Version2.0 2020-07-30T00:56:09Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 10-Jul-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE COc1cc(cc(c1)OC)C(=O)NNC(=S)Nc2cc(c(cc2OC)Cl)OC C00986435 RHF 6-31G(d) (6D,7F) COc1cc(cc(c1)OC)C(=O)NNC(=S)Nc2cc(c(cc2OC)Cl)OC C01[X(C18H20Cl1N3O5S1)] 138 C1 468 COc1cc(OC)cc(c1)C(=O)NNC(=S)Nc1cc(OC)c(cc1OC)Cl COc1cc(OC)cc(c1)C(=O)NNC(=S)Nc1cc(OC)c(cc1OC)Cl COc1cc(OC)cc(c1)C(=O)NNC(=S)Nc2cc(OC)c(Cl)cc2OC InChIKey=RSKFKUHBBAHTMO-UHFFFAOYSA-N InChI=1S/C18H20ClN3O5S/c1-24-11-5-10(6-12(7-11)25-2)17(23)21-22-18(28)20-14-9-15(26-3)13(19)8-16(14)27-4/h5-9H,1-4H3,(H,21,23)(H2,20,22,28) InChI=1/C18H20ClN3O5S/c1-24-11-5-10(6-12(7-11)25-2)17(23)21-22-18(28)20-14-9-15(26-3)13(19)8-16(14)27-4/h5-9H,1-4H3,(H,21,23)(H2,20,22,28)/f/h20-22H COc1cc(cc(c1)OC)C(=O)NNC(=S)Nc2cc(c(cc2OC)Cl)OC C01[X(C18H20Cl1N3O5S1)] 138 C01 468 COc1cc(OC)cc(c1)C(=O)NNC(=S)Nc1cc(OC)c(cc1OC)Cl CO[C]1[CH][C]([CH][C]([CH]1)C(=O)NN[C]([NH][C]1[CH][C]([C]([CH][C]1OC)Cl)OC)S)OC CO[C]1[CH][C]([CH][C]([CH]1)C(=O)NN[C](S)N[C]2[CH][C](OC)[C](Cl)[CH][C]2OC)OC InChIKey=NKPDHHBEHGWPMY-UHFFFAOYSA-N InChI=1S/C18H21ClN3O5S/c1-24-11-5-10(6-12(7-11)25-2)17(23)21-22-18(28)20-14-9-15(26-3)13(19)8-16(14)27-4/h5-9,20,22,28H,1-4H3,(H,21,23) InChI=1/C18H21ClN3O5S/c1-24-11-5-10(6-12(7-11)25-2)17(23)21-22-18(28)20-14-9-15(26-3)13(19)8-16(14)27-4/h5-9,20,22,28H,1-4H3,(H,21,23)/f/h21H 2875.4923876164 -2087.8606143 1-A 18124.3725 111 357 468 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -104.81700 -91.87414 -20.61354 -20.60879 -20.60875 -20.58757 -20.56184 -15.64478 -15.63664 -15.62188 -11.38107 -11.37866 -11.32837 -11.32612 -11.30726 -11.30671 -11.30390 -11.29972 -11.29803 -11.29648 -11.29084 -11.27503 -11.27286 -11.25184 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|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 0.08994 0.10831 0.13863 0.15811 0.18726 0.20242 0.20857 0.21456 0.22019 0.23420 0.24326 0.24828 0.25794 0.26602 0.27261 0.28320 0.28734 0.29183 0.29251 0.29701 0.29961 0.30967 0.31283 0.31489 0.31860 0.32142 0.32557 0.33721 0.33788 0.34105 0.35084 0.36007 0.36601 0.37932 0.38476 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2.78446 2.80899 2.84043 2.85297 2.87147 2.87534 2.90315 2.91630 2.91817 2.94739 2.95282 2.96687 2.97051 2.97555 2.98272 3.00405 3.01018 3.03154 3.04121 3.04699 3.07116 3.08196 3.10762 3.11931 3.13412 3.14352 3.17231 3.19986 3.20723 3.31129 3.32458 3.34885 3.35699 3.36866 3.40480 3.44714 3.45279 3.51613 3.51996 3.54547 3.65923 3.72860 3.85205 3.86289 4.30820 4.41682 4.44211 4.45379 4.46413 4.46699 4.48229 4.49402 4.53594 4.58284 4.60102 4.61006 4.62589 4.63786 4.67743 4.72807 4.73242 4.75057 4.76880 4.77347 4.86256 4.86520 4.93784 4.95497 5.01853 5.04550 5.23525 5.36466 10.21317 