Version2.4 2021-05-26T05:10:05Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 02-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1cc(cc2c1nc(s2)NC(=O)c3ccccc3)[N-]S(=O)(=O)c4cc(ccc4OC)Cl C33007840 RHF 6-31G(d) (6D,7F) Cc1cc(cc2c1nc(s2)NC(=O)c3ccccc3)[N-]S(=O)(=O)c4cc(ccc4OC)Cl C01[X(C22H17Cl1N3O4S2)] 141 C1 526 COc1ccc(cc1S(=O)(=O)[N-]c1cc(C)c2c(c1)sc(n2)NC(=O)c1ccccc1)Cl COc1ccc(cc1S(=O)(=O)[N-]c1cc(C)c2c(c1)sc(n2)NC(=O)c1ccccc1)Cl COc1ccc(Cl)cc1[S](=O)(=O)[N-]c2cc(C)c3nc(NC(=O)c4ccccc4)sc3c2 InChIKey=TYBSJAWZNLPIFQ-UHFFFAOYSA-N InChI=1S/C22H17ClN3O4S2/c1-13-10-16(26-32(28,29)19-11-15(23)8-9-17(19)30-2)12-18-20(13)24-22(31-18)25-21(27)14-6-4-3-5-7-14/h3-12H,1-2H3,(H,24,25,27)/q-1 InChI=1/C22H17ClN3O4S2/c1-13-10-16(26-32(28,29)19-11-15(23)8-9-17(19)30-2)12-18-20(13)24-22(31-18)25-21(27)14-6-4-3-5-7-14/h3-12H,1-2H3,(H,24,25,27)/q-1/f/h25H Cc1cc(cc2c1nc(s2)NC(=O)c3ccccc3)[N-]S(=O)(=O)c4cc(ccc4OC)Cl C01[X(C22H17Cl1N3O4S2)] 141 C01 526 COc1ccc(cc1S(=O)(=O)[N-]c1cc(C)c2c(c1)sc(n2)NC(=O)c1ccccc1)Cl CO[C]1[CH][CH][C]([CH][C]1[S]([N][C]1[CH][C]2[C]([C]([CH]1)C)N=C(S2)NC(=O)[C]1[CH][CH][CH][CH][CH]1)([O])[O])Cl CO[C]1[CH][CH][C](Cl)[CH][C]1[S]([O])([O])[N][C]2[CH][C](C)[C]3N=C(NC(=O)[C]4[CH][CH][CH][CH][CH]4)S[C]3[CH]2 InChIKey=RSWCELKOYALEPC-UHFFFAOYSA-N InChI=1S/C22H17ClN3O4S2/c1-13-10-16(26-32(28,29)19-11-15(23)8-9-17(19)30-2)12-18-20(13)24-22(31-18)25-21(27)14-6-4-3-5-7-14/h3-12H,1-2H3,(H,24,25,27) InChI=1/C22H17ClN3O4S2/c1-13-10-16(26-32(28,29)19-11-15(23)8-9-17(19)30-2)12-18-20(13)24-22(31-18)25-21(27)14-6-4-3-5-7-14/h3-12H,1-2H3,(H,24,25,27)/f/h25H 3434.5494525149 -2560.2769114 1-A 29992.2739 126 400 526 |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|A| -104.73587 -92.03780 -91.86992 -20.49618 -20.46930 -20.37806 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486.03490 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 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 5.2408 16.5238 23.9278 26.0413 33.3345 46.9115 53.7864 65.3319 85.8143 92.3016 111.8793 116.1925 137.6075 149.3928 168.7877 174.7546 183.3364 199.4763 205.2281 227.2536 252.1070 261.7641 264.4593 276.7686 304.8040 312.2486 347.3440 358.6718 379.1808 404.9827 413.5298 427.3255 441.8902 456.7331 459.8071 504.1376 510.6873 534.8400 545.1074 574.5773 578.4089 595.7064 605.7648 618.1014 642.8194 651.4802 673.5694 677.4285 685.9284 703.8492 705.8988 731.2808 746.1115 762.9852 766.2850 798.0439 806.3451 808.0025 822.3508 885.5341 894.1406 914.9619 919.1678 949.7151 953.9616 962.2762 982.3965 986.1862 1003.5671 1049.8393 1061.4160 1077.4723 1089.2031 1091.0287 1110.0193 1128.1643 1132.0860 1135.0371 1167.7867 1167.9020 1185.1686 1201.5944 1206.7592 1213.4996 1229.4835 1237.5461 1252.3680 1259.9411 1284.2143 1294.4426 1296.2526 1303.7888 1333.2987 1340.1536 1348.4068 1363.5071 1381.1603 1387.6316 1398.4467 1431.8247 