 6 6 8 6 8 6 6 6 16 6 7 6 8 6 16 6 7 7 6 7 7 6 6 6 6 8 6 6 6 6 6 6 6 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 15.99491 12.00000 15.99491 12.00000 12.00000 12.00000 31.97207 12.00000 14.00307 12.00000 15.99491 12.00000 31.97207 12.00000 14.00307 14.00307 12.00000 14.00307 14.00307 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 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 8146.5061 49617.1216 57113.3864 0.99999 0.00499 0.00077 -0.00499 0.99999 0.00104 -0.00077 -0.00104 1.00000 1 0.01063 0.00175 0.00152 0.22154 0.03637 0.03160 14.80 21.30 31.32 37.16 45.38 63.44 65.83 81.00 88.65 105.44 116.51 123.72 128.34 151.61 161.71 179.34 183.45 232.93 235.09 291.36 328.78 338.87 370.98 374.91 380.06 384.42 396.27 429.75 440.65 464.98 470.86 471.43 489.76 571.64 576.11 596.77 630.17 640.18 656.92 678.69 792.18 803.78 823.84 894.87 900.43 932.79 944.70 959.25 968.92 984.29 1040.83 1049.49 1112.97 1115.79 1129.75 1131.90 1141.17 1162.88 1167.03 1210.95 1234.90 1243.45 1258.20 1283.34 1293.46 1382.55 1384.57 1384.78 1401.42 1425.38 1440.11 1453.09 1458.69 1466.10 1476.23 1523.82 1567.78 1577.18 1586.12 1589.24 1592.05 1607.96 1622.36 1638.56 1671.19 1684.03 1693.84 1702.28 1703.71 1735.00 1749.01 1791.35 1799.19 1859.19 1866.82 1872.37 1874.05 1879.46 1912.21 1948.38 1985.17 2014.75 2027.17 2051.43 2079.23 2108.37 2117.77 2140.69 2163.20 2178.32 2229.29 2230.77 2266.10 2277.43 2292.90 2304.85 2310.12 2315.08 2345.52 2350.11 2358.27 2363.70 2398.75 2404.81 2420.61 2436.13 2505.83 2510.47 2549.41 2560.35 2607.06 2631.03 2684.00 2758.66 2846.60 4627.76 4651.27 4698.87 4704.73 4726.93 4727.16 4735.31 4776.83 4780.07 4780.30 4829.23 4841.67 4856.56 4867.74 4878.92 4954.20 4982.13 5013.03 5381.85 5431.97 5530.86 0.444229 0.473812 0.474756 0.377033 -2211.550810 -2211.521228 -2211.520283 -2211.618006 3.277645D-04 MUNgauss RevisionA2.0 retrievium 07-Jan-2021 DUDE CCOC(=O)c1c(c(sc1NC(=O)CSc2nnc(n2N)c3ccco3)c4ccccc4)C C11670212 RHF 6-31G(d) (6D,10F) C1 483.103498 |X|Y|Z| 66.856591 18.821944 161.949634 58.847708 25 6 7 8 16 18 4 1 2 |36.858105| |12.584995|36.858105| |8.036304|13.343715|73.516695| |5.280617|8.113387|25.734343|36.858105| |4.645943|7.265866|15.383778|15.822769|73.516695| |4.053908|5.187386|14.431753|12.936225|14.322100|36.858105| |3.841380|4.400304|11.668121|7.252926|9.108130|13.062642|36.858105| |3.022285|3.374865|8.029351|5.093108|7.230669|8.199396|14.149888|36.858105| |2.639460|3.051255|6.909640|4.786591|7.460219|7.407391|7.375574|10.902900|388.023441| |3.187100|3.959529|9.389143|7.722268|11.921604|13.896900|8.102331|7.680264|78.645650|36.858105| |2.928937|3.702680|8.032996|6.544746|12.640367|7.804971|5.178637|4.961281|49.615963|13.806715|53.358707| |2.425287|2.943488|6.072031|4.460826|8.613721|5.134810|3.979083|4.103516|43.153103|7.791993|19.038363|36.858105| |2.195691|2.585143|5.347039|3.756208|6.863148|4.522809|3.809108|4.209001|48.051802|6.700840|11.492305|15.946706|73.516695| |2.265336|2.747308|5.370708|3.807239|7.849084|3.946769|3.137118|3.129567|29.147334|5.098590|10.798781|12.568187|14.173511|36.858105| |1.865916|2.179277|4.199594|2.821245|5.532645|2.977416|2.539266|2.621746|24.077247|3.691134|6.528977|7.013