Version2.2 2021-02-09T16:15:53Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 06-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCCn1c2c(c(cs2)c3ccccc3)c(=O)n(c1=O)Cc4ccc(cc4)Cl C37638835 RHF 6-31G(d) (6D,7F) CCCCn1c2c(c(cs2)c3ccccc3)c(=O)n(c1=O)Cc4ccc(cc4)Cl C01[X(C23H21Cl1N2O2S1)] 144 C1 485 CCCCn1c(=O)n(Cc2ccc(cc2)Cl)c(=O)c2c1scc2c1ccccc1 CCCCn1c(=O)n(Cc2ccc(cc2)Cl)c(=O)c2c1scc2c1ccccc1 CCCCN1C(=O)N(Cc2ccc(Cl)cc2)C(=O)c3c1scc3c4ccccc4 InChIKey=HVWPKCCRHINOPW-UHFFFAOYSA-N InChI=1S/C23H21ClN2O2S/c1-2-3-13-25-22-20(19(15-29-22)17-7-5-4-6-8-17)21(27)26(23(25)28)14-16-9-11-18(24)12-10-16/h4-12,15H,2-3,13-14H2,1H3 InChI=1/C23H21ClN2O2S/c1-2-3-13-25-22-20(19(15-29-22)17-7-5-4-6-8-17)21(27)26(23(25)28)14-16-9-11-18(24)12-10-16/h4-12,15H,2-3,13-14H2,1H3 CCCCn1c2c(c(cs2)c3ccccc3)c(=O)n(c1=O)Cc4ccc(cc4)Cl C01[X(C23H21Cl1N2O2S1)] 144 C01 485 CCCCn1c(=O)n(Cc2ccc(cc2)Cl)c(=O)c2c1scc2c1ccccc1 CCCCN1C(=O)N(C[C]2[CH][CH][C]([CH][CH]2)Cl)C(=O)[C]2[C]1SC=[C]2[C]1[CH][CH][CH][CH][CH]1 CCCCN1[C]2SC=C([C]3[CH][CH][CH][CH][CH]3)[C]2C(=O)N(C[C]4[CH][CH][C](Cl)[CH][CH]4)C1=O InChIKey=HVWPKCCRHINOPW-UHFFFAOYSA-N InChI=1S/C23H21ClN2O2S/c1-2-3-13-25-22-20(19(15-29-22)17-7-5-4-6-8-17)21(27)26(23(25)28)14-16-9-11-18(24)12-10-16/h4-12,15H,2-3,13-14H2,1H3 InChI=1/C23H21ClN2O2S/c1-2-3-13-25-22-20(19(15-29-22)17-7-5-4-6-8-17)21(27)26(23(25)28)14-16-9-11-18(24)12-10-16/h4-12,15H,2-3,13-14H2,1H3 2949.3267142662 -1998.8779573 1-A 16007.7485 111 374 485 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -104.81996 -91.99936 -20.54758 -20.54553 -15.64313 -15.62727 -11.40992 -11.37688 -11.34882 -11.29642 -11.28571 -11.27336 -11.27130 -11.26967 -11.25474 -11.24693 -11.24297 -11.24058 -11.24045 -11.23668 -11.23636 -11.23401 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436.6215 452.8682 455.9257 460.9220 465.8611 482.8620 508.7486 518.7259 589.5727 595.0984 624.8527 631.9424 676.9722 686.1291 697.0437 706.1067 717.5813 741.0851 774.2058 787.5905 806.6502 811.9433 844.5393 853.7232 862.2379 868.1570 878.5014 894.2301 895.6879 934.6285 951.4766 955.1966 961.0889 977.7005 989.3528 1017.3978 1042.6395 1047.6763 1083.2747 1090.4924 1096.5412 1099.1506 1102.4115 1111.7947 1113.9532 1117.1037 1123.9860 1136.0517 1138.4648 1185.0061 1191.3370 1203.0765 1215.6977 1229.9111 1234.0811 1252.8103 1304.9205 1306.7348 1310.8515 1322.6198 1326.4247 1334.9474 1341.8878 1348.9804 1397.7509 1422.2525 1441.5979 1454.4286 1458.7085 1469.7682 1480.8587 1500.7244 1510.3157 1524.9614 1538.8828 1567.1891 1571.6164 1574.3367 1609.2446 1630.7202 1636.3623 1640.1480 1643.4306 