9.5958 6.2930 -2.5033 11.7451 |XX|YY|ZZ|XY|XZ|YZ| -146.4210 -181.4828 -181.9319 21.7101 -3.3752 2.4549 |XX|YY|ZZ|XY|XZ|YZ| 23.5242 -11.5376 -11.9867 21.7101 -3.3752 2.4549 |XXX|YYY|ZZZ|XYY|XXY|XXZ|XZZ|YZZ|YYZ|XYZ| 433.3759 132.6663 -2.8690 75.3463 19.8902 6.9828 20.6365 14.6811 -13.1530 18.0897 |XXXX|YYYY|ZZZZ|XXXY|XXXZ|YYYX|YYYZ|ZZZX|ZZZY|XXYY|XXZZ|YYZZ|XXYZ|YYXZ|ZZXY| -15970.5794 -4412.3231 -771.3394 1345.1769 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398.5698 415.7516 462.7316 473.6133 492.9981 505.4314 510.9519 520.8886 556.1965 568.3631 599.0210 610.6461 624.9241 652.3706 672.6084 684.3629 684.7383 697.2560 751.0389 760.4769 764.9293 784.9629 789.0208 823.1542 863.2987 872.7802 887.0449 957.0641 974.8482 980.5165 989.5452 996.8595 1010.6044 1038.2573 1053.1415 1082.0409 1122.6190 1171.3873 1181.2196 1199.0362 1201.5393 1211.6768 1228.2826 1249.3790 1259.5610 1292.2994 1293.0148 1293.2756 1294.0573 1302.2681 1318.4313 1326.0409 1336.7954 1340.7892 1351.0515 1383.6030 1385.4034 1412.6459 1434.4674 1436.6986 1471.0618 1504.9882 1526.0337 1565.8431 1613.6363 1621.4456 1632.3685 1641.0607 1642.2339 1649.8735 1650.8121 1651.2668 1652.2767 1653.0162 1658.2824 1659.3922 1661.0893 1661.2499 1673.2299 1683.0928 1701.8986 1749.3749 1796.1882 1807.9674 1810.4148 1831.6310 2002.1874 3210.0958 3212.1051 3216.1888 3219.2092 3273.8791 3276.8526 3283.8766 3287.5796 3334.0200 3334.5043 3336.1367 3336.7207 3406.5127 3425.8809 3426.7814 3442.1297 3491.2298 3834.3422 3838.3859 3846.7647 4.9136 6.2190 6.4701 5.5062 7.1319 4.0409 6.0283 3.4288 3.8608 3.9306 6.2119 6.6546 6.1290 6.1689 3.4692 4.3822 4.0090 4.4894 1.7715 7.1715 1.3445 1.7427 6.3677 4.5531 1.2867 1.8153 1.9273 3.1410 3.6930 3.5996 3.7184 7.4566 7.4027 6.8547 5.4147 5.1147 3.1463 5.6560 6.2406 1.7578 4.7077 5.1407 2.8379 5.6609 5.4405 3.0346 3.9371 2.2734 4.1009 6.4983 4.5160 2.4762 4.0020 6.5389 1.7057 5.0053 3.8853 5.0091 1.6338 1.7873 1.4351 3.7092 1.5687 1.4180 4.9763 4.9572 6.1280 4.6356 5.0667 6.7015 4.8198 2.3486 2.3760 3.9794 4.4089 5.2360 1.2652 1.2658 1.2658 1.2623 3.0762 1.6908 1.6837 1.4561 1.7502 2.1463 2.3194 2.2176 1.8606 1.5452 1.6034 7.0585 6.2316 3.4053 4.5020 2.1619 1.5748 1.2490 1.2983 1.7819 1.0700 1.4551 1.0480 1.0465 1.0481 1.0695 1.0789 1.0859 1.0675 1.6025 1.8072 1.8408 3.1502 5.0192 3.2520 6.1939 4.3797 11.2067 1.0347 1.0343 1.0331 1.0332 1.1077 1.1079 1.1081 1.1081 1.1034 1.1021 1.1034 1.1016 1.0925 1.0933 1.0922 1.0906 1.0913 1.0757 1.0785 1.0783 0.0000 0.0005 0.0009 0.0048 0.0077 0.0050 0.0145 0.0100 0.0122 0.0131 0.0308 0.0734 0.0774 0.0923 0.0693 0.0924 0.0959 0.1120 0.0471 0.2323 0.0511 0.0669 0.2657 0.1966 0.0645 0.0929 0.1137 0.1954 0.2368 0.2372 0.2644 0.6979 0.7539 0.8648 0.7156 0.7324 0.4736 0.8700 0.9976 0.3204 0.8960 