Version2.0
2020-07-30T11:53:53Z
10.1021/jm300687e
Gaussian16
RevisionB.01
SBUNGAY
07-Jul-2020
#N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2)
DUDE c1cc(ccc1CN2CCc3nnc(n3CC2)CCNC(=O)[C@H]4CCCO4)O C23130479
RHF
6-31G(d)
(6D,7F)
c1cc(ccc1CN2CCc3nnc(n3CC2)CCNC(=O)[C@H]4CCCO4)O
C01[X(C20H27N5O3)]
159
C1
474
O=C([C@H]1CCCO1)NCCc1nnc2n1CCN(CC2)Cc1ccc(cc1)O
O=C([C@H]1CCCO1)NCCc1nnc2n1CCN(CC2)Cc1ccc(cc1)O
Oc1ccc(CN2CCn3c(CCNC(=O)[C@H]4CCCO4)nnc3CC2)cc1
InChIKey=ZFJSCXQINBMUON-QGZVFWFLSA-N
InChI=1S/C20H27N5O3/c26-16-5-3-15(4-6-16)14-24-10-8-19-23-22-18(25(19)12-11-24)7-9-21-20(27)17-2-1-13-28-17/h3-6,17,26H,1-2,7-14H2,(H,21,27)/t17-/m1/s1
InChI=1/C20H27N5O3/c26-16-5-3-15(4-6-16)14-24-10-8-19-23-22-18(25(19)12-11-24)7-9-21-20(27)17-2-1-13-28-17/h3-6,17,26H,1-2,7-14H2,(H,21,27)/t17-/m1/s1/f/h21H
c1cc(ccc1CN2CCc3nnc(n3CC2)CCNC(=O)[C@H]4CCCO4)O
C01[X(C20H27N5O3)]
159
C01
474
O=C([C@H]1CCCO1)NCCc1nnc2n1CCN(CC2)Cc1ccc(cc1)O
O=[C]([NH]CCC1=[N][N]=C2N1CCN(CC2)C[C]1[CH][CH][C]([CH][CH]1)O)[C@H]1CCCO1
O[C]1[CH][CH][C]([CH][CH]1)CN2CCn3c(CCNC(=O)[C@H]4CCCO4)nnc3CC2
InChIKey=ZFJSCXQINBMUON-QGZVFWFLSA-N
InChI=1S/C20H27N5O3/c26-16-5-3-15(4-6-16)14-24-10-8-19-23-22-18(25(19)12-11-24)7-9-21-20(27)17-2-1-13-28-17/h3-6,17,26H,1-2,7-14H2,(H,21,27)/t17-/m1/s1
InChI=1/C20H27N5O3/c26-16-5-3-15(4-6-16)14-24-10-8-19-23-22-18(25(19)12-11-24)7-9-21-20(27)17-2-1-13-28-17/h3-6,17,26H,1-2,7-14H2,(H,21,27)/t17-/m1/s1/f/h21H
2534.8494128768
-1269.9039821
1-A
19379.8526
103
371
474
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12.09509
-2.3697 -4.3721 2.2472
5.4571
|XX|YY|ZZ|XY|XZ|YZ|
-123.0079 -199.1499 -161.3703 11.3189 7.4122 2.7837
|XX|YY|ZZ|XY|XZ|YZ|
38.1681 -37.9739 -0.1943 11.3189 7.4122 2.7837
|XXX|YYY|ZZZ|XYY|XXY|XXZ|XZZ|YZZ|YYZ|XYZ|
-191.7091 -155.9773 -3.2957 -19.7326 22.4848 157.1938 2.6902 -6.5948 13.1221 7.7702
|XXXX|YYYY|ZZZZ|XXXY|XXXZ|YYYX|YYYZ|ZZZX|ZZZY|XXYY|XXZZ|YYZZ|XXYZ|YYXZ|ZZXY|
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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|
14.5645 16.5141 25.6463 28.4261 38.9686 40.0709 59.2774 60.9875 82.4264 91.9157 102.6683 137.6093 161.0754 168.4246 196.4942 238.3860 250.1114 283.2169 289.4517 298.4365 311.4267 320.7104 329.6741 349.4134 363.3851 403.8556 415.7435 419.3801 450.7716 463.8997 465.9835 477.8607 513.2072 568.1174 570.5510 579.9060 588.3131 633.6352 634.9044 652.0119 703.2959 705.8651 722.3639 751.2790 778.8331 779.6128 800.5387 816.6232 847.9309 857.4259 876.5193 888.2843 919.5088 922.9743 934.2503 943.5674 966.3705 981.3790 986.0254 1001.0230 1032.0584 1042.4779 1054.5029 1061.7328 1068.6901 1079.2046 1091.7557 1102.0254 1112.1920 1116.1005 1130.1730 1158.9721 1161.5705 1179.4711 