1644.1913 1648.9369 1657.4985 1668.3994 1674.5268 1701.3400 1751.8426 1771.2432 1782.2929 1807.7223 1813.5281 1908.0026 1964.0116 3189.7889 3201.0625 3209.1316 3218.6743 3253.4774 3264.6481 3268.0242 3272.0133 3319.9201 3344.6080 3356.0252 3366.3736 3373.9217 3377.2275 3387.0630 3388.9303 3389.9910 3399.8480 3404.6638 3406.1827 3448.4069 6.5087 7.9481 4.9249 4.4169 4.3585 4.4257 4.7639 1.8845 5.4444 6.0765 5.8830 2.9940 5.9729 8.4911 6.8111 4.4542 4.9295 4.5133 1.1707 5.6794 8.2680 7.9254 6.2357 4.4569 5.7091 4.9152 4.0068 6.9029 6.2040 2.9979 2.9714 3.3770 2.6206 5.3714 5.4606 4.5044 4.8610 5.1347 7.9262 6.5217 7.2463 6.6452 6.0803 4.4292 5.3510 1.9218 1.3049 2.1458 3.6765 1.7897 5.3152 6.3796 1.5295 2.0946 3.5068 2.9079 4.2526 1.2446 1.2484 2.0920 2.2698 2.4428 1.9342 1.5357 1.5019 3.8196 5.5248 1.9015 1.3996 2.4326 1.3534 4.1713 4.1080 1.3256 2.2679 2.0888 1.7538 2.2022 3.3178 2.3860 2.2034 2.2362 2.1957 1.1602 1.4166 1.8866 2.4815 1.8567 1.7991 1.9648 2.8320 2.0443 1.2973 1.6882 1.3581 1.1758 1.6878 2.0609 1.8931 2.2928 1.3689 1.4157 1.2742 1.5373 2.2625 2.1545 2.9087 1.0586 1.1170 1.2920 1.0487 1.1131 1.1174 2.4198 2.2841 5.9698 8.0416 6.2652 5.4821 5.3417 5.3952 11.8237 11.7255 1.0603 1.0401 1.0719 1.0921 1.0977 1.0906 1.1011 1.0877 1.0607 1.0999 1.0866 1.0903 1.1091 1.0938 1.0974 1.0901 1.0906 1.0961 1.0960 1.0966 1.0954 0.0007 0.0028 0.0021 0.0033 0.0044 0.0053 0.0137 0.0067 0.0224 0.0259 0.0524 0.0303 0.0768 0.1306 0.1377 0.1106 0.1696 0.1636 0.0475 0.2889 0.4587 0.4867 0.4228 0.3109 0.4266 0.3980 0.3943 0.7753 0.7497 0.3672 0.3719 0.4318 0.3600 0.8191 0.8657 0.9225 1.0143 1.1812 1.8650 1.7610 2.0099 1.9023 1.7862 1.3437 1.7315 0.6787 0.4769 0.8226 1.4280 0.7521 2.2824 2.7945 0.6792 0.9524 1.6522 1.3745 2.1887 0.6639 0.6711 1.1385 1.2783 1.4088 1.1796 0.9836 0.9713 2.6408 3.8709 1.3471 0.9963 1.7419 0.9857 3.0497 3.0204 0.9867 1.7245 1.5951 1.4510 1.8415 2.8293 2.0776 1.9637 2.0065 2.0305 1.1640 1.4252 1.9100 2.5576 1.9247 1.8890 2.0845 3.0363 2.3532 1.5461 2.0670 1.6926 1.4741 2.1482 2.6627 2.5120 3.0814 1.8756 1.9752 1.8439 2.2371 3.3040 3.2873 4.5574 1.6701 1.7704 2.0560 1.6703 1.7831 1.8087 3.9686 3.7736 10.1810 14.5405 11.5810 10.2601 10.2848 10.4546 25.3608 26.6483 6.3564 6.2792 6.5038 6.6660 6.8456 6.8486 6.9289 6.8608 6.8879 7.2490 7.2104 7.2797 7.4388 7.3507 7.4177 7.3763 7.3845 7.4648 7.4855 7.4961 7.6750 0.0064 0.5480 0.0058 0.0630 0.0071 0.0910 0.0831 0.1762 1.1161 1.0376 1.3902 0.1261 2.2694 3.9215 0.5767 0.0257 4.0223 1.3524 0.3365 1.2316 0.6897 5.3450 0.7709 0.2477 2.9236 3.6979 1.3578 13.8450 33.9889 