Version2.0
2020-02-05T06:57:01Z
10.1021/jm300687e
Gaussian16
RevisionB.01
CFLINN
03-Oct-2019
#N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2)
DUDE Cc1ccc(cc1)N2C(=O)C[C@H](C2=O)NNc3nc(nc(n3)Nc4ccccc4)Nc5ccccc5 C30295686
RHF
6-31G(d)
(6D,7F)
Cc1ccc(cc1)N2C(=O)C[C@H](C2=O)NNc3nc(nc(n3)Nc4ccccc4)Nc5ccccc5
C01[X(C26H24N8O2)]
174
C1
588
Cc1ccc(cc1)N1C(=O)C[C@H](C1=O)NNc1nc(Nc2ccccc2)nc(n1)Nc1ccccc1
Cc1ccc(cc1)N1C(=O)C[C@H](C1=O)NNc1nc(Nc2ccccc2)nc(n1)Nc1ccccc1
Cc1ccc(cc1)N2C(=O)C[C@@H](NNc3nc(Nc4ccccc4)nc(Nc5ccccc5)n3)C2=O
InChIKey=YPMPTJCCZTZQLQ-OAQYLSRUSA-N
InChI=1S/C26H24N8O2/c1-17-12-14-20(15-13-17)34-22(35)16-21(23(34)36)32-33-26-30-24(27-18-8-4-2-5-9-18)29-25(31-26)28-19-10-6-3-7-11-19/h2-15,21,32H,16H2,1H3,(H3,27,28,29,30,31,33)/t21-/m1/s1
InChI=1/C26H24N8O2/c1-17-12-14-20(15-13-17)34-22(35)16-21(23(34)36)32-33-26-30-24(27-18-8-4-2-5-9-18)29-25(31-26)28-19-10-6-3-7-11-19/h2-15,21,32H,16H2,1H3,(H3,27,28,29,30,31,33)/t21-/m1/s1/f/h27-28,33H
Cc1ccc(cc1)N2C(=O)C[C@H](C2=O)NNc3nc(nc(n3)Nc4ccccc4)Nc5ccccc5
C01[X(C26H24N8O2)]
174
C01
588
Cc1ccc(cc1)N1C(=O)C[C@H](C1=O)NNc1nc(Nc2ccccc2)nc(n1)Nc1ccccc1
Cc1ccc(cc1)N1C(=O)C[C@H](C1=O)NNc1nc(Nc2ccccc2)nc(n1)Nc1ccccc1
Cc1ccc(cc1)N2C(=O)C[C@@H](NNc3nc(Nc4ccccc4)nc(Nc5ccccc5)n3)C2=O
InChIKey=YPMPTJCCZTZQLQ-OAQYLSRUSA-N
InChI=1S/C26H24N8O2/c1-17-12-14-20(15-13-17)34-22(35)16-21(23(34)36)32-33-26-30-24(27-18-8-4-2-5-9-18)29-25(31-26)28-19-10-6-3-7-11-19/h2-15,21,32H,16H2,1H3,(H3,27,28,29,30,31,33)/t21-/m1/s1
InChI=1/C26H24N8O2/c1-17-12-14-20(15-13-17)34-22(35)16-21(23(34)36)32-33-26-30-24(27-18-8-4-2-5-9-18)29-25(31-26)28-19-10-6-3-7-11-19/h2-15,21,32H,16H2,1H3,(H3,27,28,29,30,31,33)/t21-/m1/s1/f/h27-28,33H
3545.9925483753
-1583.9493972
1-A
23570.4790
126
462
588
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11.43495
-0.3729 0.4940 -1.0562
1.2242
|XX|YY|ZZ|XY|XZ|YZ|
-180.9902 -188.4585 -216.7265 -0.5378 -6.9022 10.5001
|XX|YY|ZZ|XY|XZ|YZ|
14.4015 6.9332 -21.3348 -0.5378 -6.9022 10.5001
|XXX|YYY|ZZZ|XYY|XXY|XXZ|XZZ|YZZ|YYZ|XYZ|
80.4938 36.1419 -30.5055 -31.6047 23.7616 88.2652 -37.0963 -14.5304 -41.9003 35.5772
|XXXX|YYYY|ZZZZ|XXXY|XXXZ|YYYZ|ZZZX|ZZZY|XXYY|XXZZ|YYZZ|XXYZ|YYXZ|ZZXY|
-17053.7620 -11165.1685 -1072.2374 -126.3078 -149.2987 -63.4974 41.8209 -22.3752 50.1029 -4747.7941 -3526.6603 -2424.5442 -67.9288 -134.0655 44.3776
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9.6925 12.5463 14.1740 15.5234 22.2880 26.2002 31.4521 41.3471 50.6857 58.7305 66.1441 72.6698 92.4596 111.9226 142.9907 157.4909 181.2104 196.3788 198.4996 206.8852 213.2779 246.6887 265.0774 279.8202 289.6497 327.8976 335.4111 349.7448 366.3337 384.5116 427.9900 445.9931 457.3460 457.7447 459.3370 476.2339 506.2328 559.5105 566.3368 569.1293 596.2816 611.1399 613.2168 614.1032 645.6543 649.5117 653.7144 662.7641 670.6918 677.6847 682.0164 684.4876 706.8677 725.6361 742.8443 769.9988 770.1931 786.8558 796.8401 816.2559 828.2923 835.8652 851.1263 856.5255 861.3595 892.4143 911.3202 925.3847 932.8457 935.8876 941.1660 943.8407 945.7479 965.9388 971.8040 1024.6392 1028.6151 1050.6433 1074.5831 1086.3900 1088.4746 1091.3253 1091.9963 1094.4647 1095.0436 1098.2861 1103.5134 1119.0642 1121.1019 1124.6278 1132.1522 1135.2360 1155.7720 1173.3421 1179.0267 1190.3848 1196.8600 1198.7585 1211.0143 1212.5835 1216.3926 1247.1414 1285.6308 1299.8568 1304.4382 1307.4928 1308.8934 1318.8758 1319.0469 1323.0412 1329.7751 1345.4101 1361.0263 1374.6897 1383.5858 1408.7270 1421.0233 1439.9579 1458.6762 1465.5667 1480.5514 1504.9676 1537.7367 1560.5545 1565.9342 1567.8843 1574.2163 1584.0729 1605.6055 1611.5332 1619.8586 1635.6367 1637.8470 1642.4025 1673.0906 1674.0524 1698.7644 1707.9879 1726.3856 1757.5377 1780.3844 1787.9503 1790.6051 1801.2276 1809.7740 1817.4147 1823.4558 1838.2757 1988.6484 2061.6939 3203.6818 3238.6597 3260.6765 3267.5188 3282.9754 3320.6397 3346.6831 3350.7588 3358.5530 3361.4290 3362.4630 3363.0466 3371.0634 3373.1389 3387.8801 3388.6884 3400.8709 3402.9359 3449.9840 3458.9990 3781.3625 3828.6337 3871.0308 3872.1591