1445.1139 1459.9287 1473.9712 1546.1993 1560.0065 1576.2866 1610.4217 1616.4454 1625.3807 1628.9722 1646.0847 1652.9176 1653.8553 1657.3421 1668.3020 1681.7225 1741.1824 1773.5333 1778.7882 1782.4177 1794.2014 1802.5035 1811.9330 1949.6529 3193.7972 3198.9356 3247.8224 3249.4674 3271.8410 3329.4259 3355.0412 3367.2308 3371.1488 3377.6478 3382.2725 3387.8716 3406.5551 3411.8475 3413.0620 3437.2128 3889.1976 8.3132 6.0406 7.7253 6.1315 4.2744 4.4587 6.2986 8.0878 6.6170 7.1578 3.5192 1.2216 6.1521 8.8466 6.2358 5.7482 7.2956 6.3813 5.5001 5.1121 4.3365 4.8498 5.4233 1.2821 4.9602 5.9065 8.2522 6.5218 8.4608 5.5336 7.0577 6.1880 7.8688 2.9456 6.2499 5.7406 7.7115 5.4596 5.7654 6.8539 3.9403 4.4586 1.5558 5.1965 5.5677 6.0917 4.7861 6.1304 4.7629 7.1289 3.3843 9.2149 7.0099 3.1171 6.2823 1.8204 4.5249 7.2591 3.8276 6.1934 2.9777 1.6077 6.8427 3.2336 2.1751 1.2651 6.9131 1.4067 8.0113 1.3547 1.4341 1.3593 2.3572 5.5405 1.3644 1.7012 1.6954 2.2844 3.8512 1.5066 1.7348 5.5186 3.2454 2.7900 5.0299 2.5909 2.9363 2.6739 1.9450 1.2675 7.1466 1.1583 1.6702 1.7833 6.9994 2.6329 2.9052 2.2690 1.4863 3.0934 3.5919 4.7711 1.3635 3.3120 1.3011 3.0760 2.1220 2.5406 1.3540 1.0468 1.2866 1.0519 2.2169 1.1643 1.8477 2.5522 7.3702 6.8738 5.8310 5.2333 5.7435 5.7297 5.1306 10.7943 1.0363 1.0365 1.1016 1.1065 1.1029 1.0992 1.0868 1.0905 1.0911 1.0942 1.0905 1.0978 1.0938 1.0944 1.0925 1.0927 1.0777 0.0001 0.0010 0.0026 0.0024 0.0028 0.0058 0.0107 0.0203 0.0287 0.0359 0.0260 0.0097 0.0686 0.1163 0.1047 0.1034 0.1445 0.1496 0.1365 0.1556 0.1624 0.1958 0.2235 0.0579 0.2715 0.3393 0.5866 0.4943 0.7167 0.5347 0.7111 0.6658 0.9053 0.3620 0.7785 0.8596 1.1849 0.9202 1.0093 1.3332 0.7767 0.9322 0.3364 1.1697 1.3555 1.5233 1.2794 1.6576 1.3203 2.0808 0.9936 2.9034 2.2992 1.0691 2.1734 0.6831 1.7334 2.7923 1.5251 2.8615 1.4026 0.7930 3.4062 1.7184 1.1663 0.6902 3.9309 0.8061 4.7539 0.8797 0.9519 0.9298 1.6477 3.8857 0.9905 1.2757 1.2802 1.7340 3.0944 1.2108 1.4357 4.6946 2.7846 2.4207 4.4797 2.3379 2.7134 2.5009 1.8899 1.2513 7.0750 1.1601 1.7493 1.8870 7.4981 2.8840 3.2652 2.5741 1.7126 3.7365 4.4195 5.9915 1.7453 4.6653 1.8656 4.5031 3.2425 3.9112 2.1076 1.6366 2.0540 1.6933 3.5727 1.8842 3.0299 4.2528 13.1649 12.7388 10.8703 9.7960 10.8935 10.9683 9.9243 24.1747 6.2281 6.2495 6.8465 6.8839 6.9560 7.1790 7.2074 7.2849 7.3061 7.3550 7.3503 7.4241 7.4783 7.5062 7.4982 7.6061 9.6047 2.4081 0.6701 0.0768 3.5832 1.1017 1.2235 0.4911 2.3809 1.8155 1.0762 0.4082 0.1580 1.0315 1.5782 6.6517 2.4475 7.3022 3.5324 0.9499 8.3820 0.1776 8.4063 0.7191 0.1337 1.7470 7.5698 2.0368 6.0951 12.1051 1.3988 0.4823 1.2316 1.7213 0.0962 9.5577 14.9555 5.3319 3.6794 5.8977 24.6751 0.0823 92.9941 70.0314 9.6395 35.6495 1.2349 24.9644 9.1503 98.1536 29.0571 12.3021 140.9143 12.4743 8.0969 34.6725 81.2472 10.0472 78.4303 13.2878 23.0107 5.1710 54.5536 