3.2439 0.1670 7.4544 6.0034 3.3839 7.2467 25.5027 26.9724 4.0943 7.6485 3.6856 9.5448 0.2680 2.8322 23.6956 2.8254 28.5257 4.4419 7.6380 23.5825 59.7946 20.5623 9.1409 0.6928 13.0744 83.6331 4.4558 1.4672 0.2611 0.5184 36.9834 13.0847 6.0209 34.4911 3.1912 1.2409 2.4575 1.7850 8.0618 0.3577 1.5955 0.6940 29.8509 4.0676 0.1510 1.6263 0.2076 0.9650 0.4852 61.0036 1.5732 18.2622 33.4559 11.0125 1.5785 1.6669 4.5906 3.0547 0.6442 2.1605 6.5484 6.3499 19.8582 8.6413 13.4678 15.5258 3.9636 58.4382 141.8883 25.2758 61.3344 9.9866 19.8278 6.0699 18.4289 11.5279 10.3968 390.5956 0.3815 9.7722 219.5908 0.3292 15.6986 9.5883 45.9299 75.7351 305.4682 112.2109 0.0817 4.9747 15.6498 1.0323 844.9202 366.9236 34.6800 28.2714 18.5986 21.3059 0.6604 32.6519 47.3319 85.2990 11.5506 11.9775 0.9126 6.2901 0.6399 35.6841 40.2483 4.2018 0.4204 10.0672 7.6899 0.4406 3.9375 2.8032 1.9271 0.6711 1.3544 2.6773 9.5995 2.8060 0.4804 2.7896 3.1567 0.4688 0.2468 0.4579 0.7202 0.9051 0.4342 2.6436 4.5977 0.2301 0.6696 3.2864 3.2620 1.2219 1.0146 1.8221 1.2821 2.4034 3.3033 3.5224 1.2242 0.0601 0.9943 0.4748 3.0100 0.3683 3.1358 1.0474 4.1239 7.3853 4.7257 2.2749 5.9593 4.0916 1.1637 1.8663 1.1070 0.8478 0.5884 3.0561 0.7723 2.3129 4.7054 1.0392 3.6871 11.1783 7.7006 5.8358 1.7687 3.8282 0.7625 11.2175 7.7982 2.8799 2.1719 1.8140 14.1692 36.8799 0.7479 1.5291 5.5771 0.1665 0.9467 1.6208 0.4365 11.5343 6.4118 0.3785 0.1980 14.8663 7.2745 8.3921 4.5136 2.9488 3.4713 1.8256 8.0175 1.2852 17.1432 9.3449 12.1549 13.6992 2.2563 0.4258 6.1048 5.3374 28.5506 8.9563 9.7658 21.0254 10.1650 3.5355 3.5019 3.5072 1.6382 0.4346 3.3733 12.4481 29.6009 33.2044 20.0415 14.6277 16.8753 3.7588 14.9555 0.7591 123.6610 13.4075 4.3878 6.0434 50.0696 112.9093 1.8727 31.6988 49.4727 91.5437 107.4920 74.1014 18.9293 55.0863 106.6844 36.6208 58.7355 35.8934 36.7540 119.3109 27.1504 61.5097 182.7094 4.2239 85.6774 147.6224 2.4117 185.1175 88.0307 0.7470 0.7267 0.7273 0.7426 0.7371 0.7192 0.7125 0.7494 0.7496 0.7489 0.6899 0.5776 0.3748 0.7425 0.6363 0.7391 0.6792 0.3835 0.3988 0.3650 0.5231 0.3231 0.2365 0.6135 0.1209 0.7111 0.4328 0.6840 0.4257 0.6829 0.5776 0.6324 0.2979 0.1467 0.6900 0.1004 0.5465 0.3165 0.2778 0.7499 0.3044 0.7470 0.2154 0.7438 0.2853 0.7475 0.7201 0.5480 0.2157 0.5030 0.4396 0.2507 0.7034 0.3184 0.0701 0.2210 0.2415 0.7341 0.6594 0.7445 0.1073 0.7244 0.3522 0.3139 0.5367 0.1091 0.1240 0.7096 0.1842 0.2009 0.3903 0.5837 0.6609 0.6108 0.7479 0.2828 0.6095 0.7108 0.0985 0.7445 0.1192 0.3797 0.6007 0.6507 0.2211 0.7185 0.7324 0.0823 0.2200 0.1498 0.3979 0.3557 0.6899 