Version2.2
2021-02-18T11:55:48Z
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 Cc1csc(n1)NC(=O)CSc2c(ccc(n2)c3ccc(c(c3)OC)OC)C#N C08783544
RHF
6-31G(d)
(6D,7F)
Cc1csc(n1)NC(=O)CSc2c(ccc(n2)c3ccc(c(c3)OC)OC)C#N
C01[X(C20H18N4O3S2)]
135
C1
479
N#Cc1ccc(nc1SCC(=O)Nc1scc(n1)C)c1ccc(c(c1)OC)OC
N#Cc1ccc(nc1SCC(=O)Nc1scc(n1)C)c1ccc(c(c1)OC)OC
COc1ccc(cc1OC)c2ccc(C#N)c(SCC(=O)Nc3scc(C)n3)n2
InChIKey=WWCQHHPTUJRNTP-UHFFFAOYSA-N
InChI=1S/C20H18N4O3S2/c1-12-10-29-20(22-12)24-18(25)11-28-19-14(9-21)4-6-15(23-19)13-5-7-16(26-2)17(8-13)27-3/h4-8,10H,11H2,1-3H3,(H,22,24,25)
InChI=1/C20H18N4O3S2/c1-12-10-29-20(22-12)24-18(25)11-28-19-14(9-21)4-6-15(23-19)13-5-7-16(26-2)17(8-13)27-3/h4-8,10H,11H2,1-3H3,(H,22,24,25)/f/h24H
Cc1csc(n1)NC(=O)CSc2c(ccc(n2)c3ccc(c(c3)OC)OC)C#N
C01[X(C20H18N4O3S2)]
135
C01
479
N#Cc1ccc(nc1SCC(=O)Nc1scc(n1)C)c1ccc(c(c1)OC)OC
N#C[C]1[CH][CH][C]([N][C]1SCC(=O)N[C]1SC=[C]([N]=1)C)[C]1[CH][CH][C]([C]([CH]1)OC)OC
CO[C]1[CH][CH][C]([CH][C]1OC)[C]2[CH][CH][C](C#N)[C]([N]2)SCC(=O)Nc3scc(C)n3
InChIKey=WWCQHHPTUJRNTP-UHFFFAOYSA-N
InChI=1S/C20H18N4O3S2/c1-12-10-29-20(22-12)24-18(25)11-28-19-14(9-21)4-6-15(23-19)13-5-7-16(26-2)17(8-13)27-3/h4-8,10H,11H2,1-3H3,(H,22,24,25)
InChI=1/C20H18N4O3S2/c1-12-10-29-20(22-12)24-18(25)11-28-19-14(9-21)4-6-15(23-19)13-5-7-16(26-2)17(8-13)27-3/h4-8,10H,11H2,1-3H3,(H,22,24,25)/f/h24H
2817.0066114159
-2005.2373012
1-A
19262.7224
111
368
479
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9.76445
-5.5701 -6.3352 -0.8907
8.4826
|XX|YY|ZZ|XY|XZ|YZ|
-144.5577 -217.1096 -181.1102 -18.8495 8.1128 -0.6497
|XX|YY|ZZ|XY|XZ|YZ|
36.3681 -36.1838 -0.1843 -18.8495 8.1128 -0.6497
|XXX|YYY|ZZZ|XYY|XXY|XXZ|XZZ|YZZ|YYZ|XYZ|
-90.4998 -313.3920 12.2644 -77.0623 -100.5647 -72.8504 -13.3117 -27.4176 -15.0270 -23.2279
|XXXX|YYYY|ZZZZ|XXXY|XXXZ|YYYX|YYYZ|ZZZX|ZZZY|XXYY|XXZZ|YYZZ|XXYZ|YYXZ|ZZXY|
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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 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135
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9.9782 18.2245 20.7676 30.4383 42.8373 60.0186 60.8302 73.6891 77.3229 87.9291 103.1750 111.8664 119.7944 130.2714 160.4786 179.8436 193.7654 206.5825 216.1081 224.6730 236.5965 256.5755 268.9896 280.2053 296.3633 299.7522 320.7728 322.4263 376.3250 401.4876 410.7052 426.6708 438.0950 480.6289 486.0485 518.9041 538.6552 562.0993 591.6899 595.8468 607.2129 640.9081 649.4286 651.4653 658.1256 671.5262 687.1593 712.5822 722.5351 744.0264 745.0164 761.4947 799.4314 826.3164 843.9010 844.5632 864.3742 890.1620 903.1567 920.4468 927.4346 951.2538 997.6421 1005.4465 1018.1042 1036.4645 1055.7905 1104.0712 1118.0669 1128.5023 