14.4086 109.0537 30.4493 0.7642 275.1036 20.8258 99.9505 1.5284 2.0934 6.7576 17.7924 4.2794 0.6642 3.9977 2.1448 19.6774 151.1965 5.0980 6.5784 233.4251 109.9392 42.3830 170.5495 33.5106 145.4508 227.4636 15.7755 2.1952 3.7210 12.3343 6.2799 6.8430 208.8160 78.9705 8.6212 288.1398 53.8393 1217.8806 164.5608 596.2002 0.9852 80.9191 0.2423 63.5604 19.7691 238.4547 106.1163 2.6999 228.6007 7.7672 288.3839 93.4020 113.9500 149.6419 127.5353 26.3617 299.7057 6.9435 42.6642 658.5210 58.3390 284.0139 68.3868 55.2802 40.4458 65.2310 41.6045 36.7492 0.2186 12.9808 27.3056 49.8412 9.6471 24.8117 22.2051 4.3708 3.3166 6.9548 45.0913 1.6266 7.7874 1.5439 0.6657 4.3526 0.8354 1.9393 3.4914 0.6461 1.8706 1.0873 0.6663 2.4377 1.4197 3.4814 0.3730 2.1471 1.5243 0.9736 0.9726 1.2785 1.3222 1.3231 0.8661 2.1062 1.3544 6.1276 3.7092 3.9474 1.8540 3.8454 2.5758 2.7653 0.1417 2.7014 7.3479 13.6467 3.1290 2.6020 3.0128 1.2960 11.0576 3.4803 2.6386 0.9124 11.0367 6.7913 5.6426 2.0222 4.0376 2.1197 10.9530 18.9083 4.0985 4.7393 2.9809 5.0066 8.4285 0.6026 21.2356 15.1142 1.6439 18.0019 29.2251 8.9272 6.0703 37.2936 2.3632 22.0195 1.0633 2.4539 0.9004 4.3775 53.8610 0.0410 5.3945 5.5748 34.5717 4.6488 1.3407 1.5516 4.9114 9.6242 4.1827 22.3721 3.5075 59.8967 58.4556 8.9704 5.3670 82.1759 3.0603 4.4084 4.8023 2.6081 119.6974 147.6304 37.3500 38.3147 5.3550 566.7119 616.5335 6.5930 2.0569 6.8148 18.8473 11.2122 234.1642 9.7175 21.2618 55.0596 20.1054 231.4656 10.9542 7.3352 129.2139 216.0139 35.1098 1548.9065 5.5964 58.6231 683.6558 287.2110 391.1647 95.1893 149.4086 78.1254 60.1748 69.3208 89.1614 47.2400 131.5285 88.0657 68.7441 78.6660 259.5710 147.4293 87.4951 47.7016 40.8451 93.5628 0.7497 0.7499 0.7494 0.7500 0.7489 0.6285 0.7281 0.6715 0.6379 0.5782 0.7475 0.7460 0.7498 0.6433 0.7479 0.6962 0.6433 0.6138 0.7083 0.7076 0.7318 0.5790 0.6767 0.6431 0.2974 0.7019 0.1195 0.4263 0.2238 0.4666 0.3433 0.7415 0.2441 0.6773 0.2315 0.2198 0.2984 0.3112 0.1572 0.6383 0.7434 0.1980 0.5406 0.6124 0.7357 0.2766 0.7332 0.7149 0.6694 0.5627 0.6224 0.5891 0.1825 0.4136 0.3115 0.7488 0.7074 0.1924 0.2535 0.4035 0.3695 0.6890 0.2245 0.1985 0.2239 0.3271 0.3764 0.7494 0.1153 0.6970 0.5591 0.4890 0.3301 0.1443 0.5476 0.1523 0.1236 0.5624 0.4832 0.7401 0.5835 0.7035 0.7370 0.7457 0.6131 0.7103 0.2218 0.3439 0.6755 0.7331 0.1446 0.4881 0.3075 0.2168 0.4009 0.2560 0.3553 0.3995 0.2312 0.5161 0.2779 0.3170 0.3148 0.4457 0.5027 0.4510 0.3789 0.3117 0.6913 0.7495 0.4894 0.7380 0.3191 0.5642 0.4916 0.3304 0.2873 0.3790 0.3694 0.4283 0.6974 0.3026 0.3957 0.2793 0.0423 0.0118 0.7476 0.7482 0.7434 0.5035 0.7499 0.7362 0.3006 0.4485 0.5173 0.1142 0.1934 0.1554 0.2451 0.2375 0.1806 0.8569 0.8571 0.8567 0.8571 0.8564 0.7719 0.8426 0.8034 0.7789 0.7328 0.8555 0.8546 0.8570 0.7830 0.8558 0.8209 0.7829 0.7607 0.8293 0.8288 0.8452 0.7334 0.8072 0.7828 