1.0868 0.6235 1.3025 1.3642 0.8089 1.0864 0.6280 1.1747 2.1596 1.5388 0.8537 1.4529 2.3985 0.6809 2.1979 1.7437 2.3222 0.8817 1.0007 0.8129 2.1400 0.9185 0.8533 3.1606 3.2394 4.2273 3.4421 4.0962 5.5091 4.0826 1.9977 2.0552 3.5372 4.0548 4.8942 1.2449 1.2469 1.2474 1.2455 3.0737 1.7316 1.7443 1.5331 1.8538 2.3083 2.6161 2.5078 2.1877 1.8733 1.9499 8.9996 8.3160 4.6724 6.5035 3.3166 2.4394 1.9609 2.0600 2.8314 1.7161 2.3363 1.6837 1.6832 1.6873 1.7328 1.7504 1.7653 1.7358 2.6434 3.0163 3.1413 5.6801 9.5409 6.2629 11.9611 8.6571 26.4691 6.2819 6.2876 6.2964 6.3089 6.9953 7.0089 7.0402 7.0567 7.2265 7.2198 7.2355 7.2261 7.4693 7.5603 7.5569 7.6131 7.8367 9.3176 9.3618 9.4009 0.3831 0.3109 0.0752 5.5691 2.2759 2.4425 0.5506 0.2147 4.4727 2.5565 0.7192 5.0879 8.5658 2.7494 0.2302 2.6122 1.6849 5.5431 0.6340 0.9986 0.0110 0.1098 3.2865 0.3756 1.5091 0.5609 1.3638 3.8297 4.4703 3.3197 23.8075 10.4067 9.4335 7.2861 10.5256 1.3493 2.5553 2.7691 22.3584 88.7816 11.2845 8.3222 20.2220 2.7870 16.5723 4.9366 19.6581 157.3022 14.4354 15.1082 8.2850 7.9355 5.0263 29.7863 97.3958 118.8993 59.2064 0.1829 44.0059 39.0461 3.9465 40.2741 10.5715 59.1889 5.4890 40.6668 1.0543 0.2588 67.6038 208.1747 85.9456 4.3001 108.7283 136.2082 165.8536 108.9415 3.0869 0.0113 5.8104 3.0452 30.3338 97.3921 37.9863 44.4151 6.5420 100.1474 445.0432 187.9100 73.4329 143.7288 125.1411 88.1595 581.5247 209.8506 237.1903 11.8571 77.5486 27.3358 31.8955 5.3792 6.8880 9.2860 0.1600 6.2880 10.3784 66.8047 57.8653 2.0367 50.7621 295.2129 192.8995 86.4538 488.5975 279.5767 326.6716 66.8724 67.0749 225.8033 36.1636 58.8889 58.5953 33.0606 43.3962 56.9613 41.7796 42.1984 37.1621 36.6849 42.1592 29.9480 1.7025 2.1888 2.2715 4.4132 13.9937 149.2108 67.4309 86.7585 1.2110 2.5212 1.1520 0.9722 0.9997 0.9558 0.1276 0.0962 0.5992 0.2160 0.5841 0.9677 0.6160 0.8400 1.3041 1.8937 0.7790 0.3396 0.9207 1.8005 1.3106 1.6400 1.2564 3.1257 0.0156 1.4737 0.2626 0.3015 3.7387 2.5705 1.6830 2.1154 6.7316 2.1188 1.7091 2.8757 1.0941 3.8197 2.6743 7.8064 1.4501 3.0019 5.5373 2.6983 3.4092 2.3530 1.9556 4.4652 0.9016 0.6115 1.1059 0.5366 3.3633 18.2847 4.1697 2.0423 2.6414 1.0108 1.2597 4.5717 3.3017 2.7990 0.9569 0.3774 4.2542 0.8526 36.6588 2.8201 15.5357 1.9299 5.0773 1.1546 1.6952 13.4867 3.6889 5.7966 3.2135 0.0511 9.2513 4.1183 9.6597 1.9984 3.4919 7.1632 1.8364 20.2114 1.8184 2.9201 2.0540 2.1668 2.8347 63.4482 29.3504 29.2900 40.1972 12.9038 0.3238 4.8970 19.0320 3.0954 20.3215 13.3540 22.1926 22.0029 26.0138 9.8797 16.7539 9.9494 11.0019 12.4849 12.1645 20.9850 10.9120 20.6242 187.6292 22.1267 67.8670 27.8239 78.2514 123.3434 90.4772 118.8700 37.5420 52.7133 49.1887 33.8267 120.7794 98.8208 148.8582 152.8471 91.2150 57.1727 58.8201 66.5462 42.0375 99.5481 36.3732 54.2910 