147|11.868281|10.509931|388.023441| |1.772047|2.061459|3.843409|2.524704|5.063180|2.540931|2.177205|2.189246|18.931807|2.972914|5.104370|4.692752|7.533575|7.111107|77.171453|36.858105| |1.870906|2.197042|4.017824|2.633799|5.426852|2.561986|2.167152|2.131573|17.978792|2.922877|5.044948|4.329165|6.624983|6.598038|49.466420|14.868760|53.358707| |1.692633|1.952926|3.517202|2.247634|4.558811|2.174426|1.879995|1.849151|15.224844|2.418834|3.991281|3.306859|5.269726|4.481885|35.084399|8.920148|18.975634|53.358707| |1.546484|1.762528|3.203817|2.034693|4.039016|2.008067|1.764560|1.760727|14.568230|2.247585|3.642727|3.080011|5.099318|4.015054|35.246861|8.859945|12.084537|20.202784|36.858105| |1.575134|1.800037|3.330022|2.139590|4.210936|2.158103|1.895512|1.918040|16.263099|2.473805|4.053250|3.592092|6.073530|4.761870|49.749556|14.020800|11.954988|11.966338|13.950422|53.358707| |1.450483|1.637646|3.050829|1.943072|3.745521|1.994306|1.785740|1.834322|15.568924|2.287500|3.644003|3.237694|5.756340|3.965612|42.741845|7.710133|7.390055|7.411327|7.758280|18.773686|53.358707| |1.393690|1.566017|2.826295|1.765371|3.459769|1.741017|1.554697|1.553065|12.628354|1.918056|3.023673|2.497697|4.216294|3.073059|26.066645|5.331865|7.286243|10.690326|13.067110|10.308466|8.502714|36.858105| |1.340478|1.496916|2.673813|1.652751|3.236074|1.614590|1.448568|1.437845|11.514714|1.753141|2.730612|2.204238|3.707935|2.655220|21.361301|4.088805|5.902587|8.369377|7.496510|6.933617|6.033287|14.185455|36.858105| |1.221540|1.350320|2.414209|1.479804|2.863566|1.454429|1.320239|1.316711|10.473597|1.571833|2.410575|1.937438|3.309540|2.269311|18.327676|3.293874|4.569927|5.884619|5.210351|5.536017|5.274910|8.598527|13.269769|36.858105| |1.207498|1.334537|2.404984|1.478972|2.847166|1.467947|1.336367|1.342641|10.758257|1.598591|2.450449|1.994040|3.446199|2.327011|19.410127|3.453001|4.578853|5.705943|5.383645|6.061903|6.133335|8.817678|8.609769|14.208584|36.858105| |1.298703|1.447424|2.625311|1.631355|3.156620|1.625911|1.468447|1.479134|12.015883|1.792011|2.785675|2.308182|3.981168|2.755771|23.911206|4.484453|5.738690|7.296972|7.880553|8.668282|8.675172|14.157625|8.617442|8.623872|14.211305|73.516695| |2.610260|2.779241|6.228281|3.702529|5.511738|5.039695|7.429033|12.815077|48.866297|4.859740|4.945349|3.234089|6.093881|2.580481|16.144770|1.919256|2.526757|2.229893|1.578765|2.335995|2.268328|1.411337|1.311713|1.213060|1.240211|2.412224|36.858105| |2.525063|2.615163|5.719323|3.275540|4.928309|4.168945|5.815464|7.611447|35.500707|3.921206|4.196834|2.777666|5.180479|2.287007|14.497132|1.752780|2.317856|2.066337|1.465255|2.153072|2.094488|1.319879|1.230044|1.144287|1.171411|2.268141|13.681489|36.858105| |2.191344|2.227084|4.694910|2.656519|4.109388|3.214694|4.144030|5.043841|27.211149|3.085880|3.466364|2.359967|4.435908|1.991485|12.942878|1.580995|2.084841|1.879225|1.342292|1.967339|1.931153|1.220405|1.141311|1.068851|1.095374|2.109275|7.894346|13.758309|36.858105| |1.997575|2.035924|4.239964|2.420468|3.799339|2.906496|3.630883|4.453474|25.503074|2.854102|3.260044|2.258897|4.297391|1.914910|12.629450|1.540565|2.020430|1.827067|1.312414|1.928284|1.906814|1.197138|1.120950|1.051826|1.078053|