0.4584 0.8248 0.2135 0.5978 0.3658 0.6363 0.5111 0.8516 0.3924 0.8076 0.3759 0.3604 0.4596 0.4746 0.2717 0.7793 0.8528 0.3305 0.7018 0.7596 0.8477 0.4333 0.8461 0.8337 0.8020 0.7202 0.7673 0.7414 0.3087 0.5852 0.4750 0.8564 0.8286 0.3227 0.4045 0.5750 0.5396 0.8158 0.3667 0.3312 0.3659 0.4930 0.5470 0.8567 0.2068 0.8215 0.7172 0.6568 0.4964 0.2522 0.7077 0.2643 0.2200 0.7199 0.6516 0.8506 0.7370 0.8259 0.8486 0.8544 0.7602 0.8306 0.3630 0.5117 0.8063 0.8460 0.2526 0.6560 0.4704 0.3563 0.5723 0.4076 0.5243 0.5710 0.3756 0.6808 0.4349 0.4815 0.4788 0.6166 0.6690 0.6217 0.5496 0.4753 0.8175 0.8568 0.6571 0.8492 0.4838 0.7214 0.6592 0.4967 0.4464 0.5497 0.5395 0.5998 0.8217 0.4647 0.5670 0.4366 0.0812 0.0234 0.8556 0.8560 0.8528 0.6698 0.8571 0.8480 0.4622 0.6193 0.6818 0.2050 0.3240 0.2691 0.3937 0.3838 0.3059 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 6 6 6 6 6 7 6 16 7 6 8 6 6 6 6 6 6 7 16 8 8 6 6 6 6 6 6 8 6 17 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 12.00000 14.00307 12.00000 31.97207 14.00307 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 31.97207 15.99491 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 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 4645.1468 53363.3080 54572.0273 0.99998 -0.00383 -0.00455 0.00380 0.99997 -0.00681 0.00458 0.00680 0.99997 1 0.01865 0.00162 0.00159 0.38852 0.03382 0.03307 7.54 23.77 34.43 37.47 47.96 67.50 77.39 94.00 123.47 132.80 160.97 167.18 197.99 214.94 242.85 251.43 263.78 287.00 295.28 326.97 362.73 376.62 380.50 398.21 438.55 449.26 499.75 516.05 545.56 582.68 594.98 614.83 635.78 657.14 661.56 725.34 734.77 769.52 784.29 826.69 832.20 857.09 871.56 889.31 924.87 937.33 969.12 974.67 986.90 1012.68 1015.63 1052.15 1073.49 1097.77 1102.51 1148.21 1160.15 1162.54 1183.18 1274.09 1286.47 1316.43 1322.48 1366.43 1372.54 1384.50 1413.45 1418.90 1443.91 1510.48 1527.14 1550.24 1567.12 1569.75 1597.07 1623.18 1628.82 1633.07 1680.18 1680.35 1705.19 1728.83 1736.26 1745.96 1768.95 1780.55 1801.88 1812.77 1847.70 1862.41 1865.02 1875.86 1918.32 1928.18 1940.06 1961.78 1987.18 1996.49 2012.05 2060.08 2079.20 2100.51 2120.72 2224.64 2244.50 2267.92 2317.04 2325.70 2338.56 2343.73 2368.35 2378.18 2379.53 2384.55 2400.31 2419.62 2505.17 2551.72 2559.28 2564.50 2581.46 2593.40 2606.97 2805.12 4595.16 4602.55 4672.89 4675.26 4707.45 4790.30 4827.16 4844.69 4850.33 4859.68 4866.34 4874.39 4901.27 4908.89 4910.64 4945.38 5595.69 0.383583 0.410659 0.411603 0.320281 -2559.893329 -2559.866253 -2559.865308 -2559.956631 3.062988D-04 MUNgauss RevisionA2.1 retrievium 26-May-2021 DUDE Cc1cc(cc2c1nc(s2)NC(=O)c3ccccc3)[N-]S(=O)(=O)c4cc(ccc4OC)Cl C33007840 RHF 6-31G(d) (6D,10F) C1 486.034903 |X|Y|Z| 42.280738 33.258015 164.615901 61.400262 25 6 7 16 20 3 2 |36.858105| |12.626678|36.858105| |7.567509|13.895655|36.858105| |4.946588|7.724330|13.385653|36.858105| |4.386683|6.721999|7.898774|13.612117|36.858105| |5.025776|7.930872|7.023376|7.963322|13.737376|36.858105| |7.539817|13.586738|8.024160|6.757986|7.795786|13.746748|36.858105| |6.389377|7.664136|5.159940|4.530441|5.206825|8.113180|13.682745|53.358707| |4.504902|5.396190|4.187634|4.035403|4.988877|7.815010|8.701824|20.495007|36.858105| |3.754835|4.870439|4.276283|4.669327|6.741533|10.830690|7.418924|10.031899|10.870190|388.023441| |3.670953|4.001297|3.239581|3.115031|3.669358|4.985932|5.432942|11.311689|13.648096|48.603177|53.358707| |2.919705|3.179001|2.715030|2.696641|3.188859|4.067986|4.084469|7.242527|7.696871|41.795130|19.116068|36.858105| |2.681396|3.004304|2.649996|2.722925|3.305553|4.123321|3.850034|6.282384|6.615212|46.098562|11.517969|15.885872|73.516695| |2.547354|2.656318|2.295553|2.249413|2.562250|3.116712|3.215367|5.528865|5.048726|28.585856|10.715326|12.667538|14.356086|36.858105| |2.181179|2.279056|2.020064|2.007035|2.275139|2.679013|2.694309|4.393916|3.890437|24.223110|7.146418|7.706699|12.039571|13.702371|36.858105| |1.952466|2.001369|1.788625|1.765436|1.962253|2.262520|2.300564|3.683488|3.108162|19.505564|5.412599|5.070041|8.097290|7.918755|13.775947|36.858105| |1.964615|1.973758|1.752461|1.705942|1.869783|2.153862|2.237798|3.608791|2.955204|18.018191|5.132428|4.448691|6.802582|6.853128|7.939906|13.736683|36.858105| |2.216147|2.200877|1.921143|1.845620|2.017736|2.359841|2.507016|4.155794|3.372176|19.593822|6.064436|4.999868|7.146715|7.913887|6.877212|7.940647|13.759683|36.858105| |2.571742|2.590047|2.218602|2.128379|2.364067|2.846805|3.046823|5.277631|4.455602|24.406776|8.913744|7.476258|9.441054|13.707524|7.939294|6.877702|7.939464|13.748275|36.858105| |3.914751|5.221166|8.085771|13.935839|7.680750|5.154433|4.559629|4.657289|3.136902|25.567174|3.471756|2.273750|4.112372|1.943249|1.764648|1.573033|1.521954|1.630717|1.848061|53.358707| |3.000385|3.787516|4.967598|7.406031|6.210516|4.281152|3.607788|3.916848|2.766858|23.515280|3.140174|2.120452|3.920639|1.820304|1.680639|1.500870|1.439652|1.523455|1.713090|16.584541|388.023441| |2.737287|3.380950|4.198603|5.763359|5.342225|3.913769|3.301188|3.680856|2.640957|22.557970|3.034667|2.074556|3.867416|1.785757|1.668932|1.490438|1.418634|1.487115|1.664917|10.239728|93.256050|73.516695| |2.754625|3.455378|4.240233|6.057811|6.034380|4.260627|3.463841|3.847837|2.797405|24.639208|3.192521|2.187271|4.104249|1.868268|1.727273|1.537331|1.469432|1.552505|1.749211|10.157319|93.472179|13.942752|73.516695| |2.603880|3.074537|3.917075|4.875094|4.035391|3.137908|2.834569|3.200904|2.240999|18.104072|2.622289|1.783199|3.261623|1.568048|1.457781|1.321518|1.278457|1.350012|1.496718|10.063338|75.497952|13.165199|12.953629|36.858105| |2.318993|2.666335|3.281730|3.889204|3.342028|2.702188|2.474527|2.856776|2.010654|16.064501|2.387738|1.637258