Version2.1 2021-01-15T21:13:56Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 27-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC(=O)Nc1cccc(c1)NC(=O)CSc2nc3ccsc3c(=O)n2c4cccc(c4)Cl C67216644 RHF 6-31G(d) (6D,7F) CC(=O)Nc1cccc(c1)NC(=O)CSc2nc3ccsc3c(=O)n2c4cccc(c4)Cl C01[X(C22H17Cl1N4O3S2)] 141 C1 526 O=C(Nc1cccc(c1)NC(=O)C)CSc1nc2ccsc2c(=O)n1c1cccc(c1)Cl O=C(Nc1cccc(c1)NC(=O)C)CSc1nc2ccsc2c(=O)n1c1cccc(c1)Cl CC(=O)Nc1cccc(NC(=O)CSC2=Nc3ccsc3C(=O)N2c4cccc(Cl)c4)c1 InChIKey=DOFOKJRRXYNRDF-UHFFFAOYSA-N InChI=1S/C22H17ClN4O3S2/c1-13(28)24-15-5-3-6-16(11-15)25-19(29)12-32-22-26-18-8-9-31-20(18)21(30)27(22)17-7-2-4-14(23)10-17/h2-11H,12H2,1H3,(H,24,28)(H,25,29) InChI=1/C22H17ClN4O3S2/c1-13(28)24-15-5-3-6-16(11-15)25-19(29)12-32-22-26-18-8-9-31-20(18)21(30)27(22)17-7-2-4-14(23)10-17/h2-11H,12H2,1H3,(H,24,28)(H,25,29)/f/h24-25H CC(=O)Nc1cccc(c1)NC(=O)CSc2nc3ccsc3c(=O)n2c4cccc(c4)Cl C01[X(C22H17Cl1N4O3S2)] 141 C01 526 O=C(Nc1cccc(c1)NC(=O)C)CSc1nc2ccsc2c(=O)n1c1cccc(c1)Cl O=C(N[C]1[CH][CH][CH][C]([CH]1)NC(=O)C)CS[C]1[N][C]2[CH]=[CH]S[C]2C(=O)N1[C]1[CH][CH][CH][C]([CH]1)Cl CC(=O)N[C]1[CH][CH][CH][C]([CH]1)NC(=O)CS[C]2[N][C]3C=CS[C]3C(=O)N2[C]4[CH][CH][CH][C](Cl)[CH]4 InChIKey=DOFOKJRRXYNRDF-UHFFFAOYSA-N InChI=1S/C22H17ClN4O3S2/c1-13(28)24-15-5-3-6-16(11-15)25-19(29)12-32-22-26-18-8-9-31-20(18)21(30)27(22)17-7-2-4-14(23)10-17/h2-11H,12H2,1H3,(H,24,28)(H,25,29) InChI=1/C22H17ClN4O3S2/c1-13(28)24-15-5-3-6-16(11-15)25-19(29)12-32-22-26-18-8-9-31-20(18)21(30)27(22)17-7-2-4-14(23)10-17/h2-11H,12H2,1H3,(H,24,28)(H,25,29)/f/h24-25H 3355.5729299030 -2539.9412363 1-A 28359.3461 125 401 526 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -104.82999 -91.98780 -91.97937 -20.55548 -20.54420 -20.54111 -15.64959 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384.9258 409.2385 444.7400 455.0751 486.5403 497.7417 505.4825 531.6561 543.3283 551.8032 565.5531 581.0217 601.8740 625.6704 635.2536 639.4119 660.2939 691.1796 703.3979 715.9537 719.7046 725.3361 750.2792 760.6348 765.9968 766.6859 794.3352 807.3525 836.6006 851.7985 885.0097 897.2457 898.9544 902.3589 908.5845 933.7867 946.9937 985.3655 1015.6937 1022.1041 1030.3639 1038.0707 1041.7463 1044.5276 1052.4588 1084.1163 1089.3100 1093.6976 1115.2760 1129.2509 1132.0324 1157.3029 1166.0081 1172.3084 1189.9252 1206.6343 1211.4357 1226.8649 1226.9268 1228.9361 1286.7212 1300.0956 1307.6210 1312.5283 1321.6059 1349.9161 1381.7327 1391.3757 1421.2863 1427.5699 1440.4210 1455.7339 1467.9856 1485.5546 1550.0777 1568.0833 1581.8735 1588.5532 1601.7506 1615.7560 1623.2456 1627.8102 1652.9298 1668.6673 1722.5304 1729.1702 1737.7929 1772.6088 1785.2175 1801.5155 1809.3124 1816.8160 1966.9473 