Version2.4
2021-05-26T08:36:01Z
10.1021/jm300687e
Gaussian16
RevisionB.01
CFLINN
05-Jan-2021
#N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2)
DUDE c1cnc(nc1)[N-]S(=O)(=O)c2ccc(cc2)NC(=S)NNC(=S)Nc3ccc(cc3F)F C20534557
RHF
6-31G(d)
(6D,7F)
c1cnc(nc1)[N-]S(=O)(=O)c2ccc(cc2)NC(=S)NNC(=S)Nc3ccc(cc3F)F
C01[X(C18H14F2N7O2S3)]
132
C1
520
S=C(Nc1ccc(cc1)S(=O)(=O)[N-]c1ncccn1)NNC(=S)Nc1ccc(cc1F)F
S=C(Nc1ccc(cc1)S(=O)(=O)[N-]c1ncccn1)NNC(=S)Nc1ccc(cc1F)F
Fc1ccc(NC(=S)NNC(=S)Nc2ccc(cc2)[S](=O)(=O)[N-]c3ncccn3)c(F)c1
InChIKey=PLVONDABJOPDKU-UHFFFAOYSA-M
InChI=1S/C18H15F2N7O2S3/c19-11-2-7-15(14(20)10-11)24-18(31)26-25-17(30)23-12-3-5-13(6-4-12)32(28,29)27-16-21-8-1-9-22-16/h1-10H,(H5,21,22,23,24,25,26,27,30,31)/p-1
InChI=1/C18H15F2N7O2S3/c19-11-2-7-15(14(20)10-11)24-18(31)26-25-17(30)23-12-3-5-13(6-4-12)32(28,29)27-16-21-8-1-9-22-16/h1-10H,(H5,21,22,23,24,25,26,27,30,31)/p-1/fC18H14F2N7O2S3/h23-26H/q-1
c1cnc(nc1)[N-]S(=O)(=O)c2ccc(cc2)NC(=S)NNC(=S)Nc3ccc(cc3F)F
C01[X(C18H14F2N7O2S3)]
132
C01
520
S=C(Nc1ccc(cc1)S(=O)(=O)[N-]c1ncccn1)NNC(=S)Nc1ccc(cc1F)F
S[C]([NH][C]1[CH][CH][C]([CH][CH]1)[S]([N][C]1[N][CH][CH][CH][N]1)([O])[O])NN[C]([NH][C]1[CH][CH][C]([CH][C]1F)F)S
[O][S]([O])([N][C]1[N][CH][CH][CH][N]1)[C]2[CH][CH][C]([CH][CH]2)N[C](S)NN[C](S)N[C]3[CH][CH][C](F)[CH][C]3F
InChIKey=WKLRSPZMJQZMGR-UHFFFAOYSA-N
InChI=1S/C18H16F2N7O2S3/c19-11-2-7-15(14(20)10-11)24-18(31)26-25-17(30)23-12-3-5-13(6-4-12)32(28,29)27-16-21-8-1-9-22-16/h1-10,23-26,30-31H
InChI=1/C18H16F2N7O2S3/c19-11-2-7-15(14(20)10-11)24-18(31)26-25-17(30)23-12-3-5-13(6-4-12)32(28,29)27-16-21-8-1-9-22-16/h1-10,23-26,30-31H
3435.5094121799
-2611.9974203
1-A
29046.8637
127
393
520
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8.98050
-21.8497 2.8270 0.6161
22.0404
|XX|YY|ZZ|XY|XZ|YZ|
-367.1203 -231.6135 -224.1494 11.6587 19.9409 -15.7578
|XX|YY|ZZ|XY|XZ|YZ|
-92.8259 42.6809 50.1450 11.6587 19.9409 -15.7578
|XXX|YYY|ZZZ|XYY|XXY|XXZ|XZZ|YZZ|YYZ|XYZ|
-683.4972 72.8383 -29.2933 -73.9756 28.3534 -76.5353 -2.5977 8.7221 57.5438 -0.7114
|XXXX|YYYY|ZZZZ|XXXY|XXXZ|YYYX|YYYZ|ZZZX|ZZZY|XXYY|XXZZ|YYZZ|XXYZ|YYXZ|ZZXY|
-36078.8626 -6060.9761 -1696.1868 705.6848 781.5249 12.1766 -144.8063 266.0771 -87.3974 -6655.5016 -6041.6783 -1291.4327 -36.9589 -104.1889 -81.2086
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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
|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|