|2.996062|1.453316|1.363646|1.243062|1.200867|1.259891|1.386381|7.259550|49.746073|12.089398|9.227228|13.832113|36.858105| |2.071840|2.311928|2.771009|3.122615|2.722837|2.285612|2.138947|2.518580|1.771136|13.876612|2.134545|1.470067|2.677004|1.320728|1.243862|1.143089|1.109363|1.162124|1.268853|5.469751|33.612654|8.097225|6.983227|7.945007|13.727095|36.858105| |2.033442|2.241995|2.670911|2.946684|2.562166|2.178161|2.061540|2.439533|1.709119|13.252830|2.068104|1.422390|2.578561|1.283682|1.205466|1.111499|1.084245|1.139458|1.241657|5.073083|29.624260|6.651535|6.519757|6.852851|7.947691|13.886156|36.858105| |2.218043|2.469591|2.982797|3.314283|2.838497|2.388505|2.256812|2.644052|1.844285|14.332895|2.215266|1.515144|2.742356|1.360832|1.269084|1.166572|1.140420|1.204977|1.319246|5.801990|33.161857|6.812902|7.518740|7.915408|6.893812|7.984583|13.713200|36.858105| |2.530774|2.917767|3.652025|4.279546|3.562745|2.877196|2.662971|3.044669|2.119997|16.785267|2.502802|1.700431|3.088692|1.507483|1.397160|1.273524|1.240728|1.315328|1.453235|8.090577|48.210761|8.699837|10.580207|13.577110|7.922026|6.870570|7.898610|13.735283|36.858105| |2.741326|3.198840|4.002702|4.691359|3.913413|3.161264|2.922750|3.315386|2.300801|18.226698|2.696376|1.820844|3.299039|1.606130|1.475990|1.341152|1.310431|1.398281|1.553450|8.387251|45.141851|7.763350|11.311118|8.138945|5.290099|4.638236|5.215067|7.948537|14.264240|73.516695| |2.547406|2.860453|3.415479|3.729582|3.222578|2.750016|2.615892|3.048033|2.112882|16.321299|2.517953|1.705478|3.067985|1.523109|1.399531|1.281367|1.261078|1.348718|1.488811|6.030204|30.933068|5.885907|8.014604|5.240984|3.990358|3.813249|4.537878|6.780763|8.036293|24.331039|36.858105| |1.815607|1.988444|2.312571|2.542648|2.281454|1.969395|1.858938|2.231289|1.578414|12.251803|1.927997|1.338344|2.437256|1.213406|1.152630|1.065429|1.032962|1.075325|1.165531|4.200482|24.969380|6.532953|5.366551|4.752391|6.996460|10.860498|7.028835|4.758169|4.208314|5.778295|2.835309|448.794386| |17.539210|8.845721|5.888774|4.245845|3.934641|4.598342|6.710748|8.737426|4.542902|25.916626|5.193687|3.007147|4.829497|2.655180|2.241798|2.015326|2.054508|2.355222|2.743994|4.680259|19.366154|4.382398|4.582137|2.393592|2.126573|1.920788|1.907721|2.094315|2.371242|4.637209|2.481906|13.534684|0.500000| |17.541248|8.846790|5.890533|4.247393|3.935141|4.598624|6.711518|8.731778|4.541088|25.921254|5.186510|3.009980|4.848034|2.652466|2.272041|2.036624|2.051340|2.314133|2.681915|4.681458|19.422158|4.576465|4.451590|2.375067|2.160144|1.937264|1.883451|2.021032|2.278474|4.302558|2.246538|13.871369|0.303105|0.500000| |17.569984|8.868596|7.267717|4.710522|3.939556|4.186984|5.564732|6.408975|3.609163|22.613242|4.134400|2.505445|4.152111|2.225218|1.940750|1.758714|1.772247|1.978197|2.250678|5.398581|21.322873|4.832474|4.797608|2.692890|2.407546|2.171596