0.7498 0.7471 0.7362 0.7244 0.7479 0.7053 0.6503 0.7033 0.7500 0.7479 0.3192 0.6895 0.6561 0.7439 0.6429 0.7166 0.7162 0.6243 0.7437 0.6810 0.7148 0.7110 0.6245 0.1363 0.4203 0.6905 0.3110 0.7299 0.1724 0.2567 0.3832 0.4393 0.1648 0.7414 0.6180 0.2082 0.5375 0.4934 0.6758 0.5432 0.3232 0.3338 0.3310 0.4595 0.7284 0.4134 0.2087 0.4456 0.7245 0.7345 0.7360 0.6438 0.5029 0.1249 0.1189 0.6127 0.4401 0.4893 0.7377 0.2403 0.7500 0.4875 0.6458 0.6119 0.6991 0.7252 0.1083 0.3850 0.3308 0.6597 0.7411 0.7464 0.3254 0.1574 0.7114 0.7466 0.7492 0.7186 0.7499 0.7459 0.1513 0.6656 0.4744 0.2116 0.1203 0.4765 0.3094 0.7148 0.4089 0.7100 0.3641 0.3297 0.1119 0.1517 0.1928 0.4478 0.1456 0.7492 0.2512 0.6690 0.7429 0.5817 0.7498 0.7491 0.7470 0.6873 0.6184 0.7310 0.5499 0.4194 0.3879 0.2367 0.6859 0.7128 0.4182 0.3688 0.7499 0.1384 0.0260 0.0215 0.0130 0.0233 0.7500 0.7470 0.7500 0.7492 0.5554 0.4815 0.4970 0.4640 0.2780 0.2542 0.2654 0.2705 0.1798 0.0702 0.3220 0.2397 0.8570 0.8553 0.8480 0.8402 0.8557 0.8272 0.7881 0.8258 0.8571 0.8558 0.4839 0.8162 0.7923 0.8532 0.7827 0.8349 0.8346 0.7687 0.8530 0.8102 0.8337 0.8311 0.7688 0.2399 0.5918 0.8169 0.4745 0.8439 0.2941 0.4085 0.5540 0.6104 0.2830 0.8515 0.7639 0.3446 0.6992 0.6608 0.8066 0.7040 0.4885 0.5005 0.4973 0.6296 0.8429 0.5849 0.3454 0.6165 0.8403 0.8469 0.8480 0.7833 0.6693 0.2221 0.2125 0.7599 0.6112 0.6570 0.8490 0.3874 0.8571 0.6554 0.7848 0.7592 0.8229 0.8407 0.1955 0.5559 0.4972 0.7950 0.8513 0.8548 0.4911 0.2719 0.8314 0.8549 0.8567 0.8362 0.8571 0.8544 0.2629 0.7992 0.6435 0.3493 0.2148 0.6455 0.4726 0.8337 0.5804 0.8304 0.5338 0.4959 0.2013 0.2635 0.3232 0.6186 0.2542 0.8567 0.4015 0.8017 0.8525 0.7355 0.8570 0.8566 0.8552 0.8147 0.7642 0.8446 0.7096 0.5909 0.5590 0.3828 0.8137 0.8323 0.5898 0.5388 0.8571 0.2432 0.0506 0.0422 0.0257 0.0456 0.8571 0.8552 0.8571 0.8566 0.7142 0.6501 0.6640 0.6339 0.4350 0.4054 0.4195 0.4258 0.3048 0.1313 0.4871 0.3866 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 6 8 6 6 6 6 6 6 8 6 6 8 7 7 6 16 7 6 6 6 6 6 6 8 6 17 8 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 15.99491 14.00307 14.00307 12.00000 31.97207 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 34.96885 15.99491 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 6827.8227 27357.3948 32494.6361 0.99984 0.01787 0.00147 -0.01786 0.99980 -0.00889 -0.00162 0.00887 0.99996 1 0.01269 0.00317 0.00267 0.26432 0.06597 0.05554 4.36 17.37 21.75 55.62 61.50 66.20 91.78 101.23 105.31 108.16 131.93 196.90 210.58 229.22 264.98 272.16 289.90 296.02 305.75 337.36 365.56 367.18 382.92 389.54 419.73 424.09 455.35 467.55 474.61 481.12 499.87 573.45 598.17 665.77 681.42 709.31 727.20 735.15 749.44 800.24 817.75 861.86 878.58 899.13 938.62 967.73 984.65 985.19 1003.20 