5.5812 3.3250 1.1792 3.9236 5.1638 4.9437 4.1024 5.4002 6.3968 5.9615 6.4992 5.2614 4.5205 5.7000 7.6899 5.5203 5.0796 7.5637 5.0676 7.0816 6.6908 5.4225 4.6250 7.2336 5.5400 5.0412 3.6086 4.8084 4.1450 3.9722 6.6039 3.9161 3.0005 3.0278 2.9622 8.1868 5.7660 2.9436 2.9222 2.9304 2.7897 2.8643 3.1145 1.6283 1.1692 2.1809 6.5201 4.8459 4.7400 6.1096 4.2448 4.6427 6.2433 5.0441 3.4361 2.1555 2.3261 3.1421 5.4062 3.9129 7.7355 4.9272 1.6212 2.0457 4.1154 2.6046 2.7835 1.6836 4.4250 4.3631 1.2568 1.4865 1.2875 2.8889 5.5372 1.4670 1.4205 3.6533 1.4148 6.2834 6.2199 7.8865 1.4368 1.4602 1.3561 1.3393 3.4087 1.3126 2.8089 1.3099 2.3642 2.1905 3.3673 1.5473 2.9256 1.9753 1.8324 1.9051 2.9038 2.4773 2.3876 2.5952 2.1937 2.5449 1.1460 1.2403 1.1543 1.9840 1.9105 1.6114 2.2179 3.9919 3.4865 3.1640 3.3633 3.8264 1.4774 1.5401 1.6132 1.3266 1.3835 1.7274 2.0838 3.6046 2.0808 1.4518 2.4915 3.2676 2.0992 1.1765 2.3021 1.0501 1.1009 1.7046 2.1624 2.1594 2.6150 2.1570 2.7928 3.3006 6.0681 5.8489 4.5745 3.7904 4.7129 4.6739 5.5954 3.2756 12.6020 12.5958 1.0399 1.0857 1.0984 1.0636 1.1039 1.1046 1.0886 1.0883 1.0892 1.0896 1.0911 1.0906 1.0941 1.0943 1.0985 1.0985 1.0951 1.0951 1.0934 1.0936 1.0764 1.0781 1.0772 1.0772
0.0003 0.0003 0.0001 0.0006 0.0015 0.0020 0.0024 0.0054 0.0097 0.0121 0.0168 0.0164 0.0228 0.0421 0.0926 0.0807 0.0983 0.1719 0.1176 0.1786 0.1793 0.1944 0.1915 0.3337 0.2738 0.3193 0.2392 0.3465 0.3277 0.3460 0.7127 0.4589 0.3698 0.3738 0.3682 1.0940 0.8706 0.5429 0.5522 0.5592 0.5844 0.6303 0.6900 0.3618 0.2872 0.5421 1.6417 1.2541 1.2562 1.6532 1.1633 1.2816 1.8380 1.5648 1.1172 0.7530 0.8130 1.1462 2.0225 1.5361 3.1268 2.0282 0.6920 0.8842 1.7990 1.2222 1.3620 0.8494 2.2687 2.2516 0.6559 0.7802 0.6785 1.5881 3.0810 0.9074 0.8855 2.3760 0.9626 4.3693 4.3418 5.5340 1.0094 1.0306 0.9581 0.9519 2.4457 0.9685 2.0801 0.9761 1.7854 1.6633 2.6502 1.2550 2.3962 1.6492 1.5465 1.6130 2.5091 2.1461 2.0814 2.3782 2.1363 2.5334 1.1489 1.2492 1.1651 2.0333 1.9585 1.6619 2.3108 4.2574 3.8052 3.5229 3.7934 4.4740 1.7577 1.8814 2.0224 1.6788 1.7868 2.3051 2.9031 5.1721 3.0063 2.1027 3.6378 4.8309 3.1885 1.8003 3.5590 1.6553 1.7400 2.7091 3.5663 3.5655 4.4461 3.7074 4.9041 6.0069 11.3326 11.0163 8.6417 7.2455 9.0947 9.0958 10.9616 6.5217 29.3634 31.5447 6.2883 6.7092 6.8807 6.6907 7.0097 7.1762 7.1839 7.1990 7.2391 7.2538 7.2682 7.2675 7.3253 7.3359 7.4285 7.4319 7.4624 7.4717 7.6679 7.7092 9.0683 9.3108 9.5101 9.5159
0.0324 0.0517 0.1771 0.4559 0.2295 0.1310 0.1792 0.8041 0.6987 0.5917 0.2024 0.5913 3.4834 4.5316 5.0804 0.8682 1.1576 1.4980 1.4323 3.5904 1.7300 6.2359 2.4440 11.2744 2.8558 6.0390 1.2739 0.2041 22.7388 2.0152 6.3023 2.4224 0.4540 1.1702 1.1068 26.4999 4.5793 2.0310 4.5438 28.2162 44.7234 5.8315 22.7082 52.1452 128.3030 127.5740 12.7101 8.2205 43.1403 0.5572 17.4377 5.3753 3.3949 19.4554 41.3834 13.4546 29.0955 8.5237 16.6296 2.8689 6.5275 12.9247 106.9986 9.0405 8.1669 2.1054 81.1933 50.2613 38.7117 110.8430 0.1272 2.0837 1.1557 55.3699 41.2864 8.3545 20.3584 10.7311 4.7515 1.7906 0.2290 0.4732 0.2319 0.5843 0.2900 0.3485 4.9240 1.3453 3.9747 3.9522 5.2030 0.4393 3.6430 12.1660 27.3337 4.9386 23.4635 1.2401 3.5156 1.7796 2.0246 9.6028 2.8242 27.9512 4.1108 6.9549 8.0271 43.7094 24.4093 4.1149 1.3777 170.8265 44.5391 130.7669 19.6467 146.5913 1.8657 40.4854 2.5117 1.9055 54.2324 113.0514 271.0676 190.8475 513.6672 127.5501 11.9027 1719.3202 212.6378 37.1018 185.3814 4.6701 7.2583 248.3712 63.3147 3.0808 150.6343 625.1975 639.0448 304.8413 0.2965 254.5026 369.9498 853.6197 22.1521 240.6255 3.1190 254.5864 731.9655 48.7174 40.9200 16.2708 29.0209 3.3177 22.6768 5.4905 13.9588 10.8584 2.1434 1.6044 17.4088 20.9735 38.7502 38.2726 38.9200 30.7028 10.0895 5.7952 1.1583 5.2440 7.7145 49.3898 0.8833 112.0277