|2.145367|2.340667|2.645589|5.052384|2.658566|15.235619|0.300736|0.300800|0.500000| |6.989335|8.974252|17.720832|8.951157|5.659843|5.030589|5.673265|5.644320|3.434264|24.499451|3.789966|2.374811|4.109713|2.057156|1.828573|1.640878|1.618257|1.768325|2.011444|10.397652|33.400234|7.049757|6.913395|4.051282|3.422716|2.938521|2.862388|3.202359|3.862759|7.389496|3.586960|19.556857|0.151895|0.151990|0.222606|0.500000| |3.518564|4.877779|5.605676|8.838019|17.773773|8.887219|5.590939|5.773375|4.325447|44.509903|4.546836|3.031185|5.768599|2.448027|2.214668|1.911169|1.803884|1.921956|2.232311|9.311562|48.731864|10.770172|13.283378|4.197446|3.480615|2.798869|2.606682|2.871256|3.621673|6.978058|3.189439|18.821638|0.089859|0.089791|0.089813|0.124040|0.500000| |3.837906|3.941897|3.134234|2.919278|3.304226|4.350336|5.068189|10.859877|9.551134|37.283265|26.067184|9.338013|10.844495|7.481482|4.959232|3.964554|3.950770|4.909504|7.370932|3.285318|15.360083|3.705304|3.856703|1.834274|1.677620|1.510613|1.468889|1.570840|1.761641|3.366507|1.782850|10.993183|0.113233|0.113519|0.087594|0.076089|0.082723|0.500000| |2.114947|2.247927|2.017512|2.035814|2.334267|2.726630|2.669709|4.251129|3.819028|25.235973|6.650215|7.256149|13.490284|8.961119|17.753151|8.893349|5.640103|4.957231|5.660658|2.443313|12.291990|3.078601|3.169478|1.489834|1.397126|1.269996|1.225024|1.286096|1.418617|2.653777|1.406805|9.464557|0.059629|0.060997|0.052484|0.050577|0.063963|0.122440|0.500000| |1.776644|1.825616|1.652105|1.641764|1.818565|2.064580|2.076996|3.252948|2.716745|17.620138|4.534630|4.137365|7.000183|5.638910|8.932410|17.716233|8.906176|5.645898|4.954353|2.009823|10.104749|2.523937|2.588291|1.257040|1.188739|1.095979|1.064135|1.112304|1.209684|2.253806|1.211236|8.243333|0.050581|0.051399|0.044854|0.042314|0.049615|0.091309|0.214302|0.500000| |1.792863|1.788615|1.602133|1.558858|1.692253|1.922530|1.996229|3.162306|2.539578|15.763127|4.246808|3.555658|5.615480|4.941121|5.646232|8.906117|17.710225|8.917853|5.645977|1.910229|9.470322|2.335889|2.412747|1.192999|1.125104|1.044533|1.022545|1.072787|1.160814|2.173349|1.181161|7.840159|0.052023|0.051943|0.045371|0.041428|0.045477|0.090911|0.123966|0.214665|0.500000| |2.169436|2.116637|1.849590|1.761096|1.899275|2.200765|2.365396|3.880586|3.046292|17.741598|5.250572|4.071451|5.968360|5.637872|4.954295|5.644143|8.909887|17.717275|8.926438|2.129340|10.352117|2.515152|2.630069|1.301723|1.215378|1.126409|1.108975|1.173578|1.275605|2.412988|1.317776|8.371491|0.064691|0.062819|0.054154|0.047696|0.050064|0.120423|0.107600|0.124069|0.214798|0.500000| |2.883217|2.860199|2.404154|2.269147|2.501880|3.049417|3.365542|6.009360|4.901772|25.435366|9.730821|6.840407|8.658602|8.872431|5.636745|4.955368|5.658732|8.959506|17.721639|2.659086|12.707355|3.054566|3.236887|1.561800|1.437633|1.315264|1.292119|1.380310|1.524336