Version2.2 2021-02-10T14:35:49Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 16-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCc1ccc(cc1)c2[nH]c(=O)c3c(n2)CCN(C3)S(=O)(=O)c4ccc(cc4)F C35453131 RHF 6-31G(d) (6D,7F) CCc1ccc(cc1)c2[nH]c(=O)c3c(n2)CCN(C3)S(=O)(=O)c4ccc(cc4)F C01[X(C21H20F1N3O3S1)] 141 C1 479 CCc1ccc(cc1)c1nc2CCN(Cc2c(=O)[nH]1)S(=O)(=O)c1ccc(cc1)F CCc1ccc(cc1)c1nc2CCN(Cc2c(=O)[nH]1)S(=O)(=O)c1ccc(cc1)F CCc1ccc(cc1)C2=NC3=C(CN(CC3)[S](=O)(=O)c4ccc(F)cc4)C(=O)N2 InChIKey=RRLNKZVKNSIWPR-UHFFFAOYSA-N InChI=1S/C21H20FN3O3S/c1-2-14-3-5-15(6-4-14)20-23-19-11-12-25(13-18(19)21(26)24-20)29(27,28)17-9-7-16(22)8-10-17/h3-10H,2,11-13H2,1H3,(H,23,24,26) InChI=1/C21H20FN3O3S/c1-2-14-3-5-15(6-4-14)20-23-19-11-12-25(13-18(19)21(26)24-20)29(27,28)17-9-7-16(22)8-10-17/h3-10H,2,11-13H2,1H3,(H,23,24,26)/f/h24H CCc1ccc(cc1)c2[nH]c(=O)c3c(n2)CCN(C3)S(=O)(=O)c4ccc(cc4)F C01[X(C21H20F1N3O3S1)] 141 C01 479 CCc1ccc(cc1)c1nc2CCN(Cc2c(=O)[nH]1)S(=O)(=O)c1ccc(cc1)F CC[C]1[CH][CH][C]([CH][CH]1)c1nc2CCN(Cc2c(=O)[nH]1)S(=O)(=O)[C]1[CH][CH][C]([CH][CH]1)F CC[C]1[CH][CH][C]([CH][CH]1)C2=NC3=C(CN(CC3)[S](=O)(=O)[C]4[CH][CH][C](F)[CH][CH]4)C(=O)N2 InChIKey=RRLNKZVKNSIWPR-UHFFFAOYSA-N InChI=1S/C21H20FN3O3S/c1-2-14-3-5-15(6-4-14)20-23-19-11-12-25(13-18(19)21(26)24-20)29(27,28)17-9-7-16(22)8-10-17/h3-10H,2,11-13H2,1H3,(H,23,24,26) InChI=1/C21H20FN3O3S/c1-2-14-3-5-15(6-4-14)20-23-19-11-12-25(13-18(19)21(26)24-20)29(27,28)17-9-7-16(22)8-10-17/h3-10H,2,11-13H2,1H3,(H,23,24,26)/f/h24H 2804.4414472685 -1691.733685 1-A 20192.7058 108 371 479 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -92.20621 -26.32877 -20.55061 -20.54941 -20.53454 -15.63480 -15.60167 -15.56658 -11.36539 -11.35851 -11.35027 -11.30146 -11.27796 -11.27731 -11.27516 -11.27392 -11.27290 -11.26501 -11.26291 -11.26162 -11.25766 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455.8077 462.5322 464.9421 518.6322 532.0950 558.0755 566.8959 588.9561 601.5902 605.4070 628.5183 649.3347 671.5104 691.6682 692.7323 702.5666 729.7650 743.0483 785.3720 797.3983 812.9183 831.6022 840.1436 854.9465 860.7753 875.8442 909.8511 935.3427 946.6023 953.3292 960.2214 973.5527 1025.2428 1040.9625 1054.3151 1089.5890 1091.2380 1104.1088 1111.8052 1113.4527 1113.9486 1115.9305 1126.0433 1150.8736 1160.6184 1183.5283 1190.8791 1192.6987 1198.5976 1209.3291 1237.5773 1266.2100 1277.9053 1284.1029 1298.9624 1306.6708 1316.0500 1319.1743 1324.5715 1338.9657 1355.6263 1388.2964 1396.2232 1400.0633 1425.7687 1439.2283 1445.3029 1462.2274 1471.2931 1474.8335 1495.7271 1524.3468 1559.3686 1560.5624 1561.9249 1568.6608 1600.7780 1613.5834 1635.4548 1640.3426 1640.4826 1653.5338 1654.6277 1663.2729 1683.1887 1695.9597 1757.0180 1786.1113 1788.2739 1805.9957 1819.8342 1837.3490 1954.0020 3176.5254 3182.4267 3205.7701 3215.1763 3227.9315 3245.7988 