0.6251 0.7488 0.7495 0.3473 0.1648 0.4232 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0.5947 0.7097 0.4434 0.8571 0.7246 0.7254 0.3213 0.6548 0.8562 0.8273 0.5986 0.8557 0.8565 0.6752 0.5793 0.5583 0.7874 0.3265 0.6096 0.8552 0.7965 0.7110 0.6150 0.3948 0.3431 0.3832 0.0296 0.3143 0.7639 0.2318 0.5024 0.8012 0.4425 0.1033 0.6013 0.8485 0.8568 0.8568 0.8265 0.2171 0.7455 0.8571 0.2305 0.5845 0.2306 0.5049 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 6 6 6 6 7 6 6 6 6 16 6 6 6 6 6 6 6 8 7 6 8 6 6 6 6 6 6 6 17 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 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 31.97207 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 14.00307 12.00000 15.99491 12.00000 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 1.00783 1.00783 1.00783 1.00783 13090.5487 17213.7817 27942.4667 0.99778 0.06646 -0.00295 -0.06646 0.99779 0.00084 0.00300 -0.00065 1.00000 1 0.00662 0.00503 0.00310 0.13787 0.10484 0.06459 19.65 34.91 38.82 51.26 59.63 64.95 100.45 111.41 120.10 122.34 176.86 188.61 212.53 232.49 266.49 295.32 347.68 356.87 377.72 422.75 441.49 464.50 488.07 495.07 512.37 533.42 587.98 628.20 651.58 655.98 663.16 670.27 694.73 731.98 746.33 848.26 856.21 899.02 909.22 974.01 987.19 1002.89 1015.93 1032.44 1066.26 1113.91 1133.17 1160.59 1168.21 1215.10 1228.32 1240.57 1249.08 1263.97 1286.60 1288.70 1344.72 1368.96 1374.31 1382.79 1406.69 1423.46 1463.81 1500.13 1507.37 1558.59 1568.98 1577.68 1581.43 1586.12 1599.62 1602.73 1607.26 1617.17 1634.53 1638.00 1704.96 1714.07 1730.96 1749.12 1769.57 1775.57 1802.51 1877.49 1880.10 1886.02 1902.95 1908.43 1920.69 1930.68 1940.88 2011.05 2046.30 2074.14 2092.60 2098.76 2114.67 2130.63 2159.21 2173.01 2194.08 2214.11 2254.84 2261.21 2265.12 2315.34 2346.24 2354.36 2359.81 2364.53 2365.62 2372.45 2384.77 2400.45 2409.27 2447.85 2520.51 2548.42 2564.32 2600.91 2609.26 2745.19 2825.77 4589.39 4605.61 4617.22 4630.95 4681.03 4697.10 4701.96 4707.70 4776.62 4812.14 4828.57 4843.46 4854.32 4859.08 4873.23 4875.91 4877.44 4891.62 4898.55 4900.74 4961.49 0.425070 0.449370 0.450315 0.366562 -1998.452887 -1998.428587 -1998.427643 -1998.511395 2.809056D-04 MUNgauss RevisionA2.1 retrievium 09-Feb-2021 DUDE CCCCn1c2c(c(cs2)c3ccccc3)c(=O)n(c1=O)Cc4ccc(cc4)Cl C37638835 RHF 6-31G(d) (6D,10F) C1 424.101228 |X|Y|Z| 82.170315 92.058861 27.945228 59.570247 22 6 7 16 19 2 1 |36.858105| |12.467104|36.858105| |7.487735|12.451867|36.858105| |4.885512|7.525540|12.479698|36.858105| |3.778650|4.949850|7.626465|12.965190|53.358707| |3.283650|4.060030|5.680852|7.657242|18.936630|36.858105| |2.721213|3.188628|4.179585|5.073313|10.767808|14.036587|36.858105| |2.436731|2.777599|3.445298|3.955767|7.095506|8.131749|13.083929|36.858105| |2.592083|2.971991|3.619493|4.112235|6.798023|7.736781|8.255826|14.196889|36.858105| |3.290084|4.005887|5.082606|6.104011|9.478174|11.026380|7.414043|7.365914|10.949591|388.023441| |2.064999|2.290166|2.739087|3.041666|5.166608|5.045765|7.213911|12.786086|7.704713|33.725620|36.858105| |1.958021|2.119375|2.490034|2.654809|4.316218|4.020686|5.120630|7.653956|6.209912|28.768511|13.710420|36.858105| |1.716982|1.837404|2.113400|2.236815|3.551994|3.146097|3.850867|5.053997|4.347736|22.341288|7.897784|13.738433|36.858105| |1.597276|1.718951|1.964852|2.110527|3.355481|2.912543|3.581070|4.455924|3.755287|20.102277|6.835614|7.941889|13.775230|36.858105| |1.653088|1.805600|2.079637|2.289001|3.710218|3.238492|4.115643|5.040155|4.021770|21.581341|7.914011|6.893538|7.953180|13.730336|36.858105| |1.863926|2.069768|2.433714|2.741018|4.604979|4.212869|5.786676|7.578965|5.343458|27.155944|13.688411|7.953200|6.878511|7.930853|13.785763|36.858105| |2.524493|2.905980|3.753214|4.437771|9.182676|7.873074|13.068810|7.251734|5.122592|34.277962|5.819421|4.365593|3.542324|3.447499|4.044130|5.423069|36.858105| |2.198751|2.465935|3.057669|3.471733|6.451856|5.383355|8.074919|6.221628|4.386151|27.490960|6.064397|4.587835|3.880568|3.920200|4.732905|6.227276|15.916438|73.516695| |2.768200|3.238968|4.281159|5.164727|11.035904|7.089064|7.931122|5.005084|4.074378|30.711939|4.102393|3.337427|2.820395|2.757188|3.143935|3.912409|13.638191|15.040862|53.358707| |3.354393|4.144886|5.866142|7.821015|18.829348|8.012416|6.760810|4.472942|3.989807|33.860643|3.527389|2.956081|2.497414|2.407665|2.687109|3.283759|7.710858|9.577089|18.819587|36.858105| |3.488700|4.298162|5.759500|7.084908|11.557293|5.482111|4.741497|3.491057|3.218688|27.212081|2.889903|2.498259|2.165573|2.102657|2.320037|2.742864|5.357443|7.511800|11.489180|15.874408|73.516695| |2.445110|2.767913|3.452476|3.915182|7.032105|4.576047|5.065897|3.757202|3.140769|23.012835|3.370635|2.854228|2.522745|2.523528|2.859987|3.372305|7.760977|12.574595|17.567886|7.836800|12.559854|36.858105| |2.169048|2.466131|2.942638|3.422480|5.791972|3.836022|4.184777|3.288193|2.800064|20.366296|3.034359|2.559020|2.317458|2.384869|2.755976|3.190775|5.785367|10.077910|10.373340|5.820878|10.057029|12.574635|36.858105| |2.186703|2.504072|2.907177|3.400279|5.388577|3.419939|3.498303|2.817694|2.499405|18.796887|2.571694|2.208375|2.011430|2.059593|2.344864|2.