1977.8960 1988.1739 3214.5331 3269.2403 3273.0413 3321.3412 3325.2478 3341.4387 3373.4973 3381.6835 3398.9516 3408.9141 3411.1777 3416.1186 3441.2083 3469.5315 3471.5875 3869.7063 3874.7109 5.5675 5.7443 4.6974 1.4373 6.1226 7.8594 7.6654 6.8070 5.9249 7.4819 2.8870 6.7245 3.4146 7.6063 10.0975 7.4645 6.3498 6.6984 5.5656 7.3468 4.5761 6.2500 7.6710 3.9214 10.4896 8.0729 7.0510 11.4191 4.1097 7.6051 21.4394 10.5764 5.8774 5.2473 3.1509 2.9479 5.3034 1.2553 1.2246 8.9614 4.7347 9.0421 6.9360 6.5266 2.2124 2.4472 4.9052 10.0823 5.4487 5.7413 5.5216 6.4561 3.5173 2.0649 4.8952 4.6169 4.8285 2.2454 5.7655 3.2101 2.4583 2.8227 1.2561 4.9920 4.5273 1.8810 4.3237 1.6351 1.9205 1.3628 1.9112 6.2183 1.3098 2.6819 5.4947 2.7048 6.2101 1.3476 1.3150 2.0260 4.0689 1.7573 2.4559 1.9458 2.7705 1.6496 2.0425 3.7243 1.7737 2.0046 1.1146 1.2795 1.3539 4.5246 2.2396 5.2656 2.5509 2.9051 2.1432 1.5647 3.8624 1.3729 1.6672 1.3599 2.3704 3.9698 3.5370 1.1044 1.0681 7.6279 1.0454 2.3821 2.5101 5.5670 1.8432 2.5377 9.2456 5.8846 5.8219 3.4319 5.0186 12.9768 9.3113 8.7103 1.0405 1.0596 1.1021 1.1068 1.0911 1.1010 1.0919 1.0894 1.0947 1.0972 1.0947 1.0908 1.1013 1.0937 1.0939 1.0780 1.0780 0.0001 0.0008 0.0013 0.0005 0.0025 0.0039 0.0066 0.0079 0.0121 0.0163 0.0143 0.0352 0.0239 0.0569 0.1059 0.0903 0.1073 0.1258 0.1519 0.2324 0.1908 0.2680 0.3345 0.1730 0.4951 0.4806 0.4572 0.8011 0.3233 0.6639 2.1155 1.2325 0.7171 0.7319 0.4599 0.4438 0.8832 0.2183 0.2197 1.6888 0.9417 1.9299 1.5998 1.5518 0.5329 0.6286 1.3807 2.9391 1.6456 1.7521 1.7116 2.1413 1.1990 0.7138 1.6953 1.7163 1.8544 0.9259 2.4647 1.4814 1.1660 1.3440 0.6026 2.4280 2.3259 0.9939 2.4735 0.9938 1.1821 0.8525 1.2134 3.9760 0.8420 1.7503 3.8049 1.8910 4.3766 0.9876 0.9880 1.5297 3.2109 1.4077 1.9886 1.6232 2.3766 1.4263 1.8114 3.3031 1.5783 1.9555 1.1100 1.2890 1.3742 4.6562 2.4045 5.9231 2.9096 3.4576 2.5734 1.9128 4.8225 1.7432 2.1678 1.9251 3.4340 5.8528 5.2589 1.6694 1.6429 11.8420 1.6321 3.8346 4.1179 9.7321 3.2471 4.5153 17.1163 11.0496 11.1325 6.6192 9.7602 29.5804 21.4618 20.2858 6.3350 6.6724 6.9563 7.1939 7.1083 7.2427 7.3217 7.3402 7.4517 7.5120 7.5049 7.4998 7.6840 7.7568 7.7672 9.5113 9.5357 0.3890 2.3082 1.8795 0.4844 6.7700 1.7846 3.2990 0.4607 0.6314 0.6748 5.7702 0.0666 3.1238 2.8359 5.5301 0.2850 2.5302 1.4819 0.0744 15.2273 0.6407 3.9209 10.3270 0.0003 11.9429 3.6898 1.5410 0.4025 3.5280 0.7566 6.4493 4.7016 5.0276 0.0717 3.4489 1.1893 0.0320 7.9144 181.4125 9.1572 31.2035 1.0114 4.6034 15.7297 1.2726 0.3867 0.0649 3.0323 5.6568 3.1936 7.2499 22.3624 4.9122 11.9388 2.6812 85.2895 14.5963 2.4322 1.3865 81.8052 38.6745 50.6607 34.0781 5.9600 19.5613 82.1957 5.9353 2.4723 