3271.4882 3272.5565 3278.9475 3330.1297 3343.9444 3357.1934 3362.2939 3376.8327 3401.6732 3403.7472 3415.4677 3418.5974 3419.8695 3868.3199 7.2534 4.4697 3.5435 5.2883 3.9985 3.8150 4.7929 5.3536 4.1794 5.5492 5.0323 5.9509 8.1427 5.0484 2.7851 4.1656 1.6007 3.0790 8.5173 10.3282 3.8922 3.6777 3.3072 3.8543 8.6759 3.4874 5.3136 4.4488 2.9437 5.0829 3.1279 3.9986 6.1827 4.3697 3.8618 5.6424 8.9221 3.4667 4.3242 4.2918 4.3881 6.1019 4.1970 5.8973 2.5833 2.7471 4.0129 3.6767 3.7564 3.5830 3.8753 1.1713 4.2532 6.7253 6.6584 1.2405 1.4502 1.5850 1.4063 2.7900 4.8145 2.3809 2.8673 1.3701 1.3252 1.9631 2.2865 1.5693 1.4781 2.2235 2.4227 2.5088 1.9436 1.8890 1.6804 2.7163 4.3306 1.8828 2.6558 5.2939 3.6166 1.2383 4.2365 2.3447 1.3470 2.7874 2.6605 1.4431 3.5884 1.3462 3.9445 1.2721 2.1746 1.2994 2.0968 1.3296 1.5064 5.2752 1.5031 1.4351 1.6972 2.8456 1.2372 2.1414 2.6727 1.1700 1.1001 1.1697 1.9308 1.0979 1.0996 1.0970 2.5371 2.6423 5.7921 6.8238 6.0732 5.5297 5.4506 9.0667 9.1228 1.0733 1.0744 1.0360 1.0610 1.0623 1.1052 1.1034 1.1032 1.1046 1.0910 1.0928 1.0888 1.0913 1.0955 1.0912 1.0918 1.0939 1.0957 1.0962 1.0788 0.0009 0.0012 0.0024 0.0052 0.0042 0.0056 0.0139 0.0221 0.0297 0.0527 0.0631 0.1012 0.1698 0.1110 0.0803 0.1223 0.0527 0.1311 0.4056 0.5622 0.2416 0.2400 0.2274 0.3127 0.7572 0.3610 0.5655 0.5218 0.3603 0.6407 0.3984 0.6337 1.0314 0.8018 0.7312 1.1531 1.9025 0.7486 1.0065 1.0662 1.1658 1.7199 1.1867 1.7150 0.8106 0.8936 1.4584 1.3774 1.4626 1.4599 1.6116 0.5044 1.8567 3.0396 3.2476 0.6394 0.7656 0.8487 0.7640 1.5580 2.9816 1.5201 1.8779 0.9584 0.9298 1.4100 1.6652 1.1463 1.0807 1.6314 1.8099 1.9578 1.5426 1.5590 1.4041 2.2766 3.6656 1.6224 2.3966 5.0007 3.4797 1.2030 4.2117 2.3587 1.3746 2.8580 2.7502 1.5243 3.8853 1.5288 4.5306 1.4692 2.6045 1.5859 2.5806 1.6749 1.9213 6.7605 1.9813 1.9647 2.4315 4.0831 1.7783 3.1047 4.0351 1.7948 1.7336 1.8544 3.0615 1.7686 1.7737 1.7881 4.2349 4.4778 10.5352 12.8261 11.4430 10.6263 10.6354 18.0337 20.5224 6.3809 6.4112 6.2728 6.4622 6.5216 6.8599 6.9580 6.9609 6.9972 7.1283 7.1993 7.2304 7.2689 7.3601 7.4397 7.4526 7.5184 7.5444 7.5540 9.5112 0.3102 0.2139 0.1941 0.1873 0.0445 0.0192 0.7851 0.9635 1.2106 1.2484 0.2226 2.5724 2.7501 0.3351 5.7138 5.2320 1.3107 1.3639 2.4669 1.2430 0.2423 1.5438 1.5409 2.9333 0.2528 0.8068 1.1299 12.2546 0.6274 4.7644 0.6668 3.2515 1.7788 12.6727 6.2044 3.8675 147.8835 24.2159 47.2378 64.1612 7.3949 1.3378 5.9895 4.6625 102.8236 23.3273 7.7761 36.9058 19.1176 122.1089 18.7731 0.2419 3.3535 67.3958 52.5547 0.2079 17.7715 52.8153 17.9852 13.8408 11.8567 2.9631 138.8685 0.1489 0.5596 48.6829 1.5562 2.6651 0.2953 11.1062 68.0895 24.1051 14.8134 23.7991 3.5000 10.2431 87.3956 8.1646 80.1725 178.3988 113.6171 18.3068 11.5629 25.4054 3.7614 32.8637 2.4617 30.4451 20.2198 16.2774 116.2677 1.6473 72.6049 