3.5496 2.4170 0.3875 8.3821 1.3723 5.0746 5.0046 4.6048 0.7367 4.5847 1.8925 1.1340 0.7712 1.9128 0.0307 0.4600 0.7839 3.4639 1.1405 1.2352 0.7150 2.5513 5.4021 1.9569 0.3707 0.4895 0.1915 0.8418 0.5400 2.4138 1.7445 0.7501 1.2180 0.1123 0.3572 3.9371 2.8813 1.1150 1.0525 0.8336 2.0928 3.6110 1.6706 5.2698 1.5625 1.9899 4.2883 3.9875 4.3995 3.0331 5.4969 4.9579 4.1250 4.9556 0.9540 1.3811 1.3486 0.8068 3.0859 1.9074 0.2670 0.9450 0.2362 3.2372 30.2674 4.4370 3.8579 0.4960 5.9134 3.9661 2.9714 4.3843 2.1275 3.7029 2.6446 2.9954 1.8388 2.6949 3.1831 28.4203 11.8518 93.3476 0.6113 1.6818 0.7386 0.2907 17.7253 1.0760 0.0961 1.5668 1.7905 25.5839 1.5360 0.9381 3.5374 1.0774 2.0572 0.6336 10.0383 12.1006 19.3500 8.0350 27.4227 2.1597 7.2425 1.5342 8.1524 5.1265 7.1210 4.1052 3.8587 3.1553 2.6282 24.4205 132.6857 7.7964 2.1832 6.3191 0.9569 1.4746 5.4417 1.8816 5.9476 12.7351 23.4409 6.1488 1.0504 34.7089 13.3386 5.9987 5.0570 20.5551 15.2058 8.2021 0.7344 16.0642 3.4938 0.7461 9.5497 8.3935 4.8923 6.8309 3.3121 25.6289 201.1925 12.2318 81.3171 173.0717 1.9626 21.0422 187.2279 88.3318 95.2362 101.5152 67.5865 70.7855 37.0032 34.7934 97.0195 107.5962 85.1311 75.3422 87.9727 81.3828 242.5159 293.0121 51.9181 121.4767 79.4937 75.3543 92.9292 39.7512 3.6086 138.8152
0.7461 0.7355 0.7351 0.7158 0.7401 0.7386 0.7365 0.7416 0.7465 0.7333 0.6529 0.7357 0.5841 0.7483 0.4798 0.7079 0.6682 0.6796 0.6968 0.7279 0.3508 0.3161 0.7341 0.2264 0.6988 0.3833 0.6761 0.6356 0.7457 0.7456 0.6430 0.6837 0.4423 0.7200 0.6174 0.4815 0.1127 0.7470 0.7282 0.6500 0.6881 0.2420 0.5992 0.4873 0.6386 0.4555 0.7467 0.0800 0.2164 0.7297 0.7497 0.7142 0.6166 0.0338 0.6229 0.7097 0.7284 0.5940 0.6164 0.7128 0.2287 0.3342 0.7044 0.2586 0.0929 0.1662 0.5875 0.7171 0.2049 0.3701 0.7336 0.2921 0.5914 0.6458 0.3995 0.6421 0.6515 0.4819 0.7455 0.1624 0.1986 0.1484 0.7161 0.4028 0.2999 0.6484 0.1149 0.5908 0.2453 0.5316 0.4545 0.1062 0.6355 0.4202 0.7326 0.5411 0.5240 0.5434 0.6112 0.5672 0.6955 0.4658 0.1687 0.2415 0.2771 0.3135 0.2396 0.1314 0.1695 0.5625 0.6685 0.5563 0.6724 0.2130 0.1930 0.4492 0.4917 0.6404 0.2159 0.7493 0.7500 0.7492 0.6243 0.3259 0.4846 0.5658 0.4924 0.7495 0.7460 0.6192 0.7144 0.7375 0.7448 0.7450 0.5910 0.2457 0.3553 0.4323 0.4414 0.6814 0.7410 0.7357 0.7154 0.7291 0.4634 0.5491 0.4863 0.4534 0.4755 0.4179 0.0601 0.2811 0.7338 0.0925 0.7482 0.6293 0.5952 0.6511 0.5998 0.6238 0.7490 0.1475 0.6964 0.6909 0.1360 0.1236 0.2660 0.1822 0.2287 0.2319 0.2628 0.1336 0.4419 0.1220
0.8546 0.8476 0.8474 0.8344 0.8506 0.8497 0.8483 0.8517 0.8548 0.8462 0.7900 0.8477 0.7375 0.8561 0.6484 0.8290 0.8011 0.8092 0.8213 0.8425 0.5193 0.4803 0.8467 0.3692 0.8227 0.5541 0.8067 0.7772 0.8543 0.8542 0.7827 0.8121 0.6134 0.8372 0.7634 0.6500 0.2025 0.8551 0.8427 0.7879 0.8153 0.3896 0.7494 0.6553 0.7795 0.6259 0.8550 0.1482 0.3558 0.8437 0.8569 0.8333 0.7628 0.0654 0.7676 0.8302 0.8429 0.7453 0.7627 0.8323 0.3722 0.5010 0.8266 0.4110 0.1701 0.2850 0.7402 0.8353 0.3401 0.5403 0.8463 0.4522 0.7433 0.7848 0.5709 0.7821 0.7890 0.6504 0.8542 0.2793 0.3314 0.2584 0.8346 0.5743 0.4614 0.7867 0.2061 0.7428 0.3940 0.6942 0.6250 0.1920 0.7771 0.5918 0.8456 0.7022 0.6876 0.7041 0.7587 0.7238 0.8204 0.6356 0.2886 0.3890 0.4340 0.4774 0.3866 0.2323 0.2898 0.7200 0.8013 0.7149 0.8041 0.3511 0.3236 0.6200 0.6593 0.7808 0.3551 0.8567 0.8571 0.8566 0.7687 0.4916 0.6528 0.7227 0.6599 0.8568 0.8545 0.7648 0.8334 0.8489 0.8537 0.8539 0.7429 0.3945 0.5243 0.6036 0.6125 0.8105 0.8512 0.8477 0.8341 0.8434 0.6333 0.7089 0.6544 0.6239 0.6445 0.5895 0.1134 0.4389 0.8464 0.1694 0.8560 0.7725 0.7462 0.7887 0.7499 0.7684 0.8565 0.2571 0.8210 0.8172 0.2395 0.2200 0.4203 0.3083 0.3722 0.3764 0.4162 0.2356 0.6130 0.2175