8.9029 0.0009 2.8058 4.4184 0.0613 6.7705 0.9414 39.8079 3.0237 0.0109 4.1524 4.3031 71.3203 7.8457 10.3260 19.4846 25.0439 5.0595 8.8115 9.1991 2.5246 106.1402 0.4359 190.2425 1.2504 9.9923 87.8448 476.9072 316.1334 36.3070 3.1685 19.9857 65.0162 9.6589 140.9856 32.3223 3.7827 54.1110 19.4741 15.2107 34.3400 62.1803 8.0866 58.0132 807.3439 960.2590 321.6398 29.0391 294.9629 30.1777 10.9957 21.4204 477.1134 616.1303 217.0077 280.4126 7.5920 16.2839 17.5306 0.7191 22.3541 9.1542 18.8173 6.1025 5.6338 6.9770 0.4671 2.1534 2.0822 3.8493 3.4233 25.5578 27.7705 1.5006 2.7884 1.3027 0.4569 1.2102 3.6867 4.1783 0.0846 6.4578 3.1635 0.8597 0.3936 1.1728 0.0789 0.7331 2.2789 0.9515 0.6590 1.3806 1.1063 0.4387 7.1016 0.8700 2.9701 1.5984 0.7019 1.9053 0.5703 2.5366 1.5895 1.9852 6.9632 0.4100 1.2879 0.7353 0.1449 2.8601 0.7596 2.0634 4.1244 4.5129 5.4171 0.6624 0.9727 0.1642 0.7573 3.7649 17.2052 0.9364 4.7538 3.5873 5.1245 6.5077 0.0109 2.3422 1.8635 10.4497 1.8718 16.8488 1.6834 2.2376 1.1014 1.7481 25.8297 0.6404 1.5407 6.1067 2.3371 0.9719 0.6692 2.4314 5.4284 0.3217 3.7641 58.0806 2.5194 37.1885 0.2139 0.6983 2.4622 1.8812 1.1186 3.7533 2.7195 5.0181 1.4666 2.7260 18.1912 14.7807 5.2940 10.6942 1.3562 1.0307 20.4475 3.5264 33.2628 1.0759 49.5135 6.1156 4.2068 24.0852 2.6049 6.7317 1.4687 1.2504 10.8972 6.5065 9.2199 15.2783 249.4262 21.5088 1.0474 4.5018 126.6736 11.9646 68.4330 4.4549 10.4555 37.4456 27.0441 52.5499 36.1112 24.6065 12.9963 111.1204 54.1729 58.5572 28.8668 48.5568 96.8100 109.4291 61.1006 62.5817 156.4447 70.9459 80.3322 194.5050 46.1484 73.7520 44.2211 46.1620 0.7500 0.7496 0.7500 0.7500 0.7491 0.7482 0.7485 0.7091 0.7368 0.7466 0.7489 0.4264 0.7484 0.5882 0.4961 0.3946 0.3390 0.7071 0.6112 0.3141 0.7492 0.4578 0.7085 0.7498 0.7056 0.6380 0.7261 0.7500 0.4045 0.6367 0.5601 0.3451 0.7036 0.5384 0.5535 0.7497 0.7345 0.7499 0.7499 0.5333 0.5115 0.2146 0.4476 0.6682 0.6976 0.7499 0.7493 0.1723 0.7475 0.2946 0.4451 0.1054 0.5197 0.7408 0.7499 0.0481 0.6689 0.6880 0.4081 0.1769 0.7382 0.3278 0.7493 0.2101 0.7122 0.7498 0.3539 0.4347 0.7151 0.7498 0.1615 0.1053 0.7487 0.3309 0.1277 0.7183 0.0896 0.7475 0.7499 0.3955 0.3400 0.7484 0.5586 0.1927 0.7499 0.6283 0.6321 0.7499 0.2649 0.4030 0.7468 0.5986 0.7307 0.4198 0.2462 0.2250 0.6949 0.2032 0.7441 0.1870 0.1169 0.5692 0.4706 0.7408 0.2872 0.7416 0.7366 0.4771 0.7231 0.2181 0.7500 0.0895 0.7105 0.2991 0.5278 0.2637 0.2427 0.6450 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0.8470 0.3797 0.3488 0.3210 0.0269 0.0495 0.8571 0.8571 0.4121 0.7216 0.5166 0.8115 0.7121 0.2740 0.3520 0.7836 0.3530 0.4057 0.3554 0.2544 0.2549 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 