|2.916448|1.577546|9.642338|0.087483|0.083093|0.069254|0.060421|0.064675|0.247390|0.124232|0.107564|0.124444|0.216805|0.500000| |2.294305|2.650165|3.225046|3.853486|3.391830|2.744376|2.490937|2.883515|2.042304|16.443012|2.425464|1.668839|3.067157|1.477962|1.392635|1.266801|1.217985|1.272894|1.401229|6.940564|48.396339|14.654599|8.799620|9.028378|17.785366|8.868166|5.648949|4.968246|5.656298|7.612721|3.337189|53.160626|0.058032|0.060161|0.065570|0.091783|0.099251|0.047205|0.039819|0.033721|0.031672|0.033990|0.040175|0.500000| |1.857982|2.014875|2.353443|2.541586|2.242464|1.944883|1.858520|2.228351|1.563522|12.003861|1.910050|1.318619|2.385034|1.199024|1.129651|1.046945|1.023669|1.073866|1.163936|4.217971|23.989831|5.528345|5.429496|4.942896|5.648272|8.949833|17.734922|8.907294|5.632141|7.476915|3.933218|53.661269|0.048735|0.048086|0.054549|0.070092|0.063146|0.037833|0.031839|0.027901|0.026906|0.029109|0.033603|0.124067|0.500000| |2.121731|2.324254|2.753128|2.980013|2.585945|2.223195|2.125403|2.518346|1.755371|13.488002|2.124364|1.454676|2.623068|1.314560|1.225272|1.130884|1.110177|1.174750|1.281845|4.987093|27.359846|5.687025|6.494265|5.625280|4.966789|5.688919|8.971261|17.765704|8.890117|12.657592|7.569204|31.638061|0.056360|0.053572|0.062353|0.082238|0.072129|0.042006|0.034368|0.029946|0.029074|0.031899|0.037331|0.107849|0.216861|0.500000| |2.228916|2.478837|2.888836|3.168918|2.836158|2.448692|2.313154|2.743230|1.927036|14.949441|2.324491|1.592868|2.880394|1.431385|1.325122|1.218000|1.196981|1.273176|1.397153|5.045424|27.394056|5.421222|7.315169|4.723679|3.783413|3.751789|4.593976|6.760362|7.004807|16.456996|17.535920|22.704372|0.060599|0.055439|0.064141|0.083208|0.079650|0.045662|0.037089|0.032115|0.031240|0.034557|0.040894|0.088029|0.113632|0.228060|0.500000| |2.683084|3.023152|3.541040|3.822655|3.371430|2.923289|2.788943|3.256218|2.256535|17.372580|2.682822|1.810661|3.249003|1.612598|1.472111|1.344882|1.326830|1.426477|1.581206|5.831917|28.958050|5.536489|7.821743|4.411350|3.417682|3.199984|3.633425|4.935282|5.908606|17.091623|17.650098|19.870577|0.073873|0.065031|0.076857|0.101046|0.091826|0.052696|0.040967|0.035178|0.034441|0.038747|0.046793|0.082322|0.089403|0.147368|0.299883|0.500000| |2.573090|2.814287|3.354061|3.501462|2.965865|2.578113|2.516077|2.947497|2.018918|15.265928|2.418727|1.630761|2.909326|1.466828|1.347141|1.239130|1.225280|1.312682|1.443440|5.626123|27.534758|5.422093|6.735537|4.759661|3.805936|3.768568|4.607241|6.772636|7.050565|16.463981|17.540237|22.782272|0.069513|0.062943|0.076200|0.101419|0.079908|0.048007|0.037470|0.032532|0.031960|0.035782|0.042584|0.088520|0.113748|0.226348|0.298811|0.299842|0.500000| 2557.713492 -12937.369592 4636.263069 -251.433644 -5994.826675 3434.549700 -2560.276975 2.001002 408B000000000026 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