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 51 52 53 54 55 56 57 58 59 60
6 6 6 6 6 6 6 7 6 8 6 6 1 6 8 7 7 6 7 6 7 6 7 7 6 6 6 6 6 6 7 6 6 6 6 6 6 1 1 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 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 12.00000 12.00000 1.00783 12.00000 15.99491 14.00307 14.00307 12.00000 14.00307 12.00000 14.00307 12.00000 14.00307 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 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 1.00783 1.00783 1.00783
17529.1924 26663.9817 41658.6345
0.99988 0.01575 0.00142 -0.01575 0.99988 0.00115 -0.00140 -0.00117 1.00000
1
0.00494 0.00325 0.00208
0.10296 0.06768 0.04332
13.95 18.05 20.39 22.33 32.07 37.70 45.25 59.49 72.93 84.50 95.17 104.56 133.03 161.03 205.73 226.59 260.72 282.55 285.60 297.66 306.86 354.93 381.39 402.60 416.74 471.77 482.58 503.20 527.07 553.23 615.78 641.68 658.02 658.59 660.88 685.19 728.36 805.01 814.83 818.85 857.92 879.29 882.28 883.56 928.95 934.50 940.55 953.57 964.98 975.04 981.27 984.82 1017.02 1044.03 1068.79 1107.86 1108.14 1132.11 1146.48 1174.41 1191.73 1202.62 1224.58 1232.35 1239.30 1283.99 1311.19 1331.42 1342.16 1346.53 1354.13 1357.98 1360.72 1389.77 1398.21 1474.23 1479.95 1511.64 1546.09 1563.07 1566.07 1570.17 1571.14 1574.69 1575.52 1580.19 1587.71 1610.08 1613.02 1618.09 1628.91 1633.35 1662.90 1688.18 1696.36 1712.70 1722.01 1724.75 1742.38 1744.64 1750.12 1794.36 1849.74 1870.20 1876.80 1881.19 1883.21 1897.57 1897.81 1903.56 1913.25 1935.74 1958.21 1977.87 1990.67 2026.84 2044.54 2071.78 2098.71 2108.62 2130.18 2165.31 2212.46 2245.29 2253.03 2255.84 2264.95 2279.13 2310.11 2318.64 2330.62 2353.32 2356.50 2363.05 2407.20 2408.59 2444.14 2457.41 2483.88 2528.70 2561.58 2572.46 2576.28 2591.56 2603.86 2614.85 2623.55 2644.87 2861.22 2966.32 4609.38 4659.71 4691.39 4701.23 4723.47 4777.66 4815.13 4820.99 4832.21 4836.35 4837.83 4838.67 4850.21 4853.19 4874.40 4875.57 4893.09 4896.07 4963.76 4976.73 5440.54 5508.55 5569.55 5571.17
0.513355
0.542115
0.543060
0.445002
-1583.436042
-1583.407282
-1583.406337
-1583.504395
3.288881D-04
MUNgauss
RevisionA2.0
retrievium
05-Feb-2020
DUDE Cc1ccc(cc1)N2C(=O)C[C@H](C2=O)NNc3nc(nc(n3)Nc4ccccc4)Nc5ccccc5 C30295686
RHF
6-31G(d)
(6D,10F)
C1
480.202222
|X|Y|Z|
117.557688 94.345267 29.148764
68.632597
33
|36.858105|
|12.609648|36.858105|
|7.547527|13.707417|36.858105|
|5.011097|7.886491|13.772875|36.858105|
|4.430358|6.829654|7.960284|13.767940|36.858105|
|5.010359|7.886073|6.898102|7.950018|13.771146|36.858105|
|7.547380|13.711832|7.991009|6.898541|7.960355|13.768198|36.858105|
|3.324588|4.514769|5.146530|7.821295|13.320002|7.813687|5.143970|53.358707|
|2.883267|3.718547|4.301856|6.110138|7.652720|5.370977|4.017687|18.575781|36.858105|
|2.940182|3.747342|4.452220|6.137498|6.637351|4.833834|3.870588|11.329204|16.073083|73.516695|
|2.383448|2.936010|3.258873|4.232015|5.101124|4.102791|3.198061|11.012071|12.588897|13.982613|36.858105|
|2.382906|2.933270|3.194604|4.097955|5.097322|4.229103|3.255852|11.017640|7.929720|9.535363|12.489217|36.858105|
|2.280528|2.770155|3.072727|3.909798|4.539220|3.722887|2.981005|8.931791|6.447917|8.447838|8.831721|17.548105|0.500000|
|2.888598|3.722233|4.016261|5.367733|7.687063|6.145700|4.313299|18.818139|8.255992|9.857293|7.937668|12.479070|0.250735|36.858105|
|2.929495|3.719712|3.827978|4.769885|6.581763|6.135947|4.435714|11.298500|5.523790|7.480120|5.378218|7.875231|0.186713|16.002395|73.516695|
|2.110430|2.523420|2.650371|3.211347|3.915465|3.558690|2.835249|7.296266|5.240911|7.115244|7.606913|13.219966|0.259581|7.647114|11.596168|53.358707|
|2.146853|2.560490|2.608314|3.092894|3.877278|3.750648|2.965611|6.884682|4.844581|6.785568|6.280518|8.086208|0.162849|6.694711|10.916313|18.731456|53.358707|