6 6 8 7 6 6 6 6 6 6 7 6 8 6 16 6 7 6 6 6 16 6 6 8 7 6 6 6 6 6 6 17 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 12.00000 31.97207 12.00000 14.00307 12.00000 12.00000 12.00000 31.97207 12.00000 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 34.96885 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 10922.0531 43290.9663 52316.4345 0.99998 0.00514 -0.00365 -0.00519 0.99990 -0.01310 0.00358 0.01312 0.99991 1 0.00793 0.00200 0.00166 0.16524 0.04169 0.03450 8.70 22.10 30.66 34.80 37.77 41.93 55.11 63.66 84.54 87.61 132.07 135.68 156.68 162.14 191.99 206.14 243.61 256.92 309.69 333.37 382.77 388.13 391.42 393.76 407.21 457.34 477.31 496.47 525.77 553.82 588.80 639.88 654.75 700.02 716.14 727.28 764.93 781.73 793.92 813.70 835.96 865.96 900.20 913.99 919.97 950.02 994.45 1012.03 1030.10 1035.49 1043.60 1079.48 1094.38 1102.10 1103.09 1142.87 1161.60 1203.68 1225.55 1273.33 1290.94 1293.39 1298.29 1307.25 1343.51 1362.51 1417.72 1461.36 1470.58 1482.46 1493.55 1498.84 1502.84 1514.25 1559.80 1567.27 1573.59 1604.63 1624.74 1628.74 1665.10 1677.63 1686.69 1712.04 1736.08 1742.99 1765.18 1765.27 1768.16 1851.30 1870.55 1881.37 1888.44 1901.50 1942.23 1988.01 2001.88 2044.91 2053.95 2072.44 2094.48 2112.10 2137.38 2230.22 2256.12 2275.96 2285.57 2304.56 2324.71 2335.49 2342.06 2378.20 2400.84 2478.34 2487.89 2500.30 2550.39 2568.53 2591.98 2603.20 2613.99 2830.00 2845.75 2860.54 4625.00 4703.71 4709.18 4778.67 4784.29 4807.59 4853.71 4865.49 4890.33 4904.67 4907.92 4915.03 4951.13 4991.88 4994.84 5567.64 5574.84 0.385852 0.413453 0.414397 0.319363 -2539.555384 -2539.527783 -2539.526839 -2539.621874 3.187490D-04 MUNgauss RevisionA2.0 retrievium 15-Jan-2021 DUDE CC(=O)Nc1cccc(c1)NC(=O)CSc2nc3ccsc3c(=O)n2c4cccc(c4)Cl C67216644 RHF 6-31G(d) (6D,10F) C1 484.043062 |X|Y|Z| 73.087632 25.721726 149.518874 65.505838 25 6 7 16 20 3 2 |36.858105| |12.570020|36.858105| |8.010181|15.936667|73.516695| |7.898436|13.929859|14.932365|53.358707| |5.032442|7.601624|11.546543|18.437138|36.858105| |4.202930|6.251842|11.660045|10.507574|13.701963|36.858105| |3.232605|4.307252|7.964043|7.004113|7.996564|13.771433|36.858105| |2.896832|3.651084|6.385524|6.170110|6.807114|7.833094|13.761474|36.858105| |3.135091|3.878260|6.378357|7.060289|7.868885|6.819024|8.007669|13.719426|36.858105| |4.014118|5.151411|7.890262|10.895781|13.709900|7.934466|6.974059|7.929647|13.716100|36.858105| |2.689178|3.134709|5.126506|5.453269|5.184307|4.533914|5.143823|7.714723|13.504146|8.004618|53.358707| |2.261270|2.586181|4.335826|4.272103|3.882434|3.656695|4.312180|6.263407|7.615192|5.161956|19.060252|36.858105| |2.112732|2.434551|4.179269|3.921634|3.581446|3.586