1156.3620 1175.5023 1175.6729 1185.4504 1199.0937 1222.1185 1260.9941 1270.3759 1277.1920 1289.2444 1294.1342 1294.3510 1302.6721 1304.7710 1323.5914 1339.7416 1348.6057 1384.6642 1413.4262 1420.6582 1447.3664 1461.7796 1466.9928 1482.2404 1522.5338 1568.6795 1581.8938 1598.6152 1608.7287 1620.9735 1630.4955 1632.3396 1637.3504 1639.6582 1650.7810 1651.6199 1658.9387 1659.2451 1706.8987 1742.0388 1748.1653 1782.1691 1784.8099 1790.9075 1806.1765 1988.7845 2602.6226 3203.7171 3208.4553 3212.2797 3264.0159 3264.5341 3269.9733 3271.2746 3293.2318 3316.1754 3332.4929 3334.5491 3382.1170 3392.7340 3411.1685 3422.1502 3436.5776 3448.4432 3858.4309
5.4445 4.8673 6.1001 5.6033 5.9337 6.3215 6.2706 3.4967 8.3110 4.1275 3.0999 6.6059 7.8488 5.3642 1.0789 4.0894 3.8213 6.3335 6.3499 3.4550 4.0156 2.1050 7.3651 1.5620 3.2889 2.5902 2.9391 4.0900 6.4133 5.7156 3.9671 5.4545 9.5365 3.8648 6.8983 3.2472 7.4853 1.6801 8.9137 6.8899 8.4708 3.1177 4.6382 7.1426 1.9601 4.8271 4.8342 7.2413 6.2910 5.4650 6.2148 8.2714 4.6151 5.9383 5.0075 1.2430 5.2356 7.5621 5.2609 4.1617 1.3926 1.4995 2.4844 2.1883 1.8999 6.0015 1.3531 3.1007 1.3663 1.7682 4.3690 1.5599 5.2980 3.7188 3.5473 5.6082 1.8126 1.8804 1.5880 1.8208 1.2684 1.2684 1.1479 2.5941 1.5946 1.6737 2.8238 3.0546 2.0958 4.9155 1.7462 2.8078 3.5759 1.8388 4.1701 1.3241 3.1888 1.1183 3.0232 1.0449 1.1696 1.2569 1.3337 2.4133 1.0491 1.0477 1.0526 1.0615 3.2092 5.1368 3.8711 6.6591 6.2709 6.3402 5.5836 10.6668 12.6993 1.0353 1.0347 1.0366 1.0740 1.0918 1.1026 1.1075 1.1035 1.1062 1.1010 1.1016 1.0906 1.0926 1.0935 1.0952 1.0907 1.0966 1.0786
0.0003 0.0010 0.0016 0.0031 0.0064 0.0134 0.0137 0.0112 0.0293 0.0188 0.0194 0.0487 0.0664 0.0536 0.0164 0.0779 0.0845 0.1593 0.1747 0.1028 0.1324 0.0816 0.3140 0.0723 0.1702 0.1371 0.1782 0.2505 0.5351 0.5428 0.3943 0.5850 1.0784 0.5260 0.9602 0.5152 1.2796 0.3128 1.8386 1.4412 1.8402 0.7545 1.1526 1.7860 0.5002 1.2825 1.3449 2.1664 1.9350 1.7824 2.0324 2.8259 1.7378 2.3889 2.1012 0.5224 2.3047 3.5304 2.5283 2.0774 0.7057 0.7995 1.4569 1.3034 1.1603 3.7986 0.8886 2.2269 1.0063 1.3267 3.4421 1.2700 4.3145 3.0791 3.0051 4.9351 1.6981 1.7880 1.5262 1.7831 1.2516 1.2520 1.1477 2.6019 1.6460 1.7700 3.0259 3.4506 2.4669 5.8451 2.1553 3.5350 4.5341 2.3802 5.6956 1.9197 4.7014 1.6838 4.6099 1.6177 1.8320 1.9732 2.1066 3.8227 1.6844 1.6839 1.7068 1.7218 5.5088 9.1846 6.9703 12.4613 11.7697 11.9812 10.7321 24.8577 50.6818 6.2607 6.2755 6.3022 6.7416 6.8557 6.9462 6.9831 7.0514 7.1672 7.2039 7.2165 7.3499 7.4098 7.4971 7.5570 7.5892 7.6831 9.4613