1190.0130 1191.7112 1194.6779 1226.0628 1227.5697 1244.1318 1259.8286 1260.8122 1294.1959 1300.3405 1312.2207 1322.7852 1324.7278 1334.3361 1344.6061 1360.2244 1371.1117 1379.4177 1391.3927 1403.0768 1405.6738 1409.0262 1434.9497 1436.2086 1443.4069 1462.3829 1465.1410 1467.5691 1487.0949 1488.1275 1497.7977 1505.2434 1505.9975 1533.4336 1544.7185 1554.5190 1561.4127 1570.8948 1578.8394 1606.8109 1607.9638 1625.8514 1633.5514 1637.9659 1642.4460 1648.3437 1653.4033 1655.2615 1659.0314 1674.9985 1686.1138 1696.6376 1719.4034 1751.4523 1773.8542 1795.1515 1824.4399 1921.3473 3122.8939 3132.1237 3219.2028 3224.9713 3225.0802 3231.7026 3234.9015 3235.7505 3242.6518 3248.3007 3257.7796 3258.5814 3279.5346 3280.7616 3283.8909 3288.7118 3289.6931 3291.3730 3311.5836 3314.4593 3322.7529 3341.7085 3356.3948 3383.2195 3393.1434 3900.4921 4117.9804
5.8637 4.6205 4.0782 4.3715 4.0848 5.1007 4.1544 3.5925 4.4444 5.1616 5.0957 4.5366 4.2537 5.5578 2.6891 2.7721 2.8521 3.8002 2.6971 4.4237 1.1636 2.3332 3.1916 2.8752 2.6449 3.1998 5.8182 3.3013 4.1938 3.5307 3.2204 3.7541 6.2680 2.9905 2.6686 2.3023 1.4844 2.5998 2.3383 2.3708 6.0816 3.3623 3.4276 4.2524 7.1687 3.2735 4.1554 1.6598 4.0297 3.4558 2.9498 4.0469 2.5605 1.7540 2.0868 1.6269 2.0398 2.1761 2.4424 2.3971 2.3531 1.9647 2.4615 1.4924 2.2693 2.0797 1.3454 1.8894 2.5300 3.7382 2.3068 3.8191 2.3725 1.9620 2.3820 2.3679 1.7956 3.2693 2.7734 2.3420 2.2789 4.1624 1.1476 1.9672 1.3808 1.4563 2.2745 1.4378 1.4277 1.6024 2.1067 1.2268 1.3605 1.6705 2.8798 1.3051 1.4888 1.3590 1.3629 1.3885 1.4866 1.2943 1.4380 1.3971 1.4902 1.5802 1.5313 1.4183 1.4067 1.4983 1.5046 1.7419 1.6889 2.4706 2.3413 1.1032 1.1421 1.0949 1.1523 1.0889 1.1083 1.1374 1.1318 1.0906 1.1118 2.6970 2.2220 8.7656 9.3061 5.7395 5.6335 9.4347 1.0757 1.0734 1.0689 1.0687 1.0693 1.0791 1.0716 1.0756 1.0700 1.0627 1.0764 1.0693 1.0920 1.0958 1.1005 1.1054 1.1049 1.0946 1.1050 1.1008 1.0982 1.0907 1.0904 1.0937 1.0948 1.0787 1.0668
0.0007 0.0007 0.0016 0.0021 0.0037 0.0048 0.0086 0.0079 0.0178 0.0257 0.0316 0.0506 0.0650 0.0929 0.0612 0.0928 0.1051 0.1796 0.1331 0.2321 0.0665 0.1414 0.2044 0.2068 0.2058 0.3075 0.5925 0.3421 0.5021 0.4477 0.4120 0.5051 0.9727 0.5687 0.5118 0.4562 0.3027 0.6150 0.5553 0.5938 1.7723 0.9870 1.0538 1.4141 2.5620 1.1722 1.5690 0.6521 1.7070 1.4969 1.3353 1.8814 1.2755 0.8804 1.0731 0.8534 1.1224 1.2348 1.3991 1.4152 1.4767 1.2580 1.6127 0.9912 1.5270 1.4271 0.9449 1.3519 1.8439 2.7436 1.7360 3.0224 1.8860 1.6081 1.9874 1.9813 1.5100 2.8955 2.4624 2.1358 2.1311 3.8984 1.1325 1.9598 1.4008 1.5014 2.3517 1.5082 1.5208 1.7468 2.3335 1.3753 1.5518 1.9376 3.3527 1.5266 1.8062 1.6516 1.6730 1.7495 1.8802 1.6424 1.8737 1.8228 1.9697 2.1095 2.0463 1.9650 1.9777 2.1333 2.1612 2.5326 2.4804 3.7582 3.5667 1.7181 1.7956 1.7307 1.8315 1.7432 1.7851 1.8361 1.8354 1.8029 1.8624 4.5742 3.8703 15.8426 17.2526 10.8975 11.0482 20.5206 6.1811 6.2041 6.5266 6.5487 6.5528 6.6404 6.6073 6.6352 6.6291 6.6064 6.7306 6.6898 6.9197 6.9492 6.9921 7.0438 7.0450 6.9866 7.1398 7.1248 7.1437 7.1763 7.2374 7.3757 7.4266 9.6696 10.6584