909|4.469231|6.540249|6.478677|4.432980|11.422079|15.943366|73.516695| |2.046821|2.264730|3.765564|3.671222|3.143153|2.902272|3.234851|4.205786|5.044222|4.030379|10.820664|12.516249|14.192185|36.858105| |1.728265|1.896868|3.217439|2.973682|2.502769|2.408458|2.715802|3.381954|3.650310|3.001720|6.536985|7.007046|11.919113|10.520437|388.023441| |1.601246|1.718919|2.894340|2.666793|2.172412|2.056054|2.237812|2.670981|2.936841|2.567348|5.072886|4.649343|7.507460|7.015857|76.467850|36.858105| |1.673485|1.778877|2.961418|2.775673|2.231465|2.067995|2.206701|2.614419|2.965648|2.663413|5.172458|4.444535|6.786543|6.886011|51.095531|14.932410|53.358707| |1.542595|1.616535|2.693029|2.487744|1.960862|1.819653|1.914227|2.210025|2.474851|2.288110|4.121506|3.375790|5.323812|4.622483|34.583565|8.444800|18.899330|36.858105| |1.558689|1.610578|2.662781|2.470873|1.911952|1.752621|1.810509|2.058672|2.328791|2.217480|3.802482|2.964631|4.637716|3.854480|26.377177|5.281806|10.436050|13.273615|36.858105| |1.414393|1.451419|2.413034|2.197358|1.685985|1.559662|1.606053|1.799753|2.000257|1.918517|3.178262|2.467216|3.961363|3.063014|21.809681|4.193283|7.194585|8.290463|14.161518|36.858105| |1.292883|1.335833|2.243796|2.008703|1.553797|1.460632|1.520989|1.703013|1.854175|1.752225|2.923801|2.326900|3.837996|2.856633|21.941555|4.326983|6.644323|7.391811|7.379070|11.030296|388.023441| |1.393251|1.457953|2.450193|2.216044|1.742423|1.640539|1.731729|1.976140|2.159503|1.995536|3.498636|2.882513|4.726497|3.726553|30.361410|7.076671|10.791017|14.011875|8.206972|7.800324|78.365229|36.858105| |1.341484|1.415517|2.399352|2.144206|1.702851|1.627010|1.740574|1.992305|2.133891|1.938896|3.436720|2.914998|4.937817|3.697632|33.681017|7.795739|9.072220|7.811767|5.172128|4.922130|47.909562|13.240496|36.858105| |1.239547|1.304947|2.224036|1.959062|1.549343|1.492669|1.595496|1.804704|1.905370|1.740468|3.003112|2.519650|4.357869|3.053658|27.428833|5.401754|6.401783|5.353555|4.072471|4.137631|42.274502|8.083839|15.952550|73.516695| |1.436373|1.533565|2.603503|2.342897|1.890760|1.814262|1.970860|2.300240|2.458660|2.178756|4.049644|3.599017|6.145922|4.741528|50.717596|13.829098|11.040650|7.118416|4.638915|4.059170|33.611043|8.060490|13.487195|14.892631|53.358707| |1.368665|1.470284|2.521622|2.229376|1.810401|1.769199|1.946426|2.261289|2.345768|2.057299|3.768757|3.389531|6.127664|4.118094|46.481121|7.749203|7.101503|4.627787|3.434352|3.129797|25.839364|5.166775|7.862639|12.622515|18.000499|36.858105| |1.328197|1.429210|2.463907|2.155793|1.751629|1.726821|1.906506|2.199365|2.248148|1.971946|3.548629|3.166139|5.858115|3.676650|39.051624|5.762496|5.800977|3.846181|2.999514|2.774553|22.656