14.9230 20.8162 33.8489 35.7507 119.1537 11.1376 4.0870 6.5003 16.7516 0.9925 4.6327 65.3188 2.7398 3.4091 22.2222 17.2955 2.8358 2.3561 6.0967 93.7994 84.4340 222.1341 54.5022 531.9459 115.9889 47.6286 258.0192 796.8991 21.8488 50.6217 42.7764 35.1460 17.3028 5.7485 17.7951 66.3339 48.5690 2.5636 3.8123 15.7100 19.7741 15.5555 3.0964 1.2888 1.9595 0.7446 1.4711 70.4891 2.7337 2.0401 1.4479 1.1942 4.5831 8.6680 0.2539 0.7902 0.1783 2.1267 1.0034 1.9101 0.1429 0.3563 1.1820 0.2685 0.0749 1.1121 1.4279 4.8874 1.6683 0.8743 5.1614 0.6446 1.3002 3.5659 0.3599 3.8465 1.4475 0.2962 0.0716 1.7546 2.2824 1.0891 3.2015 1.4911 0.6428 2.0377 1.9014 0.4165 1.8789 9.2573 5.0646 5.8418 2.8040 1.2053 0.8643 2.5438 17.1989 26.6405 4.0515 0.2997 7.5887 6.1452 22.1716 1.8337 2.2934 3.1716 3.2755 3.7460 5.1809 11.6668 2.4424 2.8304 0.2151 8.6929 0.1545 1.0265 0.0525 1.5879 10.3958 3.7689 7.2255 22.2217 2.0116 17.0932 3.0262 1.8210 22.8338 5.2272 10.2544 4.3290 1.0352 38.6520 14.6590 3.7227 11.6777 13.5421 7.6803 0.8767 3.1230 21.6824 301.5572 0.9516 5.9478 13.2159 0.9149 3.9047 15.5650 2.4017 3.7160 0.4894 5.7776 9.1338 7.6094 23.0998 37.8829 18.9380 10.2576 17.4434 0.5781 6.4635 1.1339 2.5724 192.0363 58.0478 587.7688 30.5617 600.1604 87.9021 18.1502 82.5564 77.1601 97.0475 140.6118 105.6796 100.0840 71.6227 176.5293 13.7165 52.4620 61.8655 56.1013 82.9057 105.6177 59.6807 91.0735 58.3741 42.4848 126.3984 41.1899 0.7438 0.7482 0.6608 0.7241 0.7223 0.7396 0.7192 0.5804 0.6173 0.6616 0.2955 0.1868 0.5430 0.4516 0.7345 0.6934 0.6876 0.6537 0.6144 0.4051 0.6996 0.7500 0.4394 0.6930 0.5425 0.5991 0.2420 0.5746 0.4607 0.2650 0.2771 0.3301 0.1812 0.7159 0.2842 0.5289 0.3514 0.2363 0.6982 0.4014 0.1744 0.6446 0.1913 0.4420 0.7280 0.7142 0.2994 0.2329 0.1737 0.0958 0.4566 0.7460 0.0800 0.7047 0.0947 0.7482 0.4725 0.6074 0.4031 0.1603 0.2293 0.7176 0.7132 0.5563 0.2473 0.3913 0.7133 0.5930 0.7352 0.4053 0.2684 0.3910 0.4622 0.1174 0.6018 0.2591 0.6769 0.7487 0.1012 0.1087 0.0469 0.7316 0.5355 0.2245 0.1416 0.4026 0.1608 0.3673 0.3142 0.6330 0.1890 0.4967 0.3075 0.6569 0.1461 0.4756 0.6521 0.6538 0.3999 0.4036 0.4097 0.5040 0.4755 0.1689 0.5496 0.6198 0.6498 0.7056 0.4995 0.6433 0.7428 0.4596 0.5780 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0.05206 0.05118 20.52 30.08 48.78 58.73 60.89 71.84 100.94 120.55 158.11 182.68 209.93 244.47 270.70 277.95 318.36 321.17 339.98 386.79 409.02 437.33 467.01 478.87 491.53 533.89 553.77 603.11 611.49 641.92 655.81 665.48 668.95 746.20 765.57 802.95 815.64 847.38 865.55 871.05 904.30 934.25 966.15 995.16 996.69 1010.84 1049.97 1069.08 1129.98 1147.28 1169.61 1196.49 1208.78 1230.08 1238.46 1260.14 1309.07 1345.75 1361.95 1371.63 1381.54 1400.73 1475.10 1497.71 1516.92 1567.68 1570.05 1588.57 1599.64 1602.01 1602.72 1605.58 1620.13 1655.85 1669.87 1702.83 