674159|4.359196|7.288180|7.755371|5.273200|10.270367|7.545207|13.706210|36.858105| |1.935009|2.197633|2.470860|2.868428|4.377231|2.878393|2.948384|2.480109|2.231171|16.573293|2.313130|2.002666|1.854759|1.924962|2.195903|2.453509|3.504316|6.049866|5.668942|3.933227|7.464234|5.008447|7.890690|13.755778|36.858105| |1.744125|1.961893|2.200353|2.535867|3.914121|2.689965|2.845702|2.458811|2.187991|15.754028|2.360002|2.037877|1.915163|2.026913|2.343737|2.579724|3.386553|6.118334|5.119201|3.394935|6.107178|4.442034|6.868195|7.982328|13.783925|36.858105| |1.731474|1.939168|2.209807|2.538077|4.047484|2.869945|3.169696|2.745820|2.375739|16.603409|2.696168|2.298971|2.170059|2.331585|2.750783|3.028316|3.922894|7.479816|5.669246|3.514839|6.039626|5.009163|7.891088|6.877915|7.918208|13.783319|36.858105| |1.906160|2.141734|2.507353|2.886903|4.809231|3.405954|3.883785|3.224431|2.706617|18.841035|3.128729|2.623731|2.430461|2.579248|3.055944|3.469180|5.250871|10.295861|7.756114|4.378083|7.275639|7.547093|13.705517|7.964746|6.877324|7.981838|13.756240|36.858105| |1.536445|1.710983|1.871175|2.125246|3.172863|2.213150|2.312363|2.071433|1.883632|13.510923|2.016412|1.773349|1.693221|1.802771|2.060594|2.209859|2.626024|4.756045|3.833089|2.630306|4.748874|3.157078|4.215398|4.769625|7.035176|10.913827|7.034935|4.769494|448.794386| |17.540356|8.775195|6.784189|4.507698|4.976595|3.317867|2.767122|2.526336|2.725810|24.497371|2.139978|2.056025|1.794287|1.650413|1.692189|1.905416|2.524146|3.924014|3.675062|3.193128|5.703676|2.365366|2.081862|2.063444|1.828859|1.668471|1.674616|1.850155|11.812616|0.500000| |17.544418|8.779848|6.789803|4.516384|4.977935|3.130466|2.650722|2.346703|2.439116|21.377234|2.010246|1.908274|1.682557|1.570533|1.625289|1.825182|2.527000|3.935775|3.838572|3.403129|6.470764|2.542217|2.232543|2.256217|1.980744|1.773847|1.758461|1.944208|12.487059|0.301581|0.500000| |17.555873|8.782376|5.462517|4.057478|4.355502|2.832290|2.390051|2.174657|2.319565|20.528229|1.869717|1.780754|1.578199|1.475851|1.524686|1.704157|2.228237|3.496757|3.298512|2.881749|5.358989|2.175939|1.969093|2.004511|1.801559|1.629185|1.606925|1.747229|11.668711|0.301690|0.301693|0.500000| |8.862930|17.507283|8.844708|6.905843|6.284866|4.002904|3.123995|2.794894|3.081522|30.332433|2.296182|2.127725|1.842503|1.720996|1.805737|2.070309|2.770756|4.200823|4.078628|3.735479|6.646520|2.544403|2.306956|2.334419|2.081896|1.881242|1.862920|2.038744|13.307716|0.210782|0.173023|0.213013|0.500000| |8.863740|17.517649|8.857669|6.935457|6.287655|3.687857|2.960561|2.558789|2.686396|24.959314