0.6687 0.0188 0.0505 0.0226 1.0563 2.7880 0.9911 11.4418 1.6487 0.3273 8.8347 0.1236 5.0047 2.7195 0.4721 2.2692 2.3794 17.6648 1.7869 1.1256 3.6469 3.1819 0.3344 2.2032 11.0490 8.4279 2.6864 0.2772 3.6542 0.7973 5.1068 1.2284 1.4997 1.0227 3.9629 0.4382 1.1253 48.2324 2.0709 2.5806 11.0392 9.0867 3.3285 5.7967 38.0145 12.8697 5.4045 9.0542 27.4903 1.1178 3.3073 1.7099 0.1966 51.4438 32.8994 32.2656 16.3585 7.9397 4.2902 8.5644 50.3575 22.9115 28.4332 15.7507 11.2987 3.2122 1.9310 12.6045 0.5921 23.8520 34.7530 2.3530 42.3505 70.2124 25.1748 38.3557 79.2927 145.0863 62.7889 1.7495 0.4501 6.4648 7.2057 115.2841 80.5355 22.5082 20.9149 237.3171 70.2246 214.9515 26.0579 135.1021 425.7618 173.0198 144.6144 13.7015 57.6575 26.0594 267.6036 4.6960 9.3541 19.9471 16.1907 50.6186 4.1186 5.8401 22.5380 41.2935 354.6854 285.3318 395.2615 242.8785 245.0008 136.1557 40.6398 193.4310 72.0086 58.3714 49.9166 33.0154 18.4288 51.4593 23.5178 56.4018 25.8427 0.9407 33.5046 46.7639 12.6701 4.0802 14.0798 4.9369 3.9260 2.0431 62.2619
2.6513 1.5595 1.5496 2.7639 1.2867 2.3668 1.0134 0.3037 0.1301 2.7708 1.1092 1.1744 3.4952 1.8409 0.1096 1.2429 1.5436 1.1231 2.6569 3.1602 0.4281 0.5142 1.4727 0.7497 0.5608 2.3049 1.3303 0.8205 0.1699 1.1306 4.1041 0.6936 1.6170 6.5957 1.4123 3.6117 1.7176 2.2041 6.3029 13.2392 7.9963 1.0218 3.3569 5.4320 0.6842 1.8844 3.2355 2.8866 2.6279 9.7752 1.7128 5.4400 1.7581 4.6391 31.9026 1.8128 7.1164 7.2852 14.5112 7.8003 2.0314 3.1450 6.7854 3.6455 1.3005 1.0648 4.9516 11.9528 2.8844 1.9005 2.1016 1.9754 8.4656 23.1888 4.4452 27.9655 34.3401 4.4394 6.1606 26.6169 8.0864 0.6088 8.9265 4.4563 21.4453 7.6420 72.8905 71.8380 95.5854 6.0148 136.8083 26.7722 209.9172 24.2022 10.7593 13.5106 83.2330 9.1961 72.4310 20.7282 16.9295 9.6728 27.5441 53.6067 23.0484 28.1982 23.5675 8.7362 35.5655 40.9751 103.2152 589.6791 34.1481 412.6159 507.9791 16.6538 569.5944 70.9554 131.0902 148.8532 51.0517 48.6525 85.4847 50.1235 83.2490 29.9094 114.6872 166.9568 49.8671 91.4012 96.8137 124.3282 42.8151 121.7862 55.7904
0.7499 0.6935 0.7359 0.7119 0.7461 0.7361 0.7451 0.6863 0.7373 0.5192 0.7498 0.7285 0.6149 0.6515 0.7419 0.7486 0.2926 0.5714 0.6852 0.3230 0.7486 0.5260 0.0764 0.6943 0.7264 0.6369 0.4363 0.6035 0.7280 0.7491 0.1186 0.5501 0.7266 0.6110 0.4278 0.5194 0.1910 0.7439 0.7497 0.3097 0.7332 0.6298 0.7467 0.4381 0.6954 0.7492 0.4293 0.4389 0.7498 0.2274 0.7467 0.3180 0.6562 0.2142 0.1395 0.7497 0.6356 0.2134 0.2113 0.3414 0.5821 0.1746 0.4980 0.0684 0.7443 0.7500 0.6802 0.1547 0.7268 0.6712 0.5802 0.6512 0.1967 0.2488 0.7245 0.6276 0.2290 0.2670 0.6861 0.3379 0.7498 0.7356 0.7391 0.2620 0.1217 0.2301 0.1921 0.3103 0.2676 0.7500 0.2372 0.1951 0.2563 0.5668 0.1401 0.7427 0.4026 0.6642 0.5899 0.7499 0.4813 0.7407 0.4718 0.2988 0.7498 0.7487 0.7318 0.1546 0.2117 0.2532 0.1515 0.4913 0.5510 0.4181 0.4087 0.2242 0.3030 0.0479 0.0285 0.0175 0.1404 0.4268 0.7498 0.7500 0.7408 0.7456 0.4979 0.4659 0.6581 0.4083 0.2784 0.1652 0.2561 0.3179 0.1832