4.4294 7.9962 9.2573 18.2392 26.6836 36.4375 42.5607 45.3137 57.0950 70.8057 78.7335 81.9037 91.6760 134.9850 177.5319 180.5568 198.1968 207.3282 227.1037 241.5394 262.1826 289.7267 327.8221 342.3125 360.1032 377.7691 381.4181 385.8167 405.1004 451.6991 457.7129 462.9677 467.9463 514.2235 528.7994 540.1175 550.6344 553.2507 562.5422 591.5672 601.7809 608.2233 612.4335 630.9404 653.9323 661.2302 674.8549 690.7966 693.7980 696.6852 699.9787 728.7030 744.1460 765.6639 770.9930 789.7325 809.1853 819.4563 834.0989 836.4026 852.4667 866.8408 916.3342 931.6195 939.2607 951.4699 957.8563 1013.9322 1027.7396 1068.2836 1070.1909 1088.2355 1089.8438 1095.5890 1101.3778 1106.0058 1121.0319 1128.4707 1154.3934 1179.5221 1184.8214 1191.0039 1205.4504 1207.2595 1241.3755 1250.1862 1276.8444 1278.8567 1294.0284 1299.4507 1308.9069 1338.7701 1352.8161 1374.7229 1396.2943 1411.7227 1412.2383 1444.0993 1454.6973 1484.0706 1511.5417 1529.4175 1555.4610 1604.0091 1610.8545 1616.4131 1667.1885 1677.8821 1683.2454 1699.8193 1717.7975 1728.0225 1740.1462 1786.2381 1804.1283 1809.5193 1815.6377 1832.6298 3306.9931 3322.3152 3360.4639 3389.8856 3392.8602 3400.4858 3416.1602 3418.8259 3420.1284 3422.1647 3820.8699 3832.0544 3834.0499 3836.0016
9.3959 7.9345 8.0153 4.2486 8.0208 6.8872 15.6778 10.4976 9.9486 8.6328 10.1868 7.4896 10.1423 8.4399 8.8814 7.8170 8.4914 8.8343 9.6408 7.6392 7.4294 11.3883 8.2651 8.2663 9.3321 9.4003 9.7457 7.4420 7.8742 5.0745 3.0334 5.3708 4.2362 2.9570 5.1355 4.1526 6.6199 3.9405 1.7766 1.4992 4.2978 3.9608 1.6230 4.5983 5.3515 5.5365 3.5287 3.0706 6.5384 6.5189 3.9516 5.8342 3.9859 3.7619 5.6876 2.2712 6.6777 4.5972 4.3420 1.1998 5.2496 8.3637 11.0172 1.5167 1.2554 1.6435 1.5359 4.1227 4.3371 3.2645 10.4258 1.3701 1.4206 7.2773 1.4642 1.3607 2.9274 1.3785 2.4185 2.7073 3.9806 2.0530 1.8541 5.0238 3.2151 4.8491 2.3403 3.5284 1.1518 3.3571 2.4694 2.4872 3.2967 14.7950 2.1504 1.6037 1.9075 1.3262 5.4827 2.5629 2.2629 1.9801 2.7999 5.1545 4.5345 2.8385 1.6255 2.2243 2.0100 1.8357 2.2941 5.6221 2.4398 5.3487 8.4052 5.5045 5.6168 6.8904 1.0900 1.0905 1.0919 1.0969 1.0914 1.0915 1.0971 1.0946 1.0940 1.0950 1.0765 1.0784 1.0778 1.0779
0.0001 0.0003 0.0004 0.0008 0.0034 0.0054 0.0167 0.0127 0.0191 0.0255 0.0372 0.0296 0.0502 0.0906 0.1649 0.1501 0.1965 0.2237 0.2930 0.2626 0.3009 0.5632 0.5233 0.5707 0.7130 0.7904 0.8353 0.6527 0.7613 0.6100 0.3744 0.6783 0.5465 0.4607 0.8461 0.7138 1.1826 0.7106 0.3312 0.3091 0.9170 0.8633 0.3587 1.0785 1.3483 1.4262 0.9469 0.8633 1.8543 1.8642 1.1407 1.8253 1.3005 1.2994 1.9920 0.8346 2.5761 1.8188 1.7798 0.4945 2.2476 3.7028 5.4504 0.7756 0.6525 0.8766 0.8302 2.4972 2.6991 2.1950 7.0353 0.9560 0.9941 5.1465 1.0465 0.9807 2.1676 1.0343 1.8989 2.2192 3.2924 1.7158 1.5873 4.3140 2.9191 4.4654 2.2480 3.3999 1.1364 3.3399 2.4926 2.6265 3.5548 16.4739 2.4702 1.8831 2.2415 1.6295 6.8359 3.3257 3.0462 2.7290 3.9913 7.8137 6.9325 4.3696 2.6619 3.6895 3.3553 3.1251 3.9884 9.8912 4.3529 10.0548 16.1187 10.6193 10.9093 13.6347 7.0231 7.0917 7.2647 7.4264 7.4023 7.4364 7.5435 7.5378 7.5396 7.5553 9.2591 9.3303 9.3350 9.3455