1713.41 1716.03 1724.51 1739.95 1780.60 1821.79 1838.62 1847.54 1868.92 1880.01 1893.50 1898.00 1905.76 1926.47 1950.44 1997.45 2008.85 2014.38 2051.36 2070.73 2079.47 2103.82 2116.86 2121.96 2152.02 2193.20 2243.58 2245.30 2247.26 2256.95 2303.16 2321.59 2353.05 2360.09 2360.29 2379.07 2380.64 2393.08 2421.73 2440.11 2527.96 2569.82 2572.93 2598.42 2618.34 2643.54 2811.37 4570.31 4578.80 4612.39 4625.92 4644.27 4669.98 4706.94 4708.48 4717.67 4791.31 4811.19 4830.25 4837.59 4858.51 4894.25 4897.23 4914.10 4918.60 4920.43 5565.65 0.414291 0.437691 0.438635 0.357800 -1691.319394 -1691.295994 -1691.295050 -1691.375885 2.711219D-04 MUNgauss RevisionA2.1 retrievium 10-Feb-2021 DUDE CCc1ccc(cc1)c2[nH]c(=O)c3c(n2)CCN(C3)S(=O)(=O)c4ccc(cc4)F C35453131 RHF 6-31G(d) (6D,10F) C1 413.120942 |X|Y|Z| 133.054203 37.407827 33.014123 54.772633 23 6 7 16 19 3 1 |36.858105| |12.419039|36.858105| |7.514763|12.589916|36.858105| |5.685903|7.535379|13.682931|36.858105| |4.174701|5.008923|7.885962|13.799863|36.858105| |3.741365|4.411274|6.790033|7.920237|13.689308|36.858105| |4.153112|5.008831|7.892713|6.905609|7.958176|13.704053|36.858105| |5.641029|7.540524|13.714140|7.985952|6.896357|7.909826|13.767652|36.858105| |2.919071|3.283335|4.441351|5.074487|7.682695|12.837187|7.572602|5.037370|36.858105| |2.582574|2.900454|3.748218|3.962915|5.212899|7.826782|6.550284|4.456750|14.034555|53.358707| |2.648693|3.023903|3.899986|3.919641|4.876629|7.329416|7.297892|4.878068|9.280031|26.016245|0.500000| |2.182934|2.396499|2.950013|3.120722|3.913088|5.082760|4.456505|3.372520|7.857302|18.708934|0.261834|36.858105| |2.001173|2.191562|2.630022|2.705486|3.238545|4.070450|3.843301|3.025505|5.438125|11.527831|0.218329|15.856412|73.516695| |2.070303|2.234295|2.716246|2.973043|3.765724|4.527334|3.764197|2.970606|6.992099|10.966747|0.162276|13.157319|14.310843|36.858105| |2.249672|2.419780|2.985183|3.410865|4.523438|5.212464|4.000426|3.168371|8.378173|9.813301|0.145497|7.918521|9.580689|14.151979|36.858105| |2.676411|2.921631|3.778686|4.514089|6.675876|7.941429|5.248745|3.985495|14.874925|11.237162|0.165366|6.765825|8.437530|7.933854|13.870720|53.358707| |2.049990|2.162334|2.583044|2.975430|3.759382|3.947255|3.154474|2.647503|5.276246|6.259326|0.103023|5.010008|7.001954|7.690508|12.677980|10.668211|36.858105| |1.770561|1.866320|2.177740|2.442938|2.958225|3.122161|2.624162|2.244358|4.003960|5.230570|0.089425|4.512816|6.774156|6.825653|7.613472|6.947566|12.509090|36.858105| |1.705061|1.791398|2.084630|2.277200|2.724111|2.987405|2.594064|2.199168|3.865384|5.420398|0.093195|5.070843|7.902199|7.842404|6.842791|6.251883|7.861431|13.039055|53.358707| |1.782547|1.899147|2.236417|2.411865|2.913031|3.334742|2.920171|2.414810|4.503817|6.932495|0.116918|7.570052|11.821835|12.653276|7.551837|6.821118|6.429881|7.734315|17.745394