0.8571 0.8190 0.8478 0.8317 0.8546 0.8480 0.8539 0.8139 0.8488 0.6835 0.8570 0.8429 0.7615 0.7890 0.8518 0.8562 0.4528 0.7273 0.8132 0.4883 0.8562 0.6894 0.1419 0.8196 0.8415 0.7782 0.6075 0.7527 0.8426 0.8566 0.2120 0.7097 0.8417 0.7585 0.5993 0.6836 0.3207 0.8531 0.8569 0.4730 0.8460 0.7728 0.8550 0.6093 0.8204 0.8566 0.6007 0.6100 0.8570 0.3705 0.8550 0.4825 0.7924 0.3529 0.2448 0.8569 0.7772 0.3518 0.3488 0.5091 0.7358 0.2973 0.6649 0.1280 0.8534 0.8571 0.8097 0.2680 0.8418 0.8032 0.7344 0.7887 0.3288 0.3985 0.8403 0.7712 0.3727 0.4215 0.8139 0.5051 0.8570 0.8477 0.8500 0.4152 0.2170 0.3741 0.3223 0.4737 0.4222 0.8571 0.3834 0.3265 0.4081 0.7235 0.2457 0.8524 0.5741 0.7982 0.7421 0.8571 0.6498 0.8511 0.6412 0.4601 0.8570 0.8563 0.8451 0.2678 0.3494 0.4040 0.2631 0.6589 0.7105 0.5897 0.5803 0.3663 0.4651 0.0914 0.0554 0.0345 0.2462 0.5982 0.8570 0.8571 0.8511 0.8543 0.6648 0.6356 0.7938 0.5799 0.4355 0.2836 0.4077 0.4825 0.3097
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
6 6 6 16 6 7 7 6 8 6 16 6 6 6 6 6 7 6 6 6 6 6 6 8 6 8 6 6 7 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
12.00000 12.00000 12.00000 31.97207 12.00000 14.00307 14.00307 12.00000 15.99491 12.00000 31.97207 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 15.99491 12.00000 12.00000 14.00307 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
11919.0473 24053.8699 34975.6996
0.99998 -0.00601 0.00147 0.00601 0.99998 0.00055 -0.00148 -0.00054 1.00000
1
0.00727 0.00360 0.00248
0.15142 0.07503 0.05160
14.36 26.22 29.88 43.79 61.63 86.35 87.52 106.02 111.25 126.51 148.45 160.95 172.36 187.43 230.89 258.75 278.79 297.23 310.93 323.25 340.41 369.15 387.02 403.15 426.40 431.28 461.52 463.90 541.45 577.65 590.91 613.88 630.32 691.52 699.32 746.59 775.00 808.74 851.31 857.29 873.64 922.12 934.38 937.31 946.90 966.18 988.67 1025.25 1039.57 1070.49 1071.91 1095.62 1150.20 1188.88 1214.19 1215.14 1243.64 1280.74 1299.44 1324.32 1334.37 1368.64 1435.38 1446.61 1464.82 1491.24 1519.05 1588.51 1608.65 1623.66 1663.75 1691.29 1691.53 1705.60 1725.23 1758.36 1814.29 1827.79 1837.59 1854.94 1861.97 1862.28 1874.25 1877.27 1904.35 1927.59 1940.34 1992.22 2033.61 2044.01 2082.44 2103.17 2110.68 2132.61 2190.59 2256.98 2275.99 2300.05 2314.60 2332.22 2345.92 2348.57 2355.78 2359.10 2375.11 2376.31 2386.84 2387.28 2455.85 2506.41 2515.22 2564.14 2567.94 2576.72 2598.69 2861.42 3744.59 4609.43 4616.25 4621.75 4696.19 4696.94 4704.76 4706.63 4738.23 4771.24 4794.71 4797.67 4866.11 4881.39 4907.91 4923.71 4944.47 4961.54 5551.42
0.380813