0.3348 0.6885 0.8655 0.4226 0.3421 1.9157 1.3763 4.0795 0.3494 7.4299 0.4685 0.1559 0.7125 5.2048 1.3891 5.0193 10.4372 1.6057 2.2366 5.8054 0.8392 2.9018 24.4611 6.1590 11.5595 10.4960 2.1334 2.6850 0.2749 1.6021 0.1294 20.1692 1.6477 2.1342 41.5560 48.7616 1.7252 18.8217 48.2636 147.5677 18.7389 1.8683 59.1457 20.1754 32.3990 132.3397 18.1677 15.6890 16.2540 2.8340 3.4289 64.1009 157.0145 16.8846 303.0407 131.9156 8.5414 31.5040 55.8022 38.4925 36.3093 125.0830 44.3588 5.4996 0.8569 5.4155 60.0431 44.7858 1.5505 33.9361 25.7599 0.6978 25.9780 353.1615 0.0314 0.6794 4.9819 0.0032 15.3549 23.9550 15.5675 3.2558 4.2405 383.2111 33.1714 112.6479 33.1432 229.8745 1.8241 522.9395 51.7648 32.5695 2.5470 226.0199 39.5712 39.7193 46.6218 9.4415 96.6882 218.3248 435.1741 33.0645 46.1044 43.7524 1606.1627 616.1124 33.0110 5.2336 140.8057 99.7173 696.4917 199.7796 350.8507 44.3366 93.4798 4.0708 535.2042 61.9036 83.2346 75.1899 22.2511 41.1036 10.7746 3.0345 1.0472 2.6029 1.3768 0.0384 105.2416 64.6878 82.8534 92.6077
1.5884 1.2340 2.7800 7.3683 1.9757 5.2641 4.3510 0.9418 0.8841 4.6029 3.1030 2.7824 1.4606 2.6306 0.4152 2.4120 0.3361 0.2644 0.4244 0.6989 1.8835 1.1113 6.4180 0.8816 1.9820 4.0091 0.9983 1.0759 7.4750 1.9077 1.0785 2.6909 1.4546 0.1723 0.4965 1.7401 3.4275 0.9449 2.0285 1.4705 1.5097 0.6216 15.0902 3.4843 2.1606 4.2830 3.4925 1.7195 3.7435 4.0264 0.4504 3.9359 2.9777 2.8012 1.4642 1.5304 14.4799 1.6895 9.5458 0.3198 34.1027 20.2328 0.1871 1.9971 2.0829 0.9886 1.4653 3.5441 10.2956 7.5450 30.6761 1.0331 2.7980 1.6926 4.9759 0.1312 0.5978 3.8062 2.4930 20.0154 11.2284 3.1046 3.7540 12.1103 2.4899 15.1263 10.4248 5.3385 9.6414 7.2797 1.6112 3.9429 37.9832 2.6968 3.9192 2.8975 6.4141 1.3730 13.7610 16.6825 3.7318 5.9955 1.5607 1.1984 8.1244 4.7058 9.9021 2.0125 5.0293 2.6610 13.7569 1.3955 58.4357 9.2222 7.4452 104.6500 124.1902 27.9111 145.5744 133.7007 80.0047 206.2209 53.4824 43.9294 113.1680 49.9532 106.8531 124.2041 90.4851 15.4679 164.4853 32.6851
0.7499 0.7384 0.7497 0.7272 0.7430 0.7442 0.7477 0.6371 0.6720 0.7439 0.5886 0.7492 0.7432 0.4103 0.4969 0.6866 0.6992 0.7428 0.4904 0.6438 0.7469 0.2145 0.3843 0.7147 0.7364 0.2849 0.5917 0.6999 0.6677 0.5689 0.6020 0.3293 0.7055 0.6041 0.7431 0.7433 0.3689 0.6690 0.7295 0.2460 0.2371 0.6873 0.3455 0.7356 0.2941 0.5594 0.6498 0.5139 0.7426 0.6971 0.7410 0.3335 0.4401 0.1653 0.4076 0.7058 0.1723 0.7095 0.0657 0.7494 0.0709 0.1364 0.7218 0.6713 0.5482 0.4665 0.7485 0.6943 0.2358 0.1064 0.2158 