|36.858105| |1.496135|1.556473|1.772934|1.907196|2.209890|2.386581|2.141842|1.862651|2.917362|4.126862|0.074307|3.710343|6.257051|4.821466|4.314501|4.494098|4.893869|7.124182|15.812082|7.173606|388.023441| |1.466906|1.520581|1.726359|1.825525|2.095279|2.302755|2.116637|1.839168|2.789984|4.068402|0.074486|3.703595|6.532562|4.495790|3.834768|4.136598|3.987035|4.992171|10.522605|6.575245|94.848145|73.516695| |1.455108|1.498998|1.693304|1.833241|2.105008|2.220377|1.987207|1.753844|2.646762|3.609139|0.065396|3.080984|5.109508|3.916070|3.826075|4.146047|4.692933|6.569142|10.522607|5.000252|94.748583|13.586100|73.516695| |1.380530|1.448803|1.635910|1.755565|2.011346|2.149037|1.942837|1.709060|2.575994|3.686925|0.067833|3.282789|5.738256|4.011139|3.569568|3.869978|3.912466|5.580356|9.429325|5.676213|76.424143|13.116243|13.107606|36.858105| |1.336332|1.408969|1.586093|1.681673|1.912637|2.066290|1.898974|1.671775|2.459110|3.624901|0.067929|3.268541|5.998015|3.762082|3.216939|3.574004|3.303471|4.310468|7.303288|5.265600|49.429707|11.544149|8.853818|13.715999|36.858105| |1.253152|1.325319|1.479365|1.564710|1.760119|1.881229|1.740141|1.550055|2.193615|3.216917|0.061276|2.816809|5.209192|3.124832|2.744722|3.150655|2.806774|3.523770|5.452742|4.012773|33.618125|7.872386|6.834589|7.941855|13.775338|36.858105| |1.215611|1.284273|1.426672|1.519730|1.702616|1.789767|1.644632|1.477640|2.064387|2.959437|0.056294|2.524395|4.550742|2.829847|2.583836|2.999683|2.722105|3.435512|4.964393|3.483571|30.061986|6.621301|6.619039|6.968380|8.022241|13.811023|36.858105| |1.246004|1.311402|1.459051|1.569478|1.765788|1.836880|1.668148|1.499432|2.124046|2.981519|0.056050|2.519762|4.416036|2.915323|2.741857|3.154902|3.016122|3.951137|5.453517|3.570225|33.618702|6.837021|7.869788|7.942296|6.842779|7.872214|13.806454|36.858105| |1.327716|1.392355|1.561237|1.687613|1.919939|2.008160|1.806789|1.608975|2.362607|3.298490|0.061025|2.828804|4.869305|3.412906|3.212416|3.580268|3.659420|5.171527|7.305041|4.370009|49.425729|8.857229|11.536447|13.716888|7.896619|6.843396|8.022613|13.779297|36.858105| |1.143250|1.209172|1.332699|1.413808|1.567349|1.636755|1.515793|1.375208|1.856683|2.655334|0.051145|2.220716|4.027542|2.425039|2.241091|2.666928|2.334680|2.828450|3.991392|2.862005|23.234181|5.290258|5.289088|4.694381|5.322134|8.187965|14.385330|8.189370|5.323106|97.533100| |17.552129|8.783796|5.485703|4.439888|3.421276|3.104722|3.408909|4.418247|2.511548|3.082053|0.064647|1.949168|3.213084|1.854468|1.997220|3.168813|1.840921|1.612054|2.116411|1.619690|9.805924|2.406766|2.391077|1.281042|1.243252|1.172050|1.139829|1.166491|1.236658|2.423286|0.500000| |17.557824|8.762129|6.805894|6.015258|4.405805|3.774485|3.956353|5.009810|2.972142|3.499212|0.071786|2.185350|3.524270|2.111285|2.334011|3.805084|2.156250|1.843603|2.392164|1.