0.407266
0.408210
0.318944
-2004.856488
-2004.830036
-2004.829091
-2004.918358
2.994030D-04
MUNgauss
RevisionA2.1
retrievium
18-Feb-2021
DUDE Cc1csc(n1)NC(=O)CSc2c(ccc(n2)c3ccc(c(c3)OC)OC)C#N C08783544
RHF
6-31G(d)
(6D,10F)
C1
426.082034
|X|Y|Z|
78.651208 112.438562 20.838944
56.906970
21
|36.858105|
|12.718618|36.858105|
|7.502363|14.228692|36.858105|
|4.745082|7.493255|10.962231|388.023441|
|5.324964|8.692110|7.933868|78.166283|36.858105|
|7.701463|13.768347|8.305303|52.865529|14.930795|53.358707|
|3.995572|5.442780|5.046923|49.004820|13.757636|11.277576|53.358707|
|3.167014|4.097923|4.117786|42.328405|7.750706|7.228637|18.990584|36.858105|
|2.993014|3.888024|4.195785|47.101011|6.702116|6.314169|11.533091|15.974220|73.516695|
|2.661827|3.226660|3.145993|28.776061|5.082895|5.536537|10.777017|12.561056|14.128701|36.858105|
|2.184988|2.585773|2.617424|23.733665|3.679916|4.138130|6.523920|6.997916|11.736019|10.527907|388.023441|
|1.929179|2.206092|2.180795|18.625553|2.943110|3.502099|5.046401|4.630224|7.428207|6.955188|76.440172|36.858105|
|1.698434|1.915668|1.911611|16.064794|2.452751|2.964995|4.011387|3.556275|6.024137|4.669957|49.474157|13.587390|36.858105|
|1.563316|1.733990|1.713896|14.043426|2.155035|2.665928|3.461523|2.931437|4.914914|3.732370|33.718200|7.981056|13.742910|36.858105|
|1.594107|1.753580|1.707715|13.797382|2.165849|2.718315|3.497638|2.877979|4.687457|3.717828|30.119854|6.989803|7.963621|13.823026|36.858105|
|1.784032|1.974404|1.899377|15.406502|2.493090|3.123868|4.143394|3.392277|5.311867|4.646419|34.511490|8.297543|6.976623|8.007653|13.696765|36.858105|
|1.982078|2.240914|2.165045|18.051301|2.961909|3.609486|5.136301|4.417298|6.712921|6.808465|50.688090|14.509152|8.023768|6.941601|8.019334|14.307709|53.358707|
|1.797295|1.956423|1.849248|14.630939|2.409658|3.102712|3.949477|3.067255|4.741793|4.007036|26.791909|5.253156|4.520653|5.070559|7.587047|12.831967|10.801787|36.858105|
|1.644401|1.762736|1.665381|12.953438|2.103965|2.751360|3.351109|2.557926|4.034525|3.171197|21.631006|4.017150|3.738884|4.377059|6.346502|7.629029|7.175263|13.840164|36.858105|
|1.620465|1.710689|1.600779|12.219343|1.991315|2.655350|3.114806|2.313039|3.653380|2.768745|18.330932|3.183612|2.953636|3.321425|4.355514|5.042348|5.439147|7.914911|13.661541|36.858105|
|1.735466|1.821260|1.684736|12.744460|2.107204|2.845046|3.290478|2.391595|3.737395|2.832698|18.025187|3.016376|2.717633|2.935932|3.693739|4.448990|5.167997|6.809848|7.911592|13.839975|36.858105|
|1.924973|2.045217|1.882445|14.385241|2.425679|3.253802|3.872182|2.806006|4.296123|3.401248|20.782754|3.459476|2.983676|3.123655|3.901412|5.056637|6.166574|7.877067|6.860970|7.920380|13.486285|36.858105|