1080.58 1094.16 1100.56 1129.39 1135.22 1184.34 1242.09 1255.74 1276.26 1377.00 1402.59 1410.74 1423.73 1434.26 1454.03 1493.82 1515.24 1556.82 1615.20 1685.37 1699.51 1725.15 1728.75 1743.33 1767.22 1797.58 1812.23 1859.33 1860.36 1860.74 1861.86 1873.67 1896.93 1907.88 1923.35 1929.10 1943.86 1990.70 1993.29 2032.48 2063.88 2067.09 2116.53 2165.34 2195.62 2252.90 2321.66 2332.90 2348.61 2361.12 2362.81 2373.80 2375.15 2375.80 2377.26 2378.32 2385.90 2387.50 2389.94 2390.17 2407.40 2421.60 2448.65 2516.96 2584.31 2601.26 2604.78 2635.31 2880.70 4618.61 4621.50 4627.38 4631.72 4710.38 4714.66 4724.77 4730.09 4796.91 4797.61 4799.96 4800.80 4901.21 4929.08 4930.37 4952.46 5023.10 5516.76 5522.58 5534.64 0.401480 0.428260 0.429204 0.338039 -2087.459134 -2087.432354 -2087.431410 -2087.522575 3.057689D-04 MUNgauss RevisionA2.0 retrievium 30-Jul-2020 DUDE COc1cc(cc(c1)OC)C(=O)NNC(=S)Nc2cc(c(cc2OC)Cl)OC C00986435 RHF 6-31G(d) (6D,10F) C1 425.081220 |X|Y|Z| 57.669688 119.146368 24.548327 55.252267 17 6 7 14 3 |36.858105| |13.602293|73.516695| |7.995109|25.223286|36.858105| |5.264052|14.642405|13.730043|36.858105| |3.994460|9.452814|7.975543|13.778769|36.858105| |3.792075|8.223430|6.858142|7.893320|13.732107|36.858105| |4.519927|9.265244|7.933290|6.854880|7.965018|13.736088|36.858105| |6.740547|14.052213|13.690185|7.892926|6.880614|7.899379|13.704288|36.858105| |3.718771|7.029250|5.205799|4.621231|5.309530|8.236147|14.156759|7.893807|73.516695| |3.781434|6.613064|4.516729|3.789717|3.991232|5.264722|7.992750|6.736730|24.169799|36.858105| |3.137237|7.093909|5.087719|7.733806|12.705221|7.566810|5.039541|4.464033|7.011669|3.113537|36.858105| |2.982914|6.749069|4.511402|6.680221|8.024846|5.337162|4.025136|3.806168|5.780918|2.684417|16.007239|73.516695| |2.665778|5.725323|3.984106|5.242134|7.838367|6.649241|4.501609|3.786626|6.764262|2.986973|13.742610|15.032503|53.358707| |2.280234|4.793850|3.164564|3.989998|5.145923|4.499104|3.398702|2.987276|5.338029|2.465937|8.029168|12.638766|18.873298|53.358707| |2.035163|4.190931|2.720993|3.302386|4.113076|3.797478|2.977357|2.617161|4.834614|2.266316|5.756419|9.829925|10.839806|18.920400|36.858105| |1.776888|3.607739|2.265103|2.682284|3.122631|2.872104|2.375492|2.159378|3.905221|1.891366|4.082746|7.551400|6.661860|9.954362|11.358188|388.023441| |2.049604|4.179077|2.749851|3.266384|4.163612|4.094641|3.190353|2.723032|5.297731|2.449523|5.407220|8.750878|9.836250|11.458416|14.297113|49.758727|53.358707| |1.848818|3.693410|2.387933|2.736364|3.337212|3.386741|2.783582|2.400666|4.776745|2.262751|3.985294|6.690403|6.488645|7.106900|7.567014|40.174830|18.419515|36.858105| |1.645368|3.255220|2.059268|2.331583|2.737466|2.732676|2.319789|2.053215|3.998882|1.944836|3.230400|5.636092|5.081781|5.812024|6