|1.923550|2.243989|2.269999|2.624679|3.170918|3.118391|2.564874|5.326315|3.987178|5.949338|5.075611|5.497086|0.122142|4.617919|7.624861|10.833442|19.083205|36.858105|
|1.893990|2.181476|2.155534|2.431085|2.927196|3.008778|2.524914|4.654935|3.386012|5.226732|3.944072|4.188346|0.096643|3.897511|6.763914|7.330878|11.493172|14.367874|53.358707|
|1.706896|1.932780|1.911397|2.124575|2.486374|2.544808|2.197622|3.862992|2.887527|4.613657|3.322732|3.374221|0.080792|3.112848|5.364617|5.630226|7.528089|8.572257|19.601120|36.858105|
|1.584729|1.786307|1.791162|1.995523|2.291063|2.289701|1.992887|3.584271|2.766139|4.480237|3.257818|3.208253|0.078318|2.849370|4.807557|5.300114|6.495874|7.231912|11.013066|14.348104|53.358707|
|1.616648|1.838823|1.873748|2.121233|2.433080|2.367556|2.035512|3.919837|3.103608|4.957967|3.862909|3.754702|0.091374|3.148044|5.172885|6.381454|7.459297|8.597169|9.791199|8.527396|19.545328|36.858105|
|1.767058|2.042670|2.099603|2.426525|2.837539|2.714263|2.276236|4.763018|3.776170|5.780725|5.040861|5.055547|0.118089|3.972504|6.373151|9.439414|11.236018|14.454742|10.983010|7.179235|10.996281|14.375914|53.358707|
|1.486540|1.675397|1.721316|1.937473|2.170637|2.087875|1.823077|3.456492|2.786081|4.563834|3.433574|3.251959|0.082158|2.718164|4.449358|5.247195|5.611997|5.485302|6.486571|5.526245|11.519160|14.107975|11.191516|53.358707|
|1.447294|1.630403|1.698222|1.920766|2.117546|1.996651|1.749239|3.390863|2.787175|4.603903|3.490195|3.246621|0.084569|2.646647|4.277274|5.069358|5.024075|4.465828|5.107921|4.018201|7.150293|7.560787|8.769260|18.427058|36.858105|
|1.506724|1.709939|1.803033|2.066349|2.272761|2.101202|1.825590|3.716427|3.081587|4.999398|4.035423|3.795019|0.101399|2.945919|4.693988|5.931779|5.430371|4.522198|4.902247|3.600263|5.882903|6.108489|8.800391|10.464968|13.694003|36.858105|
|1.430551|1.612603|1.716186|1.957676|2.104773|1.927352|1.695478|3.393042|2.824892|4.686336|3.576910|3.338619|0.093073|2.641942|4.219269|4.912643|4.388927|3.458729|3.905361|2.853937|4.495554|4.240660|6.055452|6.970682|7.945577|13.740942|36.858105|
|1.320617|1.472894|1.561483|1.756640|1.866544|1.724811|1.538791|2.939119|2.435310|4.144911|2.942599|2.720118|0.075479|2.244285|3.624599|3.926678|3.635100|2.888260|3.399379|2.548361|4.042779|3.634014|4.884286|6.178161|6.820639|7.879731|13.768939|36.858105|
|1.280394|1.421595|1.492409|1.665220|1.778492|1.666281|1.492766|2.771611|2.283288|3.912651|2.712205|2.497832|0.067783|2.104769|3.424631|3.647340|3.508936|2.876567|3.468751|2.686566|4.395795|3.885712|4.886085|7.082521|7.898112|6.858249|7.992036|13.752356|36.858105|
|1.333452|1.486091|1.547593|1.729504|1.875107|1.773598|1.578303|2.937373|2.411176|4.088033|2.894513|2.669691|0.070722|2.246819|3.660295|4.005780|3.972762|3.403679|4.108503|3.279554|5.666986|5.172024|6.023431|10.905831|13.671642|7.933247|6.927445|7.938200|13.790836|36.858105|
|1.636431|1.825843|1.780679|1.941770|2.247420|2.349034|2.076295|3.377339|2.488311|4.055969|2.747818|2.787738|0.068109|2.672201|4.701890|4.454074|5.670841|5.471710|11.188634|14.101859|11.508162|5.524976|6.477064|5.756962|3.243262|2.905934|2.400483|2.201469|2.339110|2.798498|53.358707|
|1.685135|1.866052|1.789086|1.924541|2.231882|2.395380|2.145100|3.270784|2.345551|3.833085|2.511128|2.591292|0.063680|2.583496|4.666862|4.051117|5.117038|4.476561|8.824937|7.590784|7.154441|4.025570|5.118533|4.418622|2.640959|2.444163|2.075326|1.910374|2.001055|2.324439|18.399902|36.858105|
|1.531881|1.669946|1.598167|1.698137|1.933805|2.070954|1.894541|2.793435|2.003349|3.312610|2.126857|2.196487|0.055113|2.192351|3.987136|3.386567|4.079479|3.450073|6.133218|5.219664|5.676378|3.298172|4.147832|3.818010|2.330869|2.153347|1.862286|1.739022|1.829399|2.102332|10.855192|13.695125|36.858105|