|1.964844|2.134427|1.988081|15.603959|2.634508|3.432588|4.348735|3.271191|4.944121|4.230123|25.916656|4.595096|3.784632|3.937023|5.121763|7.624906|9.090284|13.568154|7.961505|6.897518|7.913113|13.881040|36.858105|
|2.039984|2.141050|1.945697|14.614358|2.485452|3.404192|3.894952|2.737813|4.193525|3.186920|18.992735|2.988918|2.581232|2.633455|3.128814|3.881827|5.067288|5.177515|4.625212|5.299551|8.169628|14.165024|7.907062|73.516695|
|2.264341|2.402525|2.171088|16.379929|2.832413|3.874134|4.471756|3.097610|4.687167|3.562742|20.446057|3.091273|2.611661|2.581744|2.972397|3.698740|5.149271|4.507871|3.801007|3.991038|5.246225|8.035648|6.748800|24.233720|36.858105|
|1.682424|1.736618|1.598017|11.877240|1.952624|2.680676|2.980888|2.130658|3.361680|2.441340|15.511796|2.502316|2.283044|2.435393|2.938595|3.390541|4.111955|4.607120|5.196277|7.902951|14.214643|8.169839|5.302455|13.160928|4.800427|73.516695|
|1.525145|1.563391|1.447539|10.699732|1.731584|2.379837|2.608036|1.873021|2.996667|2.117010|13.768263|2.212750|2.068278|2.230110|2.655570|2.933944|3.539388|3.787042|4.515085|6.741612|8.041050|5.243791|3.990321|8.529898|3.552153|24.200722|36.858105|
|1.623210|1.835691|1.864602|15.787834|2.324750|2.791868|3.704051|3.312973|5.922358|4.020174|44.513033|7.654160|13.240079|7.790078|5.138035|4.569098|7.019802|3.370232|2.926820|2.419258|2.255111|2.444228|2.961508|3.873568|2.226402|3.462529|1.789509|36.858105|
|1.552016|1.752973|1.801270|15.241548|2.186954|2.627899|3.405583|3.022349|5.582972|3.467564|36.559713|5.383055|7.397957|5.488896|3.977104|3.590571|5.411834|2.806087|2.497140|2.116615|1.987727|2.136338|2.522501|3.441513|1.984905|3.102200|1.617420|16.763400|53.358707|
|17.557444|8.927146|5.886058|29.626144|4.843646|9.367873|5.198029|3.036627|5.036385|2.608364|15.148814|1.904881|1.674957|1.550975|1.592652|1.788906|2.690702|1.820665|1.664372|1.652597|1.789222|1.995554|2.015796|3.821446|2.414929|3.104890|1.574998|1.590281|2.061738|0.500000|
|17.558107|8.928140|5.886520|29.631410|4.844475|9.368289|5.198868|3.035941|5.036090|2.604908|15.204921|1.911163|1.684992|1.558957|1.596758|1.788536|2.689111|1.813202|1.671286|1.654070|1.768891|1.946249|1.974428|3.652512|2.246124|3.058259|1.565466|1.603710|2.082081|0.302275|0.500000|
|17.589441|8.896915|7.072532|30.911267|4.396736|7.668261|4.613084|2.805661|4.842653|2.373457|14.247668|1.771051|1.577688|1.454880|1.474822|1.632906|2.454361|1.637046|1.507069|1.484559|1.580075|1.737363|1.773133|3.257749|2.018018|2.731238|1.404093|1.522290|1.996363|0.300472|0.300470|0.500000|
|6.516172|8.777083|17.802972|54.940886|5.517727|7.796898|5.389166|3.419051|6.340088|2.707147|16.601337|1.967885|1.752009|1.579703|1.567626|1.723627|2.644528|1.677398|1.523868|1.468727|1.539627|1.703839|1.790030|3.127501|1.946246|2.610437|1.340353|1.725540|2.289289|0.144350|0.144358|0.199288|0.500000|