.075817|41.216559|10.449774|13.795825|36.858105| |1.515151|2.956533|1.851259|2.051934|2.359657|2.390805|2.088555|1.862930|3.662100|1.812943|2.676498|4.679918|4.068696|4.448680|4.214929|29.430458|6.933598|7.892374|13.674280|36.858105| |1.537586|2.977380|1.871070|2.044527|2.351890|2.440912|2.160372|1.911787|3.853606|1.913634|2.586838|4.454218|3.875228|4.041056|3.644117|23.934967|6.212947|6.877855|7.971749|13.773010|36.858105| |1.699667|3.301234|2.107242|2.300810|2.700142|2.874401|2.520908|2.183162|4.538228|2.215707|2.927638|4.919510|4.400038|4.406519|3.898476|23.697504|7.122300|7.936685|6.897222|7.915584|13.741898|36.858105| |1.886510|3.725705|2.424312|2.709531|3.300645|3.519020|2.952209|2.501845|5.215189|2.464508|3.685142|6.044855|5.740304|5.685525|5.189083|28.574157|10.963068|13.600947|7.926151|6.832263|7.947482|13.842576|36.858105| |2.135376|4.238857|2.832937|3.156943|3.992005|4.512885|3.690264|2.995555|6.580753|2.989637|4.265299|6.644419|6.597611|5.924062|4.915844|25.658672|10.029194|8.140511|5.275898|4.595591|5.190906|7.871599|14.013693|73.516695| |2.148870|4.175208|2.774393|2.961591|3.605300|4.242932|3.739843|3.030164|7.039248|3.262960|3.573630|5.633710|5.196529|4.595419|3.626937|20.301195|6.513945|5.235658|3.978138|3.780054|4.512331|6.714447|7.974781|24.147670|36.858105| |1.380160|2.634742|1.632224|1.750547|1.965764|2.044651|1.862724|1.674187|3.360867|1.710086|2.108710|3.657526|3.086460|3.180031|2.739015|18.609451|4.387996|4.226871|4.761020|7.015269|10.965002|7.070986|4.783184|6.623546|3.582734|448.794386| |1.377998|2.671708|1.650993|1.816769|2.048257|2.056749|1.824846|1.652780|3.199654|1.607923|2.306082|4.089103|3.453130|3.805119|3.490014|26.214547|5.307522|5.208417|7.914830|14.208900|8.166248|5.276780|4.615066|6.173736|3.003053|52.578765|73.516695| |1.338405|2.603010|1.598145|1.769449|1.979596|1.954634|1.730612|1.582396|3.003489|1.512481|2.259927|4.064504|3.386582|3.843579|3.536180|28.994017|5.030468|4.547145|6.781832|8.015800|5.249061|3.983226|3.799489|5.352742|2.590178|35.548390|24.128102|36.858105| |17.563013|16.434760|7.020113|4.770347|3.802363|3.741076|4.583506|6.735513|6.894731|4.063037|2.992637|5.052922|3.486427|2.984294|1.987519|12.313084|2.765072|1.854495|1.647599|1.528185|1.564815|1.738870|1.917848|3.880022|2.236551|11.327758|2.466135|1.338232|0.500000| |17.655290|17.015328|5.883930|4.430625|3.422903|3.186987|3.623129|4.913909|5.463123|3.123559|2.819911|4.892126|3.282279|2.869227|1.892992|11.946901|2.571942|1.713743|1.542126|1.424810|1.439445|1.575875|1.736354|3.442808|1.939756|10.434106|2.320608|1.274255|0.300106|0.500000| |17.561379|16.432607|7.000986|4.751858|3.793746|3.735372|4.576489|6.734037|6.880689|4.058800|2.984664|4.947801|3.546273|3.031573|1.979550|12.287588|2.712638|1.796888|1.600027|