816181|10.938074|2.662966|2.680476|1.412232|1.356486|1.269018|1.235845|1.274830|1.363584|2.608956|0.301201|0.500000| |17.557266|8.763592|6.804049|5.051425|3.979524|3.772467|4.368680|5.938533|2.965947|3.615789|0.076140|2.243027|3.669651|2.110337|2.273068|3.662909|2.055400|1.776462|2.355744|1.816903|10.816801|2.673786|2.622227|1.393879|1.352208|1.262564|1.218183|1.245767|1.331707|2.571278|0.301177|0.301823|0.500000| |8.849142|17.548983|8.924796|7.125169|4.726879|3.972999|4.224833|5.686877|3.048866|3.658715|0.077040|2.253975|3.667498|2.127887|2.316074|3.775857|2.099532|1.821718|2.355346|1.822222|10.722136|2.599648|2.592523|1.415206|1.373841|1.299606|1.267361|1.296912|1.370696|2.694981|0.213171|0.210642|0.172961|0.500000| |8.848993|17.550471|8.921526|5.664783|4.214869|3.971104|4.734877|7.159418|3.042514|3.791906|0.082463|2.317115|3.831179|2.127076|2.257073|3.638074|2.006863|1.757403|2.320946|1.823061|10.609244|2.609794|2.540223|1.396935|1.369491|1.292775|1.248512|1.266607|1.338611|2.653883|0.213132|0.172948|0.210709|0.303980|0.500000| |5.591878|6.992156|8.907093|17.704825|8.966244|5.645247|4.967985|5.663411|4.138084|4.521541|0.090417|2.729560|4.254433|2.664872|3.068409|5.329194|2.785676|2.311019|2.894888|2.212832|12.812545|3.044402|3.114911|1.670188|1.592845|1.491307|1.461316|1.516561|1.623664|3.072664|0.125997|0.175434|0.129989|0.212901|0.143506|0.500000| |3.562222|4.086208|5.623768|8.922547|17.761292|8.940392|5.663146|4.967576|7.160943|6.577979|0.120262|3.841096|5.588500|3.918362|4.974510|10.153110|4.300979|3.283202|3.962757|3.039815|16.600599|3.856193|3.993330|2.125239|1.993032|1.832716|1.789451|1.877253|2.050563|3.693653|0.083721|0.107007|0.093655|0.111967|0.097021|0.215976|0.500000| |3.555296|4.101113|5.645258|4.969480|5.639138|8.857677|17.714033|8.987683|6.921095|9.758304|0.247909|4.877255|7.721462|3.887858|3.910261|6.550155|3.045803|2.591008|3.589783|3.037933|15.579322|3.920087|3.566541|1.981477|1.958660|1.786901|1.669741|1.679059|1.819538|3.456165|0.083654|0.093302|0.106510|0.097468|0.112714|0.107787|0.124055|0.500000| |5.518060|6.988000|8.911080|5.660743|4.963478|5.641861|8.955293|17.707733|4.104776|5.267848|0.120450|3.046063|5.014968|2.663077|2.768698|4.539614|2.345852|2.031470|2.746007|2.217882|12.351179|3.082031|2.904864|1.600855|1.578279|1.469044|1.396381|1.408663|1.504333|2.936681|0.124851|0.128398|0.171460|0.144054|0.214509|0.124213|0.107761|0.218429|0.500000| |2.064040|2.135070|2.530613|2.889654|3.579228|3.738520|3.052729|2.591230|4.775009|5.631382|0.094657|4.394497|6.309592|6.215067|9.000119|9.221789|17.549014|8.855678|9.360392|5.455151|33.585770|7.050411|8.533980|3.590657|3.032815|2.571450|2.488996|2.756311|3.348696|4.832079|0.051448|0.060753|0.057921|0.057214|0.054850|0.075403|0.111802|0.082126|0.064146|0.500000| |2.105494|2.231581|2.660234|3.150395|3.993924