|3.951556|5.046549|4.382402|37.409006|9.524172|10.738459|26.008916|9.271265|10.825551|7.568910|31.662936|3.712760|2.926878|2.577111|2.669852|3.236391|5.412658|3.181009|2.683066|2.516629|2.700573|3.230703|3.601916|5.830018|3.797906|4.337087|2.106252|2.634827|3.257802|0.107695|0.107811|0.091480|0.097738|0.500000|
|2.658132|3.162577|3.008409|26.351955|4.789347|5.475470|9.861554|8.871319|10.798531|17.621977|56.316432|6.648358|4.537439|3.763383|3.872479|4.990629|9.812709|4.413086|3.497818|3.038007|3.087572|3.684632|4.596398|6.006507|3.656503|4.680655|2.278112|3.799957|4.434858|0.072086|0.073882|0.065399|0.072021|0.216891|0.500000|
|2.622293|3.126226|3.000114|26.480648|4.723091|5.360820|9.541810|8.940434|11.147016|17.607759|56.251150|6.473578|4.422044|3.675833|3.787714|4.879766|9.597001|4.351301|3.339178|2.938243|3.080712|3.850883|4.894372|6.503697|4.273725|4.690560|2.245350|3.719883|4.357394|0.072979|0.070690|0.064781|0.072012|0.201220|0.303324|0.500000|
|1.442086|1.589229|1.578770|12.833690|1.938524|2.412881|3.052628|2.556737|4.368263|3.121589|27.824122|5.659943|8.938937|17.731977|8.917455|5.664514|6.790297|4.104365|3.776601|2.971386|2.618209|2.721408|3.289558|4.146130|2.277746|3.942080|2.068692|7.186810|7.548854|0.039706|0.039949|0.037521|0.040742|0.062746|0.086978|0.085210|0.500000|
|1.486091|1.616546|1.570229|12.502779|1.952839|2.483565|3.097649|2.494307|4.090881|3.107346|24.328785|5.018301|5.657047|8.932785|17.779757|8.865508|7.756013|6.943911|6.884441|4.698004|3.799944|3.808624|4.715987|5.403057|2.812929|5.392742|2.800988|4.163623|4.633202|0.041370|0.041449|0.038325|0.040266|0.065925|0.090117|0.088564|0.214184|0.500000|
|1.543562|1.654566|1.576226|12.281557|1.964286|2.557891|3.101041|2.392674|3.833664|2.932326|20.820502|3.904266|3.838739|4.725107|6.918718|6.991336|6.573210|8.918232|17.738179|8.951066|5.657882|4.947958|5.640658|6.523566|3.138294|7.471789|3.927571|3.022894|3.513463|0.043132|0.043626|0.039534|0.040277|0.067951|0.089426|0.083684|0.116202|0.231290|0.500000|
|1.508878|1.580758|1.483376|11.238193|1.810313|2.426006|2.789762|2.066790|3.304986|2.422911|16.292502|2.779269|2.646118|2.992927|3.797195|4.117840|4.556513|5.657556|8.941207|17.768018|8.942513|5.628217|4.968940|7.593907|3.329139|12.567918|7.502405|2.216306|2.672420|0.042658|0.042919|0.038614|0.038038|0.062062|0.073468|0.070401|0.076415|0.116902|0.218113|0.500000|