1.474474|1.496922|1.654466|1.834674|3.696858|2.095160|10.804410|2.386294|1.304037|0.298570|0.300121|0.500000| |4.859484|13.437737|8.928666|17.775330|8.893682|5.623833|4.947248|5.633667|6.520749|3.134766|7.168695|13.006186|6.565892|5.326540|3.241717|19.288217|4.230622|2.610418|2.266210|1.991598|1.960426|2.169909|2.532915|5.088200|2.656810|13.525405|3.165300|1.753227|0.119916|0.121351|0.119261|0.500000| |3.138364|6.524630|4.948448|5.610262|8.818898|17.760075|8.985836|5.650517|13.566676|4.888128|6.885310|8.719255|9.891150|6.636566|4.224799|21.932604|6.535881|3.931112|3.067739|2.660039|2.736626|3.299300|4.170689|10.079579|5.152654|18.062059|3.999232|2.115092|0.086922|0.075172|0.086681|0.123360|0.500000| |7.538669|12.628207|8.899996|5.632858|4.963634|5.635880|8.905288|17.815953|12.611516|7.532348|3.569668|5.594194|4.267933|3.490379|2.288923|13.710938|3.244473|2.145814|1.861410|1.711474|1.765597|2.003185|2.251045|4.724790|2.746256|12.599499|2.721437|1.464297|0.225787|0.146956|0.226573|0.124118|0.124509|0.500000| |4.069434|6.898872|4.582769|3.740366|3.796884|4.759602|7.008815|6.736808|16.431174|17.564876|2.973170|4.658552|3.787034|3.160508|2.155430|12.907218|3.171066|2.173951|1.879963|1.764304|1.869139|2.158797|2.376606|5.083078|3.165114|13.510924|2.790581|1.474513|0.128336|0.092735|0.117883|0.086806|0.120218|0.226243|0.500000| |4.053840|6.883544|4.573403|3.733333|3.796259|4.767053|7.017724|6.731805|16.432132|17.565647|2.971317|4.582215|3.874308|3.224090|2.150137|12.901723|3.100808|2.088050|1.814236|1.686663|1.760502|2.008488|2.229857|4.706444|2.808115|12.673742|2.681569|1.431671|0.117422|0.092420|0.127676|0.086566|0.120169|0.225944|0.298643|0.500000| |3.123638|5.464172|3.620657|3.184800|3.419226|4.428886|5.879392|4.911127|17.004775|17.652334|2.794921|4.317309|3.755097|3.159772|2.167828|12.948350|3.219072|2.222388|1.919270|1.807347|1.925211|2.233765|2.450541|5.262062|3.303320|13.930910|2.852661|1.500773|0.092626|0.073989|0.092512|0.075106|0.121976|0.146869|0.300067|0.300147|0.500000| |2.689109|5.698131|3.998340|5.021634|7.382252|7.083126|4.819820|3.937670|7.359967|3.204212|9.323089|11.023965|25.997928|12.988484|6.244659|29.933544|8.081188|4.221841|3.371599|2.766055|2.668266|3.034347|3.873807|8.045763|3.688838|17.328204|4.211361|2.316259|0.071374|0.067065|0.074520|0.124234|0.223753|0.090777|0.080816|0.085734|0.082417|0.500000| |2.256474|4.767012|3.075088|3.900941|4.725754|3.968734|3.106438|2.827991|4.840377|2.282518|7.238565|12.959971|12.799651|25.996747|9.530451|51.271025|8.289356|4.269435|3.723185|2.928818|2.644363|2.818005|3.487733|6.359566|2.894614|17.115293|4.584953|2.661635|0.059646|0.058604|0.061063|0.110870|0.113876|0.067903|0.060116|0.061682|0.059432|0.203324|0.500000| |2.248932|4.616803|3.117948|3.728305|5.019842