0.5245 0.1599 2.8010 0.7455 1.4454 1.4557 3.3242 1.8152 7.2482 1.4318 2.4531 2.3588 1.7247 0.6295 4.2307 0.6780 4.0493 0.4350 5.7245 0.9850 129.6267 15.7268 0.6785 12.8485 2.7956 5.3079 23.4467 5.3081 20.4220 1.3120 3.0094 7.3240 11.9648 17.3741 4.4947 19.5612 71.5563 3.2107 3.0339 4.8072 0.2513 1.3676 6.0006 13.7094 2.0001 2.2207 4.5124 5.3257 9.6620 9.0090 3.6481 15.8176 19.7552 9.1218 4.2605 60.5990 9.9018 18.4208 1.3094 7.3458 11.1912 0.3983 23.9659 3.8504 3.0701 3.3928 0.2796 7.4961 4.0696 0.5812 15.4520 7.5944 21.4977 1.5517 6.8032 20.0293 17.6378 1.4095 12.6396 9.7916 209.7689 112.5872 22.1146 17.4883 30.2308 31.1727 0.8180 48.9248 3.7723 90.8101 1.4361 16.0811 20.7733 61.0170 114.4993 15.6928 42.8745 3.1538 1.3269 15.3014 1.4925 4.6822 12.9342 1.4616 12.1650 3.7849 37.5389 68.1991 11.5965 81.5529 50.5885 13.2841 3.8851 60.2041 15.8268 4.9787 3.5052 5.7494 14.2596 3.5441 5.7325 12.5648 4.0284 1.2097 4.3132 119.2126 378.1718 59.5299 37.3525 17.8726 71.1848 263.7242 20.3831 81.0821 76.7777 22.0535 7.1648 14.8758 22.2085 20.0656 53.6480 2.8399 28.0043 57.4028 32.9945 31.3586 45.7835 0.0454 68.3099 16.5690 26.4269 19.9958 12.6001 28.6275 14.5237 11.4033 9.5625 97.0648 93.4466
0.3956 0.1639 1.3914 4.2281 4.3882 1.8278 0.9418 0.2842 0.5216 0.5749 0.6360 1.1760 0.4878 0.2539 0.2748 0.8774 0.2879 1.8269 0.3600 0.5733 1.1110 1.0095 1.8507 0.9236 1.0068 1.6653 1.0969 2.1346 1.0092 1.3190 0.7331 0.4378 3.9842 2.4681 0.0883 1.1777 0.3264 1.6311 0.3036 1.0733 7.8078 6.1066 13.7617 1.8034 1.6952 0.4582 1.1356 1.9394 0.7678 9.3411 0.4805 1.1787 17.4643 13.2857 8.5619 3.4391 3.2431 16.8652 5.5894 3.9247 4.5293 2.9814 2.6720 1.6643 0.5876 2.2698 0.1736 1.3918 0.1601 9.5179 10.1197 2.5316 3.0586 4.4578 4.5647 2.6260 1.1114 6.6363 2.8124 5.2692 5.5101 0.9296 6.3663 10.1968 1.7695 7.5903 14.3409 2.6642 5.7399 6.8274 5.1342 15.9495 4.6793 2.2665 7.5934 2.6069 6.5904 6.0267 2.4869 5.6838 2.1841 4.6953 2.7786 0.9375 3.1941 11.8401 11.0218 5.6669 4.7837 4.2581 3.6102 3.0316 5.1914 11.6446 4.7558 8.9276 15.8927 11.5523 1.4043 5.8361 10.7938 18.3486 4.2891 6.9670 9.8899 0.6449 2.1278 61.8082 8.2021 5.6780 50.9565 2.4624 14.3373 61.2295 121.2548 92.0943 21.4371 42.9841 48.5880 147.5456 43.8364 97.3457 69.7448 83.0451 77.1116 129.7319 50.0663 83.7675 78.4333 126.8132 33.5108 68.2489 49.2249 89.2267 59.7546 59.1547 148.9667 50.3641 102.6453