|1.531583|1.651231|1.562430|1.639124|1.856071|2.015389|1.875230|2.630040|1.861425|3.094059|1.939043|2.013344|0.050922|2.052073|3.782663|3.045682|3.603411|2.911796|4.959289|3.911684|4.401869|2.699725|3.498973|3.190653|2.006101|1.884782|1.657528|1.552790|1.619188|1.828314|7.067019|7.907398|13.775282|36.858105|
|1.684133|1.814551|1.692762|1.764321|2.012743|2.232962|2.089790|2.811026|1.956319|3.245198|2.003784|2.093008|0.052696|2.187312|4.084391|3.125138|3.720543|2.908684|4.928813|3.650482|4.049561|2.557383|3.417881|3.002668|1.913305|1.825726|1.612599|1.501755|1.549973|1.735503|6.180225|6.831131|7.936720|13.758298|36.858105|
|1.894117|2.074265|1.924418|2.022071|2.355393|2.656408|2.441504|3.298788|2.270824|3.729196|2.315130|2.425990|0.060029|2.575243|4.825154|3.625124|4.459158|3.451387|6.049145|4.245352|4.500800|2.857133|3.905188|3.271546|2.074679|1.993556|1.745302|1.608220|1.650610|1.854824|6.981373|7.943705|6.915865|7.981662|13.757655|36.858105|
|1.896986|2.114489|1.994807|2.138656|2.524005|2.791920|2.488239|3.644117|2.547354|4.137305|2.659097|2.769592|0.067273|2.872477|5.275203|4.245110|5.474245|4.469570|8.674764|6.093822|5.887984|3.596773|4.877308|3.957697|2.440066|2.319773|1.989383|1.817956|1.875055|2.142767|10.513547|13.707427|7.938766|6.866307|7.895142|13.754620|36.858105|
|17.530825|8.850932|6.274147|4.452785|3.981729|4.441585|6.252901|4.190523|2.649444|4.718212|2.237995|2.283445|0.061433|2.761793|5.088189|2.773423|2.800367|1.838234|2.463115|1.630388|2.060498|1.544515|2.298535|1.935730|1.386967|1.448322|1.378713|1.272030|1.230215|1.278177|2.130858|1.617061|1.479010|1.484900|1.632635|1.823928|1.814926|0.500000|
|17.572431|8.837156|5.638365|4.194288|3.963401|4.705787|7.097809|4.173212|2.690297|4.869176|2.257316|2.250522|0.059240|2.702483|4.899466|2.760105|2.854255|1.899432|2.581217|1.717389|2.158750|1.602127|2.364629|2.000207|1.420312|1.466017|1.385578|1.283782|1.253061|1.310981|2.263813|1.728391|1.575615|1.586741|1.758143|1.978070|1.959217|0.302075|0.500000|
|17.572008|8.837246|7.083530|4.700504|3.963473|4.198269|5.646095|4.173801|2.750172|5.109263|2.273320|2.234892|0.059883|2.643454|4.673431|2.687444|2.711783|1.801732|2.402754|1.605642|2.048823|1.540572|2.280905|1.945021|1.400151|1.457592|1.394037|1.293675|1.253299|1.298286|2.093728|1.572291|1.434900|1.429759|1.558516|1.738925|1.750295|0.302050|0.301654|0.500000|
|6.994861|8.909986|17.708012|8.962569|5.664920|4.964389|5.664294|5.687303|3.709819|7.001681|2.902444|2.823116|0.076998|3.389463|5.744178|3.224860|3.141869|2.038446|2.633431|1.737542|2.238436|1.722183|2.603715|2.178454|1.591532|1.690508|1.627468|1.491585|1.422693|1.463471|2.211737|1.627718|1.467349|1.436435|1.546285|1.737082|1.794576|0.168470|0.143033|0.212266|0.500000|
|4.088826|5.625593|8.918667|17.747478|8.930636|5.655288|4.967656|9.781839|6.400664|11.943087|4.434777|4.173033|0.114805|5.082296|7.740919|4.354121|4.060706|2.549627|3.161829|2.047892|2.658605|2.103170|3.280602|2.647922|1.958849|2.132480|2.047963|1.834574|1.721187|1.769398|2.530153|1.820485|1.612573|1.547397|1.647487|1.870744|1.991546|0.103888|0.096692|0.111593|0.216199|0.500000|
|4.088595|5.625909|4.967604|5.655105|8.931240|17.750355|8.917887|9.765722|5.096649|7.857879|4.178735|4.431419|0.104696|6.451296|12.065247|5.310679|5.915115|3.563640|4.779211|2.893820|3.456072|2.595727|4.072550|3.052963|2.108401|2.201320|1.987068|1.771148|1.722470|1.855119|3.631882|2.752948|2.337821|2.270260|2.546507|3.113063|3.299957|0.103636|0.111732|0.096787|0.107761|0.124369|0.500000|
|6.994340|8.911737|5.664175|4.964583|5.665055|8.961154|17.707972|5.684076|3.393914|5.810057|2.826458|2.899714|0.073730|3.719211|6.993085|3.561810|3.801463|2.457950|3.372634|2.171028|2.655403|1.962967|2.950390|2.387620|1.668483|1.724045|1.596225|1.456673|1.423175|1.510630|2.839811|2.195002|1.950954|1.957901|2.214932|2.593192|2.581039|0.167571|0.213102|0.143300|0.124238|0.107762|0.216190|0.500000|