2.072187|6.825232|7.934350|13.748870|36.858105| |2.036369|2.107826|4.429258|2.574993|4.043475|3.155091|3.935428|5.045203|29.322172|3.158446|3.573037|2.483467|4.776502|2.076385|13.670697|1.649340|2.153263|1.936318|1.391606|2.055785|2.034865|1.263717|1.181288|1.104162|1.130697|2.179831|7.893967|6.885296|7.952521|13.753147|36.858105| |2.296839|2.428635|5.260011|3.127153|4.816609|4.042282|5.280512|7.617027|40.589097|4.072742|4.389373|2.984230|5.743868|2.417561|15.536508|1.846792|2.412468|2.142553|1.529729|2.269917|2.227974|1.374866|1.280288|1.187707|1.214639|2.355971|13.681937|7.953223|6.884954|7.934261|13.754888|36.858105| |4.489049|4.661486|12.032803|5.927955|7.669176|7.244849|12.630491|7.578247|33.499879|5.028885|5.142528|3.056857|5.207196|2.560104|15.140995|1.882934|2.577723|2.279308|1.572380|2.266768|2.140790|1.403812|1.321682|1.211653|1.220757|2.361716|6.094285|5.533027|4.150450|3.577063|3.710652|4.605481|36.858105| |17.557606|8.905726|10.211666|4.278945|7.158959|3.363951|3.164048|2.586099|16.495089|2.765415|3.560017|2.212658|3.564058|2.111625|12.504818|1.696809|2.456787|2.246656|1.504353|2.066181|1.899018|1.363996|1.320648|1.204874|1.185739|2.256314|2.272805|2.210498|1.952127|1.795264|1.825978|2.032988|3.576371|0.500000| |17.574354|8.847794|12.871562|4.905481|7.498811|3.973689|3.912212|3.085539|18.803345|3.124713|3.849299|2.356908|3.834099|2.182036|12.897239|1.711930|2.442339|2.212326|1.493734|2.078352|1.923383|1.349049|1.293356|1.184222|1.176134|2.248930|2.697809|2.677998|2.317179|2.076395|2.083104|2.334625|4.722985|0.300794|0.500000| |17.574548|8.846611|12.865821|4.903706|7.495467|3.970568|3.919777|3.083483|18.746536|3.115231|3.834044|2.346776|3.818097|2.172591|12.841873|1.705207|2.432706|2.204482|1.488884|2.071172|1.918984|1.345451|1.295823|1.183145|1.169423|2.232131|2.697135|2.585543|2.256633|2.076022|2.129546|2.400647|4.798121|0.300796|0.300798|0.500000| |8.811369|17.628121|16.519390|7.269301|13.085744|4.770934|3.962378|3.141162|20.862789|3.823136|5.049242|2.975907|4.602020|2.833502|15.899546|2.137994|3.132279|2.784145|1.832506|2.533555|2.288421|1.624404|1.550305|1.396245|1.380456|2.666244|2.599537|2.478752|2.118824|1.928115|1.981075|2.266335|4.026060|0.211728|0.211088|0.172942|0.500000| |8.810725|17.627537|16.517478|7.267455|13.074002|4.767276|3.971340|3.139734|20.790275|3.806972|5.016383|2.956260|4.575374|2.813449|15.798601|2.125204|3.112389|2.768796|1.823727|2.520839|2.281235|1.618242|1.554587|1.394532|1.369750|2.638651|2.599422|2.405674|2.072769|1.928070|2.020954|2.326627|4.073078|0.211665|0.172947|0.211083|0.302482|0.500000| |3.206404|4.233667|8.922881|7.634636|17.808296|7.382576|4.766781|4.282290|37.603980|9.499164|25.902880|9.273457|10.795194|7.587411|31.636505|3.755963|5.313260|4.189036|2.733924|4.034411|3.547548|2.263678|2.061887|1.805745|1.817575|3.660966|3.222090|2.803695|2.341082|2.195229|2.377303|2.866295|3.673104|0.079884|0.084538|0.084236|0.120009|0.119186|0.500000| |2.334359|2.852453|5.481977|3.866213|8.195206|3.851443|3.044698|2.975106|26.627873|4.752427|9.675590|8.870084|10.954920|17.616141|56.371330|6.728823|9.444845|6.387016|4.049010|6.249686|5.080183|3.099447|2.682232|2.290362|2.345322|4.933287|2.459847|