|2.115711|2.333878|2.176083|17.341871|2.968461|3.808078|5.031636|3.824552|5.658960|5.123265|29.763145|5.102013|3.975626|3.916059|4.800145|7.129788|10.176754|8.934669|5.680643|4.971456|5.629486|8.964143|17.801626|12.589834|7.518091|7.602222|3.330316|3.120597|3.609949|0.060439|0.058450|0.052771|0.053986|0.116278|0.148891|0.178488|0.090094|0.117628|0.124408|0.107911|0.500000|
|2.295280|2.386658|2.139393|15.774535|2.705196|3.788625|4.125490|2.803120|4.310016|3.089567|17.968163|2.649625|2.282895|2.254109|2.546374|3.058153|4.256983|3.613443|3.190697|3.417111|4.411952|5.894040|4.917160|17.025913|17.651100|7.786264|3.349161|1.988073|2.444943|0.069104|0.063085|0.056898|0.053565|0.096363|0.087358|0.100415|0.056100|0.067680|0.075165|0.082075|0.146680|0.500000|
|2.544152|2.743031|2.446466|18.622817|3.345683|4.570357|5.446406|3.670507|5.374843|4.252164|22.899354|3.372950|2.765234|2.669222|3.036824|3.865429|5.659254|4.562500|3.740107|3.787270|4.737044|7.033918|6.736394|16.444245|17.548730|7.510466|3.234061|2.352134|2.845300|0.075145|0.070209|0.062052|0.060017|0.134070|0.123022|0.144319|0.064760|0.078093|0.086627|0.087969|0.226298|0.300078|0.500000|
|2.135985|2.291667|2.109081|16.157230|2.735644|3.658477|4.335912|3.104989|4.757110|3.618818|21.356101|3.262038|2.763322|2.732033|3.137266|3.881612|5.404278|4.587158|3.761194|3.807464|4.762580|7.066686|6.754976|16.443531|17.556060|7.540714|3.247112|2.347603|2.839381|0.062981|0.058211|0.053379|0.052760|0.099333|0.099668|0.123874|0.066812|0.082126|0.086961|0.088343|0.225367|0.299851|0.298871|0.500000|
|1.427265|1.469082|1.371594|10.192278|1.632215|2.225337|2.458177|1.787163|2.881715|2.026346|13.443664|2.184986|2.075655|2.274166|2.721660|2.930485|3.469330|3.740907|4.584391|6.744889|7.060406|4.752513|3.798496|7.529491|3.245489|16.441222|17.559012|1.796983|2.211576|0.040847|0.040497|0.036680|0.035398|0.054594|0.060009|0.059691|0.059146|0.081577|0.113559|0.225075|0.088216|0.084539|0.081727|0.085328|0.500000|
|1.528632|1.566557|1.450001|10.714610|1.734537|2.384825|2.612028|1.874690|2.998879|2.117017|13.791336|2.216615|2.076704|2.239452|2.659247|2.926162|3.533307|3.734913|4.575195|6.734680|7.049086|4.746801|3.795771|7.518933|3.237038|16.440314|17.559380|1.798920|2.214095|0.043574|0.043874|0.039086|0.037292|0.058625|0.064062|0.061498|0.057769|0.077814|0.113586|0.225690|0.088170|0.084297|0.084745|0.081851|0.298790|0.500000|
|1.500633|1.523304|1.406451|10.291276|1.660190|2.302075|2.470787|1.759221|2.826728|1.957002|12.678674|1.998618|1.868795|1.991446|2.323327|2.551571|3.149651|3.181371|3.619131|4.914124|5.900385|4.411215|3.417708|7.786797|3.350318|17.021436|17.653213|1.637794|2.030990|0.043256|0.042813|0.038461|0.036293|0.055325|0.058079|0.057658|0.051620|0.067438|0.089300|0.146463|0.082129|0.091024|0.084284|0.084569|0.299902|0.299937|0.500000|
2003.316111
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