|3.951975|3.100663|2.653536|4.997460|5.672949|0.095689|4.275152|6.110457|5.834923|8.997167|10.082963|17.566669|8.837057|7.707219|4.912117|28.442231|5.870050|7.072056|3.437956|2.940196|2.584097|2.566539|2.862579|3.370277|5.042060|0.052551|0.062063|0.057856|0.060975|0.057001|0.083552|0.133736|0.081041|0.064749|0.302775|0.500000| |1.670610|1.741749|2.002944|2.241433|2.655208|2.740699|2.339799|2.041978|3.359608|4.344308|0.076221|3.620287|5.616463|4.988460|5.565346|5.694125|8.876599|17.679835|12.474680|5.648274|50.114577|8.464177|14.232833|5.487624|4.056666|3.369166|3.390717|4.069035|5.492039|6.293521|0.042499|0.048558|0.046493|0.047417|0.045504|0.059718|0.081917|0.063937|0.051678|0.220214|0.206638|0.500000| |1.728450|1.843010|2.144752|2.411153|2.908510|3.042555|2.558443|2.199923|3.857815|5.115080|0.088579|4.404920|6.735495|6.290028|6.666636|6.472535|8.830945|17.490029|12.323428|7.044835|42.575110|7.764885|9.518836|5.684392|4.503330|3.816319|3.806270|4.402078|5.564133|7.036397|0.043873|0.049771|0.047842|0.050359|0.048380|0.063656|0.090062|0.069895|0.055324|0.173807|0.218119|0.300730|0.500000| |1.694305|1.820561|2.127084|2.287317|2.729759|3.084834|2.728838|2.285529|4.037927|6.311404|0.110503|6.703897|11.527014|8.927589|6.006646|5.913747|5.284207|6.614276|12.251436|17.485648|45.057760|10.182028|7.967511|6.175424|6.192074|4.764052|4.026631|3.991510|4.728540|7.352530|0.043014|0.047724|0.047685|0.048874|0.048836|0.058657|0.079137|0.078645|0.058603|0.122444|0.121662|0.139781|0.195639|0.500000| |1.730598|1.830183|2.138851|2.261918|2.682742|3.107001|2.817118|2.339533|4.065063|6.463387|0.113085|7.013032|12.334854|8.968047|5.847477|5.855264|5.018894|5.671217|12.479628|17.663638|48.615935|13.738601|8.374166|5.233222|5.173612|3.886862|3.271820|3.267376|3.929732|6.106008|0.043793|0.048715|0.049435|0.048441|0.049148|0.057476|0.076131|0.083294|0.060533|0.128796|0.110467|0.127709|0.141983|0.302386|0.500000| |1.360682|1.433770|1.617546|1.700372|1.933806|2.120007|1.968730|1.723249|2.533864|3.817907|0.071912|3.515230|6.661878|3.942594|3.254562|3.622951|3.223550|4.034807|7.216184|5.646577|47.224405|13.259355|8.175400|8.914217|17.757547|8.925099|5.682205|4.939794|5.633333|9.620567|0.035115|0.038220|0.038454|0.038608|0.038849|0.044425|0.055373|0.057096|0.045393|0.083221|0.078577|0.103290|0.113308|0.180568|0.168392|0.500000| |1.215104|1.287266|1.431134|1.501359|1.677055|1.799395|1.683971|1.505669|2.077864|3.081266|0.059533|2.682147|5.078402|2.872657|2.508167|2.932386|2.505466|3.026827|4.668404|3.579470|27.702162|6.860628|5.726256|5.631751|8.861767|17.750718|8.954849|5.633058|4.939703|16.744323|0.031648|0.034022|0.034048|0.035036|0.035066|0.039690|0.048097|0.048304|0.039879|0.064156|0.064457|0.079806|0.090340|0.117525|0.098811|0.212898|0.500000| 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