2.224788|1.935595|1.838912|1.964055|2.267695|2.521260|0.060766|0.062776|0.061212|0.083902|0.080303|0.208504|0.500000| |2.322831|2.838704|5.459042|3.856720|8.186105|3.848659|3.044538|2.975139|26.625428|4.751113|9.667765|8.870696|10.962288|17.615067|56.356553|6.741924|9.436106|6.390632|4.061159|6.273617|5.135634|3.111800|2.742352|2.308913|2.322086|4.838776|2.459832|2.170293|1.899239|1.838467|2.003374|2.329293|2.525099|0.060464|0.061175|0.062202|0.080496|0.082879|0.208373|0.303469|0.500000| |1.458820|1.646502|3.087186|1.971122|3.778044|2.042297|1.834144|1.896845|16.229037|2.359103|3.745908|3.365971|6.093996|4.040000|44.581855|7.006097|6.759806|6.461606|6.150491|13.225822|25.916758|5.078304|3.899089|3.431834|3.846472|8.905139|1.725619|1.580328|1.458249|1.449390|1.558790|1.710087|1.608951|0.038850|0.039391|0.039608|0.046585|0.046947|0.073593|0.101411|0.108255|0.500000| |1.438755|1.620616|3.033996|1.931632|3.697443|1.999003|1.798765|1.860176|15.867601|2.302572|3.643812|3.258826|5.905163|3.895487|42.539327|6.762756|6.599751|6.408004|6.190007|13.205795|25.920113|5.186204|3.820997|3.469395|4.111658|10.027323|1.696012|1.573971|1.452238|1.429860|1.519383|1.659876|1.580255|0.038353|0.039167|0.038768|0.046353|0.045702|0.071666|0.103505|0.099170|0.322345|0.500000| |1.383522|1.547984|2.744833|1.693337|3.336196|1.638085|1.463981|1.442872|11.485270|1.766540|2.754452|2.195550|3.651921|2.649975|20.564370|3.906471|5.925938|8.423813|6.512775|6.181437|5.240534|8.845668|17.815653|8.432628|5.855165|10.453994|1.311862|1.228055|1.137453|1.116654|1.178043|1.279407|1.340292|0.038001|0.036889|0.037148|0.044510|0.044966|0.058368|0.074423|0.077623|0.097407|0.092765|0.500000| |1.162293|1.277123|2.273369|1.383605|2.667259|1.356349|1.237625|1.231968|9.712909|1.454508|2.210663|1.757759|3.006947|2.029517|16.071004|2.799603|3.914856|4.874963|4.079411|4.523607|4.356889|5.853257|8.454172|17.805517|8.822962|10.450082|1.139785|1.078159|1.010456|0.995407|1.042973|1.117736|1.143279|0.031956|0.031293|0.031315|0.036626|0.036663|0.046073|0.056897|0.057581|0.080852|0.080950|0.192493|0.500000| |1.142665|1.255876|2.267946|1.388924|2.654101|1.385490|1.270609|1.281710|10.237249|1.506073|2.287076|1.857375|3.242878|2.129824|17.762964|3.031395|3.959806|4.715082|4.294819|5.188922|5.496132|6.053601|5.820289|8.612372|17.837603|16.538840|1.191567|1.129879|1.061137|1.045585|1.093705|1.169159|1.163737|0.031156|0.031025|0.030776|0.036046|0.035662|0.046860|0.059568|0.058519|0.097239|0.106438|0.123085|0.195121|0.500000| |2.712371|2.802670|6.162778|3.484498|5.195428|4.371695|6.034318|7.053190|33.850038|3.993471|4.283682|2.793441|5.114872|2.315562|14.516796|1.767422|2.352885|2.096436|1.479200|2.164349|2.091941|1.330842|1.240169|1.152762|1.179605|2.284972|8.918666|17.722583|8.922337|5.646023|4.958925|5.653720|5.897338|0.065555|0.081599|0.075902|0.074596|0.070203|0.080442|0.063568|0.060730|0.043547|0.043762|0.034408|0.030163|0.031586|0.500000| |2.099831|2.106659|4.363723|2.437854|3.806377|2.864887|3.575475|4.110336|23.174341|2.735701|3.139912|2.147490|4.005714|1.841971|12.040152|1.486394|1.966304|1.783244|1.274557|1.859271|1.825800|1.164330|1.091198|1.025536|1.051326|2.018088|5.629703|8.930660|17.