0.7278 0.6022 0.5376 0.7497 0.4965 0.5389 0.7500 0.7423 0.1056 0.1668 0.1700 0.6705 0.4039 0.7450 0.0567 0.6160 0.5085 0.1580 0.7427 0.6933 0.2265 0.2302 0.7063 0.6106 0.7414 0.2690 0.5877 0.2467 0.3630 0.3509 0.2479 0.5338 0.3995 0.3065 0.2720 0.1486 0.7462 0.7452 0.7250 0.4540 0.6846 0.2489 0.3163 0.6598 0.4518 0.3955 0.5495 0.3675 0.4330 0.3659 0.2200 0.4614 0.7405 0.1651 0.2195 0.1758 0.2971 0.1293 0.7444 0.0477 0.7464
0.8571 0.8495 0.8569 0.8421 0.8526 0.8534 0.8556 0.7784 0.8039 0.8531 0.7410 0.8567 0.8527 0.5819 0.6639 0.8142 0.8230 0.8524 0.6581 0.7833 0.8551 0.3532 0.5552 0.8336 0.8482 0.4434 0.7435 0.8234 0.8008 0.7252 0.7515 0.4954 0.8273 0.7532 0.8526 0.8527 0.5389 0.8017 0.8436 0.3949 0.3833 0.8147 0.5135 0.8477 0.4545 0.7175 0.7877 0.6789 0.8523 0.8215 0.8512 0.5002 0.6112 0.2838 0.5792 0.8275 0.2939 0.8301 0.1233 0.8567 0.1325 0.2401 0.8384 0.8034 0.7082 0.6363 0.8561 0.8196 0.3816 0.1924 0.3549 0.8425 0.7517 0.6992 0.8570 0.6636 0.7004 0.8571 0.8521 0.1910 0.2859 0.2906 0.8028 0.5754 0.8539 0.1073 0.7624 0.6742 0.2729 0.8524 0.8189 0.3693 0.3743 0.8279 0.7582 0.8515 0.4239 0.7403 0.3957 0.5326 0.5196 0.3973 0.6961 0.5710 0.4692 0.4276 0.2587 0.8546 0.8540 0.8406 0.6245 0.8128 0.3986 0.4805 0.7950 0.6224 0.5668 0.7093 0.5375 0.6043 0.5358 0.3606 0.6314 0.8509 0.2834 0.3600 0.2990 0.4580 0.2290 0.8535 0.0911 0.8548
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
6 6 7 6 7 6 7 16 8 8 6 6 6 6 6 6 7 6 16 7 7 6 16 7 6 6 6 6 6 6 9 9 1 1 1 1 1 1 1 1 1 1 1 1 1 1
12.00000 12.00000 14.00307 12.00000 14.00307 12.00000 14.00307 31.97207 15.99491 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 31.97207 14.00307 14.00307 12.00000 31.97207 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 18.99840 18.99840 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
10005.4846 47487.8995 53559.7604
0.99997 0.00729 -0.00016 -0.00729 0.99997 -0.00220 0.00014 0.00220 1.00000
1
0.00866 0.00182 0.00162
0.18038 0.03800 0.03370
6.37 11.50 13.32 26.24 38.39 52.43 61.24 65.20 82.15 101.87 113.28 117.84 131.90 194.21 255.43 259.78 285.16 298.30 326.75 347.52 377.22 416.85 471.66 492.51 518.11 543.53 548.78 555.10 582.85 649.89 658.55 666.11 673.27 739.85 760.82 777.11 792.24 796.00 809.37 851.13 865.83 875.10 881.16 907.78 940.86 951.36 970.97 993.90 998.22 1002.37 1007.11 1048.44 1070.66 1101.62 1109.29 1136.25 1164.24 1179.01 1200.08 1203.40 1226.51 1247.19 1318.40 1340.39 1351.39 1368.95 1378.14 1458.82 1478.69 1537.02 1539.77 1565.73 1568.04 1576.31 1584.64 1591.30 1612.91 1623.62 1660.91 1697.07 1704.69 1713.59 1734.37 1736.98 1786.06 1798.74 1837.09 1839.99 1861.82 1869.62 1883.23 1926.19 1946.40 1977.92 2008.96 2031.15 2031.90 2077.74 2092.98 2135.25 2174.77 2200.49 2237.96 2307.81 2317.66 2325.66 2398.71 2414.10 2421.81 2445.66 2471.53 2486.24 2503.68 2570.00 2595.74 2603.49 2612.30 2636.75 4758.03 4780.07 4834.96 4877.29 4881.57 4892.54 4915.09 4918.93 4920.80 4923.73 5497.38 5513.47 5516.34 5519.15