|2.191496|2.644097|2.974766|3.780986|4.226905|3.428449|2.793735|8.143070|8.880341|12.495480|17.627522|8.646257|0.221888|5.802159|7.664160|8.351026|6.718384|4.295904|4.622935|2.980047|4.111310|3.632892|6.230358|4.619168|3.626917|4.359916|4.041230|3.277765|2.932563|3.046086|3.389943|2.262147|1.948507|1.777965|1.819317|2.066527|2.350862|0.057444|0.057461|0.058894|0.075654|0.114706|0.094946|0.069049|0.500000|
|2.263777|2.748964|2.959749|3.690057|4.479658|3.862249|3.044409|8.755431|8.976112|11.940788|17.586461|8.802421|0.176189|6.385017|8.429283|9.997005|9.643160|6.213252|6.361429|3.929431|5.277986|4.691365|8.552046|5.498468|3.979033|4.439006|3.742886|3.092752|2.926520|3.223787|4.296151|2.814479|2.340498|2.100841|2.156754|2.510708|2.956855|0.058761|0.060541|0.059915|0.073331|0.104013|0.113314|0.076361|0.302492|0.500000|
|2.045912|2.420783|2.526368|3.009716|3.601568|3.330717|2.707501|6.361441|4.349012|6.111513|5.672228|9.398994|0.236152|6.764390|11.700271|25.932570|13.215628|6.408047|6.519254|3.754980|4.779149|4.090410|7.631013|4.687214|3.343817|3.897158|3.321937|2.685264|2.485328|2.696663|4.165866|2.842173|2.418575|2.197982|2.257539|2.590806|2.974296|0.055559|0.054522|0.052998|0.063111|0.083093|0.100996|0.069997|0.136205|0.147962|0.500000|
|2.263554|2.705061|2.695879|3.154197|4.033233|4.094105|3.212232|6.839903|4.457659|6.334641|5.194718|6.747527|0.143362|6.803800|12.559458|12.643058|25.975082|9.529791|10.995230|5.188131|5.777800|4.521484|8.168995|4.762076|3.126832|3.312746|2.764837|2.345599|2.278778|2.554667|5.652811|3.969652|3.146201|2.828943|2.994037|3.678860|4.472939|0.060523|0.061737|0.057613|0.065626|0.082519|0.137643|0.085133|0.115145|0.154751|0.230682|0.500000|
|1.409524|1.574723|1.607627|1.788908|1.990373|1.935067|1.710055|3.108227|2.482229|4.128556|2.955049|2.803940|0.071374|2.416561|4.004443|4.424168|4.787865|4.565218|5.837143|5.268376|11.299594|9.732491|8.204622|26.052490|9.315485|5.735600|4.293789|4.080190|4.933813|7.665173|5.852025|3.263776|2.879904|2.385789|2.208952|2.370025|2.851207|0.037466|0.038893|0.037703|0.041671|0.049713|0.057688|0.046037|0.081006|0.095215|0.082210|0.085757|0.500000|
|1.608487|1.842837|1.944781|2.254441|2.518210|2.316326|1.983647|4.216369|3.465543|5.437655|4.767765|4.674925|0.123567|3.450411|5.453855|7.773453|6.763556|5.533878|5.603037|3.920176|6.163490|6.580511|11.232254|9.468807|8.908058|17.825994|8.916171|5.631223|4.952796|5.646621|4.194968|2.605000|2.262287|1.981023|1.935244|2.137493|2.503831|0.043008|0.043352|0.042963|0.050248|0.064446|0.067884|0.051826|0.140067|0.145081|0.138517|0.110230|0.142920|0.500000|
|1.457594|1.646719|1.767732|2.027515|2.162750|1.957025|1.720508|3.503507|2.908886|4.796116|3.696129|3.513274|0.101647|2.743570|4.367784|5.048153|4.327810|3.268964|3.676628|2.622004|3.995433|3.679170|5.491410|5.644056|5.659886|8.970943|17.707584|8.930595|5.667618|4.979473|3.025027|1.955507|1.758221|1.580903|1.550723|1.681203|1.899385|0.039155|0.038977|0.039493|0.046712|0.059515|0.055600|0.044743|0.119276|0.102937|0.096238|0.076161|0.098201|0.216561|0.500000|
|1.268491|1.407534|1.497862|1.676754|1.759814|1.621788|1.458211|2.742854|2.263082|3.891810|2.675892|2.484903|0.070033|2.079409|3.372267|3.514732|3.232983|2.515098|2.998333|2.231437|3.463085|3.021093|4.110096|4.918703|4.925218|5.618862|8.897470|17.723162|8.893840|5.642735|2.666323|1.725938|1.584067|1.428363|1.386339|1.478608|1.653479|0.034014|0.034175|0.034660|0.040024|0.048923|0.045906|0.038315|0.083388|0.076509|0.067582|0.058735|0.092472|0.123956|0.214648|0.500000|
|1.206523|1.329956|1.393213|1.541082|1.632971|1.537140|1.389920|2.510115|2.055195|3.563540|2.381986|2.198451|0.059845|1.890051|3.096266|3.171525|3.077032|2.500686|3.083635|2.401813|3.875737|3.284972|4.110796|5.757444|5.635493|4.944178|5.662765|8.902042|17.714033|8.959089|2.911213|1.849111|1.710617|1.523596|1.455622|1.538410|1.731673|0.032217|0.032860|0.032913|0.037073|0.044216|0.043981|0.036928|0.071144|0.070856|0.060545|0.056340|0.117009|0.107518|0.124264|0.213848|0.500000|