|2.139167|1.966337|1.723001|1.631657|1.725705|1.969277|2.774749|4.215538|4.304398|4.082238|7.948930|2.767093|2.515782|2.622979|2.312860|2.035131|1.979610|2.165827|14.287184|0.172992|0.210950|0.212966|0.303664|0.500000| |6.858321|8.841124|17.557020|8.918389|9.497444|5.084864|3.998745|3.240018|3.267145|30.175788|2.638211|2.407782|2.062978|1.927457|2.038961|2.368565|3.820041|5.575499|6.219354|6.323270|11.947166|3.798362|3.142641|3.108357|2.588613|2.277295|2.284338|2.620222|15.386858|0.168689|0.203506|0.140278|0.173499|0.211826|0.500000| |6.862454|8.841245|17.525661|8.856098|9.492856|6.031043|4.435519|3.768552|4.072886|41.598642|2.953373|2.726446|2.279549|2.080792|2.175651|2.551905|3.811310|5.543592|5.591547|5.222025|8.503657|3.275910|2.760710|2.655965|2.275312|2.066896|2.109625|2.403502|14.178459|0.203522|0.168904|0.140312|0.211481|0.173600|0.302727|0.500000| |4.528315|6.861681|8.795958|17.602753|12.525901|7.333026|4.843243|4.014805|4.422007|50.938110|3.061137|2.673237|2.247732|2.116975|2.293672|2.748866|4.012538|5.708693|5.911494|5.830508|9.251897|3.361820|3.044630|3.022323|2.636037|2.378313|2.383347|2.659199|16.321233|0.119211|0.111229|0.108573|0.206677|0.171946|0.173808|0.209987|0.500000| |4.532986|6.839532|8.840702|17.678150|12.584143|5.817531|4.307811|3.403733|3.448062|33.284514|2.722308|2.378648|2.045149|1.960768|2.139501|2.528994|4.040981|5.766248|6.702004|7.542923|14.374255|3.949576|3.586510|3.743280|3.155489|2.712215|2.643826|2.965017|18.210864|0.111172|0.119914|0.108504|0.169833|0.206710|0.214077|0.173708|0.303675|0.500000| |2.384103|2.677136|3.131044|3.448035|5.366120|5.439380|5.692527|8.801763|17.802622|55.354308|6.800837|6.271390|4.515796|3.808954|3.918816|4.897948|4.037699|6.481707|4.522716|3.263035|4.857405|2.681521|2.437567|2.202971|2.001119|1.978970|2.139511|2.390673|13.934691|0.070190|0.062049|0.060130|0.078114|0.067383|0.078715|0.097677|0.104226|0.082188|0.500000| |2.079227|2.228707|2.622157|2.729334|4.367084|4.074719|4.916616|7.105836|6.530679|30.566355|8.921217|17.719287|8.921124|5.651015|4.962872|5.652455|4.069754|7.265919|4.379373|2.931455|4.423238|2.730681|2.410627|2.106915|1.900422|1.907332|2.119434|2.416015|13.354858|0.061486|0.056067|0.052301|0.062270|0.056698|0.070036|0.081544|0.076482|0.066995|0.189393|0.500000| |1.643806|1.736634|1.975253|2.054558|3.198602|2.777951|3.274559|4.120974|3.749234|20.092651|5.631862|8.922622|17.714961|8.913979|5.648122|4.954717|3.033806|5.816488|3.399436|2.249048|3.517156|2.263826|2.078231|1.825769|1.689721|1.737068|1.947186|2.161714|12.446173|0.047978|0.044785|0.042137|0.