224|4.226348|5.849394|10.195219|10.617154|13.782653|36.858105| |1.259351|1.358398|2.361654|2.031540|1.651426|1.651117|1.832664|2.088116|2.086077|1.831648|3.207214|2.824178|5.390735|3.100888|30.944280|4.185865|4.494055|3.022967|2.470226|2.321590|18.733617|3.278030|4.250196|7.826145|6.995398|7.980310|13.765768|36.858105| |1.229494|1.327197|2.315278|1.977818|1.607548|1.616255|1.797205|2.036304|2.016504|1.772239|3.069115|2.686633|5.179807|2.896295|28.352080|3.761082|4.100618|2.769425|2.292751|2.165302|17.410611|2.993114|3.821195|7.124842|6.169606|6.896435|7.928255|13.761809|36.858105| |1.261749|1.360160|2.363132|2.034740|1.652930|1.650773|1.830145|2.084895|2.086566|1.834069|3.209961|2.820640|5.363181|3.101906|30.894000|4.193139|4.503158|3.031112|2.476402|2.327730|18.789920|3.288428|4.265093|7.852777|7.017128|8.006882|6.898088|7.978944|13.772929|36.858105| |1.330809|1.431032|2.465232|2.159192|1.753032|1.726088|1.903249|2.194945|2.247979|1.974399|3.550648|3.159046|5.818986|3.674808|38.876941|5.767911|5.812152|3.858107|3.008002|2.782922|22.734978|4.242454|5.873805|10.231118|10.650060|13.772232|7.912102|6.868165|7.912709|13.791967|36.858105| |1.205131|1.297012|2.264454|1.924853|1.555990|1.564267|1.727450|1.937072|1.919267|1.704245|2.888198|2.471434|4.704775|2.631060|24.093793|3.238732|3.693201|2.528704|2.145098|2.039058|16.190841|2.701668|3.283713|6.065150|5.053176|4.783761|4.231021|4.773110|7.039974|10.943068|7.055743|448.794386| |17.550190|8.840315|10.960019|9.611009|4.698173|3.854420|3.046983|2.796623|3.077764|3.937819|3.659146|2.259194|3.722804|2.066865|12.357095|1.621990|2.321845|1.577148|1.603330|1.453883|9.397824|1.420149|1.360542|2.231275|1.976856|1.377016|1.340147|1.265407|1.228058|1.256734|1.329537|9.574080|0.500000| |17.549275|8.846981|10.996654|9.576775|4.690142|3.856678|3.047689|2.794423|3.071413|3.925270|3.649872|2.254275|3.716732|2.061440|12.339529|1.618669|2.314692|1.572014|1.596603|1.448249|9.370782|1.416476|1.358092|2.228013|1.973914|1.376091|1.325963|1.254225|1.228755|1.268712|1.343024|9.763072|0.301035|0.500000| |17.649014|8.972528|13.560248|7.828724|4.137627|3.714574|2.925589|2.595180|2.731269|3.348704|3.219092|2.031096|3.418358|1.846065|11.277992|1.472981|2.083726|1.419313|1.432243|1.309565|8.566926|1.292162|1.248967|2.062998|1.813994|1.277090|1.243633|1.185748|1.160242|1.187542|1.245536|9.146705|0.299687|0.299751|0.500000| |7.762004|9.473869|10.891958|26.074652|9.354132|5.746174|4.311242|4.079742|4.934175|7.701720|5.514593|3.144317|5.010046|2.774750|15.750059|2.017396|2.899668|1.916352|1.925294|1.704829|10.952790|1.693027|1.621190|2.622034|2.398814|1.658663|1.595976|1.492611|1.448967|1.496002|1.599787|11.321954|