0.345613
0.372281
0.373226
0.278549
-2611.651808
-2611.625139
-2611.624195
-2611.718872
3.175482D-04
MUNgauss
RevisionA2.1
retrievium
26-May-2021
DUDE c1cnc(nc1)[N-]S(=O)(=O)c2ccc(cc2)NC(=S)NNC(=S)Nc3ccc(cc3F)F C20534557
RHF
6-31G(d)
(6D,10F)
C1
494.033920
|X|Y|Z|
153.384273 65.791360 34.515903
70.359538
26
|36.858105|
|13.729587|36.858105|
|8.000336|14.582478|53.358707|
|7.040590|8.392753|19.173412|36.858105|
|8.023893|7.103427|10.938316|14.152974|53.358707|
|13.771288|8.193875|9.629685|8.377059|19.808796|36.858105|
|4.713834|5.503399|11.405950|14.250878|11.069113|5.423255|53.358707|
|3.747647|3.955663|6.898624|7.480663|9.033723|4.558271|16.375610|388.023441|
|3.513423|3.563902|5.848476|5.943763|8.123221|4.332368|10.160571|93.641346|73.516695|
|3.514588|3.562688|5.843810|5.942962|8.137293|4.337435|10.150228|93.609644|13.774309|73.516695|
|2.908012|3.175014|5.442587|4.940279|5.717918|3.268728|10.174998|75.685718|13.138432|13.142326|36.858105|
|2.639784|2.892877|4.855384|4.168829|4.877500|2.899324|7.854530|49.143662|11.456048|8.856830|13.747524|36.858105|
|2.255739|2.474780|4.040605|3.291040|3.909401|2.417839|5.773770|33.463705|7.850130|6.840702|7.936847|13.775389|36.858105|
|2.111204|2.312744|3.739623|3.007864|3.596850|2.249185|5.184049|29.778768|6.605785|6.606628|6.903510|7.974069|13.761709|36.858105|
|2.236618|2.443311|3.976633|3.253021|3.889451|2.404874|5.690344|33.483232|6.880355|7.907815|7.953175|6.882212|7.923233|13.775472|36.858105|
|2.611667|2.846426|4.752635|4.097504|4.842332|2.879068|7.659877|49.185541|8.935034|11.627084|13.777011|7.940153|6.862473|7.957064|13.752797|36.858105|
|1.845255|2.014730|3.181706|2.486646|3.016085|1.935911|4.087415|22.658195|5.181860|5.196485|4.546171|5.134698|7.764969|13.280721|7.880744|5.161615|53.358707|
|1.663227|1.792805|2.781806|2.171331|2.688382|1.746183|3.482193|19.528917|4.634246|4.531554|3.690779|4.216952|5.971496|7.680312|5.426524|4.006609|19.626221|36.858105|
|1.605280|1.703447|2.618983|2.074111|2.622531|1.704629|3.295510|19.103336|4.725126|4.440703|3.500222|4.075992|5.422183|5.868462|4.467249|3.615372|9.621608|11.394569|388.023441|
|1.517551|1.636124|2.507280|1.923336|2.389936|1.575451|3.017410|16.508554|3.921301|3.878608|2.968096|3.293148|4.303389|5.191431|4.143519|3.217577|11.372616|13.743634|51.811206|53.358707|