|1.288174|1.427280|1.475387|1.634339|1.771207|1.694263|1.518275|2.737827|2.227066|3.806696|2.609590|2.414529|0.063524|2.080716|3.419958|3.611261|3.675270|3.180550|3.984998|3.282631|5.759444|4.897586|5.435126|10.099512|8.899126|5.641533|4.978392|5.648952|8.941436|17.694196|3.908822|2.368942|2.164021|1.871852|1.759379|1.864963|2.153227|0.034266|0.035361|0.034848|0.038775|0.046141|0.049367|0.040624|0.074958|0.081104|0.067899|0.066689|0.235903|0.124071|0.107942|0.124160|0.216749|0.500000|
|1.517990|1.679704|1.644982|1.784728|2.035349|2.109170|1.886308|3.042310|2.268298|3.745716|2.502583|2.506847|0.062171|2.381166|4.165953|3.952580|4.818252|4.554153|8.200462|9.710615|11.254861|5.257467|5.822764|5.842147|3.259484|2.842417|2.364604|2.206135|2.386155|2.880568|26.052734|9.282425|7.511724|4.883037|4.069444|4.303407|5.780197|0.040379|0.042850|0.039885|0.042021|0.047782|0.065492|0.052600|0.064163|0.079365|0.075829|0.096361|0.127580|0.081749|0.060235|0.054500|0.061115|0.084062|0.500000|
|1.421103|1.544328|1.490050|1.584905|1.787899|1.888909|1.732100|2.595486|1.882620|3.127051|2.016586|2.071018|0.052415|2.033989|3.669761|3.200925|3.779453|3.238422|5.554696|4.954952|5.771907|3.308687|4.037991|3.921116|2.379783|2.167092|1.876306|1.767350|1.877978|2.169321|10.035001|8.910679|17.698786|8.927115|5.646404|4.972796|5.645719|0.038167|0.040441|0.037196|0.038234|0.042138|0.058495|0.049206|0.051926|0.061609|0.063605|0.079237|0.083934|0.062504|0.048882|0.044660|0.048982|0.062731|0.227164|0.500000|
|1.420426|1.518052|1.439406|1.501973|1.681981|1.815215|1.705789|2.372962|1.685292|2.818425|1.752762|1.816359|0.046417|1.844367|3.396464|2.730047|3.161724|2.535961|4.175662|3.306822|3.879978|2.414720|3.114963|2.917485|1.854970|1.741974|1.546675|1.460178|1.525370|1.711166|5.741370|5.639022|8.950487|17.715010|8.905986|5.659025|4.948417|0.038391|0.040868|0.036985|0.036994|0.039550|0.056096|0.049452|0.045060|0.052374|0.055038|0.068303|0.061047|0.050481|0.041014|0.037486|0.040128|0.048859|0.115579|0.216223|0.500000|
|1.657671|1.764221|1.634582|1.684980|1.903991|2.122693|2.021523|2.622723|1.816055|3.030510|1.840474|1.924015|0.048884|2.028221|3.809341|2.834416|3.306227|2.532773|4.144164|3.033137|3.468447|2.239105|3.014776|2.671778|1.728768|1.660938|1.483106|1.386650|1.425899|1.581011|4.919933|4.930657|5.642366|8.899365|17.722810|8.899115|5.626301|0.044854|0.048327|0.042577|0.041635|0.043630|0.066580|0.060097|0.046652|0.054424|0.057250|0.073866|0.054561|0.048764|0.039818|0.035777|0.037368|0.044460|0.092256|0.124109|0.214057|0.500000|
|2.075065|2.269187|2.069150|2.153465|2.521843|2.922379|2.715871|3.456898|2.335652|3.838991|2.330846|2.451895|0.060682|2.677608|5.084907|3.586706|4.365914|3.243769|5.451505|3.676244|3.999049|2.621486|3.664880|3.027790|1.953148|1.901386|1.678900|1.544250|1.572236|1.749439|5.654460|5.657468|4.973815|5.663254|8.923027|17.711837|8.964185|0.055494|0.060734|0.052383|0.051546|0.054679|0.096325|0.081794|0.057465|0.069384|0.071368|0.101809|0.060400|0.056817|0.045270|0.039635|0.040740|0.048551|0.098585|0.107853|0.124223|0.214619|0.500000|
|2.076842|2.358903|2.227620|2.420122|2.924832|3.259633|2.824078|4.274326|2.966507|4.753000|3.088330|3.211306|0.076172|3.375426|6.148602|4.907794|6.634576|5.319947|10.599946|6.517577|6.171633|3.901611|5.508770|4.195704|2.595276|2.495993|2.125393|1.921085|1.966284|2.247294|9.548550|8.919322|5.651331|4.956195|5.636169|8.921510|17.815826|0.054799|0.059362|0.052987|0.055049|0.062167|0.110040|0.080653|0.074185|0.096683|0.093473|0.154095|0.082190|0.075791|0.056535|0.048394|0.050085|0.062055|0.144978|0.124206|0.107577|0.124025|0.216330|0.500000|
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