|5.130078|3.806503|3.135535|6.275637|2.809779|6.401277|9.493522|12.162812|11.159689|9.685671|37.958625|25.998269|9.488007|5.774951|4.309951|4.151374|5.054831|7.956670|16.459800|5.652024|24.336546|5.988060|3.144399|0.062089|0.056880|0.060820|0.095521|0.177181|0.075050|0.073638|0.071761|0.074865|0.202793|0.161397|0.500000| |1.604134|3.183710|1.998527|2.278741|2.647661|2.585980|2.195931|1.967795|3.745544|1.830903|3.186046|5.671941|5.027642|6.083176|6.573555|53.636170|9.519848|9.021652|17.885166|8.911203|5.670714|4.977756|5.664023|7.609724|3.333061|31.516659|12.662821|7.609749|0.044298|0.041992|0.043350|0.062358|0.079351|0.049554|0.049118|0.047934|0.049936|0.092203|0.111354|0.143616|0.500000| |1.689736|3.247261|2.067986|2.217210|2.573342|2.790565|2.509047|2.172355|4.608581|2.277505|2.701704|4.517434|3.977494|3.878991|3.286632|20.109607|5.761737|5.635119|4.970593|5.662787|8.993657|17.789635|8.918728|12.518988|7.453515|54.712343|7.610556|3.334486|0.048417|0.043436|0.045748|0.057689|0.088500|0.055919|0.062002|0.056821|0.064510|0.077398|0.069700|0.118981|0.108045|0.500000| |2.095818|4.053504|2.649454|2.814863|3.320691|3.750284|3.384781|2.848472|6.237789|2.990699|3.304075|5.390675|4.622944|4.173332|3.325652|19.227607|5.806902|4.804792|3.827598|3.762995|4.604772|6.740735|7.086737|16.456331|17.573805|30.253232|5.369542|2.581137|0.061122|0.052925|0.056150|0.071161|0.119294|0.072413|0.082986|0.071874|0.083400|0.089348|0.074538|0.133467|0.089126|0.221446|0.500000| |2.404264|4.672672|3.175452|3.333037|4.112261|5.172975|4.633204|3.588408|9.002541|3.996320|3.843614|5.894233|5.456304|4.600041|3.458990|19.199390|5.960778|4.400353|3.406143|3.175484|3.616552|4.898635|5.859928|16.976738|17.649860|23.908343|4.624622|2.305640|0.069983|0.059412|0.065283|0.080854|0.178118|0.089585|0.106981|0.092502|0.111674|0.109775|0.080816|0.149112|0.082169|0.145795|0.299720|0.500000| |1.968725|3.769856|2.469508|2.595726|3.095911|3.636409|3.309326|2.714767|6.436102|3.078970|3.066418|4.867567|4.538677|4.114858|3.254036|18.774541|5.691211|4.701526|3.758253|3.708964|4.561324|6.709443|6.963857|16.446543|17.571086|30.195469|5.305149|2.545764|0.056798|0.049616|0.053870|0.065160|0.121499|0.069633|0.082048|0.074158|0.089239|0.091790|0.072728|0.131489|0.087582|0.226720|0.298651|0.299952|0.500000| |1.344090|2.617609|1.611497|1.788256|2.011616|1.989608|1.753857|1.597494|3.046157|1.529316|2.308997|4.115105|3.530497|4.078707|3.775320|31.849606|5.251691|4.611595|6.778689|7.014809|4.747754|3.786953|3.744813|5.344532|2.555621|31.483756|16.420465|17.574770|0.037167|0.035500|0.036543|0.049138|0.060108|0.040997|0.041131|0.040365|0.042190|0.067628|0.078343|0.090236|0.229275|0.088154|0.069314|0.063695|0.070194|0.500000| 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