|1.504433|1.631994|2.496290|1.890867|2.335683|1.548230|2.946867|15.783246|3.678611|3.747234|2.797901|3.000531|3.774339|4.657469|3.992722|3.105351|9.678215|7.919118|34.816583|18.885318|53.358707|
|1.462780|1.595963|2.427184|1.808735|2.225371|1.488519|2.783965|14.563621|3.406636|3.432459|2.518372|2.710322|3.319599|3.857700|3.355108|2.729409|7.210791|5.493571|27.409588|10.851551|19.005314|36.858105|
|1.389652|1.516074|2.282867|1.681946|2.075835|1.402574|2.549120|13.163500|3.054363|3.151043|2.211246|2.306734|2.698827|3.106515|2.881824|2.418003|5.307763|3.847039|20.901242|6.641877|9.880147|11.389387|388.023441|
|1.471219|1.608572|2.445256|1.815156|2.229005|1.493139|2.787946|14.496053|3.441595|3.358212|2.494439|2.765000|3.411092|3.742893|3.139890|2.614897|6.760138|5.274227|27.631581|9.748554|11.410056|14.283947|50.493634|53.358707|
|1.413947|1.549241|2.333128|1.708042|2.099429|1.420865|2.583124|13.212844|3.155706|3.055310|2.210033|2.436108|2.892519|3.052079|2.636481|2.277940|5.081775|3.836142|21.915248|6.383817|7.149014|7.801547|43.178213|18.285559|36.858105|
|1.486528|1.645653|2.479530|1.788257|2.177321|1.478913|2.690187|13.462360|3.195741|3.091354|2.228387|2.444566|2.842973|2.950731|2.587519|2.277720|4.693079|3.350780|19.388812|5.181415|5.795106|5.789510|36.889526|10.597386|13.751807|36.858105|
|1.405893|1.552462|2.309663|1.650485|2.022130|1.388239|2.443111|12.146345|2.905452|2.797999|1.960084|2.132633|2.409386|2.454747|2.198113|1.983146|3.766228|2.709740|16.390712|4.097708|4.465425|4.173847|28.812185|6.981657|7.906654|13.775657|36.858105|
|1.282955|1.402311|2.069374|1.487885|1.843647|1.271005|2.189570|11.013856|2.659416|2.554786|1.761902|1.913597|2.151642|2.187854|1.966855|1.780955|3.361148|2.490220|15.460344|3.817459|4.087595|3.757355|26.139815|6.221424|6.926706|8.034764|13.815312|36.858105|
|1.232780|1.338176|1.976875|1.436812|1.791116|1.230792|2.124130|10.841552|2.628446|2.526497|1.746227|1.902072|2.162987|2.217081|1.979025|1.773935|3.475052|2.655171|16.571373|4.199655|4.454154|4.133238|27.888507|7.001956|7.882281|6.859293|7.878779|13.828645|36.858105|
|1.288579|1.399576|2.085131|1.528154|1.899728|1.294969|2.285432|11.766781|2.841645|2.740455|1.931431|2.117227|2.464575|2.566609|2.252988|1.979010|4.169055|3.249789|19.675467|5.388000|5.772855|5.692110|35.099563|10.692788|13.781084|8.012188|6.912362|8.090170|13.826330|36.858105|
|1.227982|1.323252|1.967335|1.455141|1.823837|1.242109|2.177601|11.376253|2.762290|2.668543|1.868079|2.044059|2.385599|2.501393|2.197517|1.922131|4.105736|3.340876|20.723506|5.733627|5.934524|5.499982|32.970254|9.480787|8.169749|5.315782|4.671123|5.349037|8.201739|14.406303|97.533100|