0.212558|0.210903|0.151071|0.500000| |4.427550|6.819542|15.060002|9.502568|8.897302|17.841161|8.905644|5.609928|4.933496|5.646465|4.920760|3.041792|5.371305|2.496802|15.132031|1.844413|2.522589|1.651882|1.599153|1.437042|9.604661|1.502441|1.491539|2.450463|2.243874|1.615245|1.583094|1.524645|1.497227|1.524182|1.582318|11.683884|0.109484|0.109719|0.112839|0.142980|0.500000| |2.884255|3.738260|7.213816|5.663303|5.681641|8.990016|17.715816|8.987142|5.686568|5.004122|5.660808|3.740778|7.196270|2.883892|17.972088|2.085743|2.766853|1.777678|1.675064|1.499660|10.205591|1.628293|1.651601|2.714801|2.539975|1.869410|1.845878|1.799220|1.774865|1.795012|1.840986|13.711338|0.075324|0.075389|0.074508|0.098443|0.216245|0.500000| |2.492862|3.038041|5.378277|4.919943|4.927101|5.610383|8.902992|17.838893|8.892696|5.642562|9.487989|6.821616|14.983544|4.420173|26.575650|2.832265|3.671969|2.260884|2.068674|1.812313|12.369397|2.040546|2.092040|3.376106|3.337882|2.457278|2.403743|2.301982|2.251489|2.294496|2.394427|17.025516|0.067222|0.067180|0.063045|0.092542|0.123862|0.216232|0.500000| |4.078193|4.843987|7.112623|10.092307|8.918690|5.643622|5.000392|5.642540|8.919190|17.669153|10.101387|4.855498|7.110532|4.101796|21.195401|2.634646|3.821773|2.425627|2.393808|2.053329|13.094503|2.085611|1.992090|3.159381|3.017473|2.055792|1.956104|1.797604|1.732602|1.801732|1.960832|13.394576|0.114584|0.114005|0.092797|0.238136|0.124106|0.108325|0.124060|0.500000| |2.765954|3.141656|5.015131|5.517233|4.935621|4.082098|4.311217|5.744343|9.338790|7.707769|26.064484|9.489745|10.885444|7.835028|32.225984|3.788446|5.536007|3.251107|3.070623|2.523542|16.097505|2.692539|2.576149|3.967525|4.061945|2.699615|2.517967|2.248096|2.143107|2.253620|2.524526|16.276273|0.077794|0.077546|0.066885|0.119199|0.092595|0.098431|0.142822|0.238653|0.500000| |2.072261|2.269304|3.741327|3.683592|3.097953|2.810865|3.058378|3.870594|4.732877|3.973660|9.740660|8.849334|10.933558|17.621791|56.371349|6.636483|9.813954|4.897976|4.178790|3.258069|21.088749|3.834628|3.678682|5.375712|6.190693|3.844455|3.318654|2.823930|2.700767|2.966109|3.555197|20.747644|0.057888|0.058784|0.051751|0.078367|0.067518|0.075503|0.109636|0.115913|0.217048|0.500000| |2.065584|2.263114|3.734688|3.670063|3.088097|2.806671|3.057457|3.869905|4.716554|3.954141|9.665787|8.861658|11.009240|17.620036|56.368991|6.645000|9.862935|4.914352|4.194089|3.266608|21.126048|3.841825|3.681508|5.378037|6.189707|3.838238|3.544709|2.955322|2.693693|2.820465|3.314151|19.112706|0.058750|0.057489|0.051626|0.077981|0.067439|0.075546|0.109823|0.115069|0.213411|0.303379|0.500000| |1.682192|1.729874|2.834125|2.672836|2.054033|1.855592|1.897672|2.156795