048400|0.045151|0.053659|0.059413|0.057357|0.052281|0.110471|0.215621|0.500000| |1.467775|1.567672|1.770584|1.886964|2.951457|2.502740|2.986996|3.560459|3.112299|17.363332|4.932381|5.644935|8.915847|17.714982|8.902748|5.643280|2.928348|5.890544|3.293773|2.134632|3.367839|2.264386|2.166223|1.890837|1.786837|1.891992|2.165887|2.355414|13.711018|0.042068|0.040185|0.037894|0.043585|0.041517|0.048426|0.051824|0.052542|0.049119|0.088435|0.124193|0.214614|0.500000| |1.546749|1.688858|1.925884|2.126746|3.408499|2.891321|3.570520|4.105034|3.388644|19.122132|5.639043|4.962656|5.651733|8.906223|17.717280|8.945236|3.632492|7.593019|3.982021|2.507388|3.908313|2.739015|2.724874|2.331095|2.223784|2.422744|2.872709|3.109002|17.330098|0.043690|0.042353|0.039847|0.046872|0.045245|0.052665|0.055299|0.059119|0.056023|0.091644|0.107692|0.124115|0.214633|0.500000| |1.891251|2.128410|2.507321|2.901500|4.943625|4.448912|6.115378|6.993618|5.022956|27.376277|8.907869|5.652982|4.957287|5.648734|8.945578|17.747777|6.013779|12.169328|5.896744|3.581547|5.283842|3.716823|3.642303|3.021780|2.783148|2.961060|3.531112|4.052300|20.060135|0.053118|0.051473|0.048072|0.059053|0.056833|0.067815|0.071707|0.080682|0.075368|0.123719|0.124223|0.107595|0.124248|0.216276|0.500000| |2.608320|2.924793|3.639968|3.972462|6.742247|4.157036|4.303889|3.285388|2.851864|21.550632|2.930921|2.556461|2.271796|2.245967|2.487333|2.875484|5.826544|9.291913|12.555691|7.623547|14.550305|17.699367|8.888294|7.143311|4.729347|3.993374|4.215847|5.671553|23.576720|0.069266|0.076872|0.064180|0.073076|0.082119|0.116060|0.093972|0.092412|0.113662|0.068397|0.069275|0.057534|0.056562|0.066175|0.086138|0.500000| |2.263140|2.503312|3.083658|3.376554|5.938602|4.145475|4.848959|3.762700|3.079876|21.626499|3.529096|3.028369|2.706260|2.716660|3.061846|3.553727|7.584802|14.613697|12.592514|5.873886|9.286591|17.700251|8.893028|5.668659|4.215129|3.994894|4.734517|7.157430|23.583789|0.061710|0.065405|0.056144|0.064399|0.068609|0.093602|0.083686|0.082455|0.092294|0.073751|0.079828|0.067381|0.067737|0.081208|0.106381|0.302075|0.500000| |2.409192|2.778065|3.224300|3.747706|5.747674|3.471657|3.405618|2.723806|2.462948|19.082456|2.440207|2.119186|1.916829|1.934164|2.168805|2.475299|4.107608|6.619753|7.630179|5.780885|12.769926|7.007316|8.920258|17.737809|8.946952|5.672132|4.956164|5.658325|31.616735|0.062255|0.069741|0.061113|0.070722|0.082231|0.097756|0.079849|0.090122|0.118544|0.060238|0.056964|0.048683|0.049337|0.059245|0.076373|0.214113|0.143708|0.500000| 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