|1.217709|1.326968|1.940140|1.387721|1.728313|1.200624|2.020319|10.125919|2.455277|2.355872|1.593756|1.718931|1.898543|1.914606|1.744187|1.602650|2.879940|2.126625|13.495820|3.196089|3.384345|2.988662|21.293473|4.720220|4.673913|5.320705|8.172901|14.370903|8.205673|5.347887|9.231265|97.533100|
|17.746457|8.790609|7.732349|5.040761|7.742129|8.802699|5.069646|22.098130|5.285664|5.287481|2.499256|2.301512|2.003863|1.887520|1.988532|2.280234|2.277387|1.521595|10.473693|1.905199|1.892457|1.357547|9.225607|1.859138|1.320208|1.387952|1.322108|1.212293|1.164086|1.210555|2.598097|2.603315|0.500000|
|8.886102|17.630473|12.807723|5.888641|6.892845|5.731079|6.034000|23.556483|5.363934|5.361069|2.811116|2.614367|2.294432|2.160856|2.262264|2.570268|2.605929|1.709356|11.474818|2.146378|2.155956|1.564435|10.653919|2.150784|1.536512|1.645877|1.565571|1.411421|1.337781|1.390088|2.942288|3.020509|0.210593|0.500000|
|8.883113|5.726439|6.875443|5.888580|12.799435|17.647806|5.940114|28.554740|7.080719|7.092377|2.936667|2.626388|2.215370|2.070357|2.209550|2.617925|2.445743|1.638619|11.497633|2.017567|1.976454|1.392955|9.346231|1.899594|1.328128|1.374218|1.293495|1.192218|1.159233|1.218231|2.642492|2.540342|0.210187|0.124376|0.500000|
|2.745192|2.987168|4.974282|4.288863|5.086492|3.028614|7.768700|47.213141|13.024442|8.173600|8.958494|17.761603|8.910117|5.658374|4.960403|5.661266|5.653881|3.616155|25.858023|3.977577|3.617366|2.451677|14.955861|3.466631|2.293128|2.315891|2.053452|1.853330|1.835096|2.018560|4.378600|3.777697|0.066410|0.074629|0.076273|0.500000|
|2.096616|2.292252|3.674420|2.928989|3.524561|2.223896|4.925250|27.673638|6.851137|5.735014|5.642544|8.906229|17.746968|8.925099|5.644861|4.948859|9.679033|6.194451|41.863365|6.164852|5.202789|3.427377|19.324779|5.008494|3.124168|3.038618|2.566384|2.301056|2.326689|2.665339|5.806276|4.541828|0.052247|0.059697|0.056965|0.213857|0.500000|
|2.068623|2.247185|3.587873|2.879982|3.496885|2.205060|4.830313|27.673943|5.773008|6.916233|5.647566|4.955826|5.642163|8.927939|17.704246|8.897732|9.899029|5.234561|29.707535|5.740976|5.795146|3.498372|21.895858|4.277424|2.621146|2.550489|2.165083|1.945756|1.967416|2.246947|4.961591|3.880143|0.051605|0.058382|0.056715|0.107634|0.124254|0.500000|
|2.689012|2.897342|4.781522|4.152000|5.014143|2.986941|7.438678|47.245467|8.282778|13.460801|8.968392|5.660261|4.950356|5.649149|8.888556|17.764548|5.689736|3.387714|22.008053|3.853108|3.797042|2.477101|16.055607|3.195539|2.071959|2.079002|1.832010|1.653632|1.643895|1.818537|3.981436|3.374069|0.065231|0.072300|0.075774|0.124775|0.107519|0.213404|0.500000|