714834|8.909795|5.649854|4.958030|3.685348|0.052342|0.062332|0.059688|0.056137|0.054200|0.059599|0.050204|0.048766|0.038115|0.038216|0.030187|0.026983|0.028355|0.215594|0.500000| |1.819530|1.838757|3.759652|2.133004|3.392120|2.497925|3.021314|3.558854|21.343591|2.460323|2.877468|2.015736|3.827385|1.737130|11.598390|1.427757|1.872529|1.705758|1.229838|1.801439|1.789390|1.128913|1.059987|0.999108|1.024392|1.961042|4.927053|5.643166|8.908006|17.716073|8.909341|5.642988|3.024239|0.045874|0.052513|0.052505|0.048572|0.048571|0.054288|0.046462|0.046449|0.037748|0.037283|0.029304|0.026330|0.027678|0.124142|0.214633|0.500000| |1.872624|1.935497|4.001356|2.328594|3.714704|2.790985|3.343448|4.111869|25.571196|2.826783|3.283735|2.319100|4.475738|1.965355|13.130261|1.591116|2.071206|1.872280|1.352084|1.997304|1.989244|1.233375|1.155366|1.082720|1.108502|2.131273|5.629817|4.958300|5.649730|8.911227|17.716150|8.930401|3.170616|0.047075|0.052769|0.054547|0.050565|0.052121|0.060991|0.051355|0.053012|0.042515|0.041150|0.031994|0.028454|0.029827|0.107624|0.124119|0.214651|0.500000| |2.272307|2.436092|5.257693|3.187848|4.970095|4.122249|5.089918|7.053569|42.815384|4.286745|4.664079|3.198500|6.200448|2.571346|16.520064|1.948452|2.535785|2.242778|1.602265|2.387354|2.344610|1.435110|1.335496|1.234534|1.260620|2.450048|8.911162|5.651424|4.958263|5.647149|8.926142|17.717792|4.291993|0.056076|0.063102|0.066218|0.062862|0.065934|0.083879|0.065845|0.069484|0.050392|0.048241|0.037127|0.032230|0.033618|0.124235|0.107610|0.124171|0.215779|0.500000| |5.090864|5.088602|12.885553|5.833220|7.633797|6.378355|8.839539|5.930683|29.199249|4.518628|4.824033|2.882141|4.861840|2.462533|14.570729|1.833884|2.528203|2.245401|1.543878|2.211985|2.081555|1.381591|1.302637|1.195984|1.204611|2.326686|4.976274|4.972839|3.831751|3.223743|3.220656|3.816951|17.584491|0.110169|0.160449|0.144406|0.124509|0.116617|0.097833|0.068721|0.067079|0.043142|0.042801|0.036693|0.031379|0.031922|0.159544|0.098692|0.077285|0.077195|0.098065|0.500000| |3.720491|3.721100|8.713306|4.470166|6.204726|5.444336|8.914876|7.260824|31.203846|4.252350|4.461386|2.760129|4.828190|2.321590|14.097605|1.750590|2.376494|2.117286|1.473708|2.129089|2.030774|1.324450|1.247998|1.150778|1.162272|2.241625|7.129327|6.807376|5.078729|4.287949|4.359417|5.319989|17.630069|0.085524|0.109545|0.111629|0.091577|0.092796|0.087071|0.063123|0.063349|0.042496|0.041740|0.035051|0.030221|0.030897|0.191058|0.122429|0.098699|0.100741|0.130443|0.301201|0.500000| |5.095056|5.179054|13.190032|6.021383|7.854322|6.538765|8.870810|5.886020|29.308386|4.592217|4.905224|2.918228|4.905357|2.494440|14.710349|1.852762|2.556947|2.269143|1.558822|2.232613|2.100937|1.394262|1.320273|1.207597|1.209961|2.333887|4.878395|4.345288|3.496609|3.158383|3.340647|4.060565|17.598610|0.110487|0.140771|0.162662|0.117219|0.128941|0.099829|0.067936|0.069754|0.043943|0.042777|0.037386|0.031721|0.031965|0.123699|0.087247|0.075848|0.081860|0.109990|0.303516|0.301625|0.500000| 2209.705800 -12017.624208 4429.453456 -238.181713 -5616.646664 3404.651588 -2211.995076 2.001036 40C3A4000000000C 4523714B0EA821EB 44A3C04C3FA6BCDE 41CCC031A0000003 BC079CA100000000 442B0A849BBBE1D9