|2.484977|2.402985|4.073239|3.081848|4.720957|3.977708|25.283252|4.681288|9.212420|8.598145|17.768364|8.867338|37.424708|5.718786|4.122103|5.966279|5.366069|3.044110|2.703408|2.266566|2.114979|2.271545|2.709897|16.015254|0.048290|0.048042|0.042667|0.058489|0.046879|0.048346|0.059411|0.073400|0.093822|0.122293|0.122836|0.500000| |1.380579|1.404330|2.331315|2.113208|1.604286|1.480947|1.511976|1.676849|1.861023|1.809303|2.911416|2.220357|3.577782|2.681568|18.747340|3.408353|5.648508|5.713175|8.805121|17.778382|55.512220|5.463392|3.889811|6.106377|4.499055|2.663895|2.407222|2.059030|1.933811|2.064128|2.413889|14.771329|0.039517|0.039350|0.035584|0.045689|0.038102|0.039257|0.046600|0.053993|0.064353|0.079207|0.079399|0.203419|0.500000| |1.343151|1.441731|2.478716|2.176837|1.763062|1.728943|1.898252|2.186741|2.253901|1.988545|3.565591|3.146468|5.720085|3.686486|37.098768|5.689485|5.966123|3.997026|3.132606|2.892479|23.439145|4.351071|5.742887|9.726328|9.777104|8.939121|17.741448|8.891145|5.636775|4.966980|5.642670|27.425648|0.037858|0.037134|0.034898|0.044898|0.044014|0.050841|0.065838|0.055069|0.070845|0.091043|0.102886|0.078377|0.069615|0.500000| |1.223805|1.319544|2.302145|1.963709|1.592655|1.600346|1.774210|2.002759|1.985411|1.752187|3.010104|2.611572|5.004066|2.805168|26.546183|3.558279|3.971163|2.699311|2.258690|2.137645|17.075574|2.898650|3.604098|6.658562|5.670489|5.666223|8.929990|17.734956|8.939821|5.667972|4.950865|31.617978|0.034220|0.033715|0.032103|0.039970|0.041239|0.048664|0.061238|0.047628|0.058528|0.070600|0.075581|0.058074|0.053240|0.214286|0.500000| |1.176660|1.270313|2.228023|1.880398|1.525083|1.545649|1.718720|1.924181|1.882845|1.663228|2.815829|2.426730|4.715831|2.549122|23.762775|3.115754|3.514048|2.395702|2.030526|1.932219|15.386984|2.566688|3.159603|5.922036|4.914708|4.966869|5.638364|8.893925|17.751355|8.932459|5.643282|53.847590|0.032579|0.032611|0.030972|0.038109|0.040025|0.047584|0.059117|0.044954|0.054451|0.066344|0.066153|0.052513|0.048509|0.123852|0.214711|0.500000| |1.347320|1.444410|2.480198|2.181916|1.764699|1.726979|1.891940|2.178124|2.252156|1.991724|3.566073|3.131150|5.652376|3.677550|36.763969|5.680721|5.972104|4.010900|3.143718|2.904322|23.551785|4.371171|5.766428|9.760834|9.784644|8.910849|5.637457|4.952849|5.635452|8.909648|17.760240|53.783125|0.037297|0.037988|0.034980|0.045067|0.043962|0.050596|0.065378|0.055270|0.071108|0.103033|0.090877|0.078605|0.069883|0.124220|0.107545|0.124168|0.500000| 2537.639743 -12702.297645 4518.630908 -249.487484 -5895.514478 3355.573171 -2539.941306 2.000907 408B00000000000E 451FBCD6DD70A4E4 44A03FEAF05A7119 41E7653E00000001 B7CA22391F5F0C01 44210BF6CD38DFF6