|1.821086|2.003915|3.157248|2.423958|2.919072|1.889154|3.939862|21.134646|4.758554|4.900346|4.089110|4.417634|6.063431|9.212267|6.998176|4.739771|25.991639|9.632712|38.027340|10.921714|11.668499|6.416236|33.302139|7.631597|4.126890|3.849592|3.015649|2.644114|2.711758|3.277689|7.120076|5.048776|0.045991|0.053367|0.048545|0.101560|0.155814|0.197570|0.110766|0.500000|
|1.419570|1.518335|2.306313|1.771807|2.226333|1.475990|2.749802|15.153063|3.645727|3.592018|2.659250|2.928978|3.694537|4.273345|3.550667|2.853517|8.256717|9.491365|51.348065|25.979695|12.815256|6.457252|30.995032|8.145422|4.227814|3.394430|2.773107|2.660378|2.989669|3.808107|9.637600|5.065773|0.036541|0.040668|0.038820|0.073524|0.108708|0.100801|0.070853|0.158660|0.500000|
|1.466027|1.583171|2.411455|1.830442|2.274557|1.511047|2.838872|15.284065|3.538003|3.694920|2.679041|2.793042|3.411063|4.268698|3.894498|3.038430|8.272258|6.501200|31.291939|12.686619|25.981553|9.491130|50.545332|8.216452|4.303318|3.631637|2.909358|2.694520|2.917487|3.648256|8.537366|5.121649|0.037710|0.042656|0.039492|0.068584|0.093392|0.120703|0.077381|0.200494|0.215593|0.500000|
|1.498182|1.632748|2.490103|1.865288|2.295457|1.530052|2.883950|15.178014|3.642446|3.486665|2.642238|3.001156|3.803254|4.090741|3.296504|2.732778|7.545380|6.322852|32.982925|11.728646|10.875416|9.549919|38.026702|25.965210|9.155068|6.220590|4.440146|4.051858|4.566954|6.583255|14.335687|7.136900|0.038544|0.044298|0.039772|0.076948|0.118086|0.089727|0.067230|0.162379|0.196494|0.157375|0.500000|
|1.612508|1.802977|2.744206|1.969915|2.369596|1.600972|2.987911|14.771399|3.463588|3.370132|2.472261|2.707944|3.160769|3.302057|2.893260|2.535830|5.203887|3.542168|20.008288|5.293570|6.000872|5.785547|36.707109|9.753534|8.976737|17.746946|8.922984|5.685774|4.947268|5.690951|9.634824|9.611661|0.041593|0.050099|0.041049|0.070561|0.092611|0.078789|0.063927|0.121689|0.093599|0.104461|0.164565|0.500000|
|1.441211|1.600201|2.371752|1.675720|2.045910|1.411654|2.461104|12.075068|2.881692|2.776451|1.924954|2.080230|2.309101|2.332646|2.116138|1.937206|3.489780|2.466095|15.065465|3.632969|3.940316|3.547474|25.092030|5.644979|5.620875|8.860965|17.759203|8.949090|5.635068|4.975959|8.321684|16.684088|0.037723|0.045173|0.036435|0.055959|0.067703|0.057703|0.049974|0.077448|0.068239|0.072493|0.102685|0.212811|0.500000|
|1.155711|1.247235|1.831833|1.333897|1.674273|1.154840|1.961252|10.057443|2.451419|2.354900|1.605141|1.741205|1.961834|2.004163|1.803176|1.627867|3.110430|2.400516|15.350291|3.771110|3.938058|3.514618|24.092687|5.683509|5.623064|4.948825|5.618350|8.889881|17.768106|8.909943|16.636903|16.611494|0.030420|0.034632|0.030338|0.046890|0.058489|0.049886|0.042121|0.066637|0.076203|0.072976|0.106666|0.107494|0.124067|0.500000|
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