0.7408 0.7436 0.7431 0.7446 0.7469 0.7489 0.7070 0.5497 0.6408 0.7367 0.7287 0.6199 0.2484 0.5547 0.7464 0.5341 0.5626 0.0336 0.5776 0.7429 0.7201 0.5272 0.7019 0.4653 0.7352 0.6673 0.4561 0.7423 0.7328 0.2473 0.2740 0.7125 0.4398 0.7446 0.7268 0.6635 0.7497 0.5869 0.6956 0.5943 0.5593 0.2017 0.1423 0.2702 0.7300 0.3867 0.7088 0.6500 0.7500 0.0441 0.6994 0.7260 0.1333 0.1683 0.0869 0.1047 0.4168 0.1073 0.3589 0.5444 0.7211 0.7428 0.6823 0.7211 0.4380 0.5992 0.7472 0.4770 0.7016 0.1876 0.6217 0.7311 0.3706 0.7490 0.2227 0.5761 0.5268 0.7390 0.6524 0.5877 0.7453 0.6603 0.3329 0.7391 0.4198 0.7457 0.1877 0.7328 0.1668 0.4848 0.2190 0.7408 0.6973 0.2204 0.2065 0.6790 0.7465 0.7047 0.7458 0.7092 0.7129 0.7367 0.7452 0.5834 0.7469 0.6803 0.6966 0.7498 0.5757 0.4460 0.7452 0.2440 0.3966 0.4574 0.6025 0.7204 0.7300 0.7499 0.4454 0.7434 0.7083 0.7449 0.7444 0.7476 0.6264 0.4592 0.7344 0.2048 0.4989 0.7472 0.4989 0.3862 0.3766 0.1277 0.2455 0.2286 0.5489 0.5832 0.5823 0.0392 0.2036 0.0525 0.4903 0.0540 0.3453 0.1577 0.6281 0.6376 0.6854 0.3143 0.2237 0.4599 0.5492 0.3838 0.4848 0.1751 0.2307 0.2007 0.2911
0.8511 0.8530 0.8526 0.8536 0.8551 0.8564 0.8284 0.7095 0.7811 0.8484 0.8431 0.7654 0.3980 0.7135 0.8548 0.6963 0.7201 0.0651 0.7322 0.8525 0.8373 0.6904 0.8249 0.6351 0.8474 0.8004 0.6265 0.8521 0.8458 0.3965 0.4301 0.8321 0.6109 0.8536 0.8418 0.7977 0.8570 0.7397 0.8205 0.7456 0.7174 0.3357 0.2491 0.4255 0.8439 0.5578 0.8296 0.7879 0.8571 0.0846 0.8231 0.8412 0.2353 0.2881 0.1600 0.1896 0.5884 0.1938 0.5282 0.7050 0.8380 0.8524 0.8111 0.8379 0.6092 0.7494 0.8553 0.6459 0.8246 0.3159 0.7667 0.8447 0.5408 0.8565 0.3643 0.7310 0.6901 0.8499 0.7896 0.7403 0.8541 0.7954 0.4995 0.8499 0.5913 0.8543 0.3160 0.8458 0.2859 0.6530 0.3593 0.8511 0.8217 0.3612 0.3423 0.8088 0.8549 0.8268 0.8544 0.8298 0.8324 0.8484 0.8540 0.7369 0.8551 0.8098 0.8212 0.8570 0.7307 0.6169 0.8540 0.3923 0.5679 0.6277 0.7519 0.8375 0.8439 0.8571 0.6163 0.8528 0.8292 0.8538 0.8534 0.8556 0.7703 0.6294 0.8468 0.3400 0.6657 0.8553 0.6657 0.5572 0.5472 0.2265 0.3942 0.3722 0.7087 0.7367 0.7360 0.0755 0.3383 0.0998 0.6580 0.1025 0.5133 0.2724 0.7715 0.7787 0.8134 0.4783 0.3656 0.6301 0.7090 0.5547 0.6530 0.2980 0.3749 0.3343 0.4509
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
6 6 6 6 6 6 6 7 6 6 6 7 7 6 7 6 6 6 6 7 6 8 6 1 6 6 6 8 8 1 1 1 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 12.00000 12.00000 14.00307 14.00307 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 12.00000 1.00783 12.00000 12.00000 12.00000 15.99491 15.99491 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 1.00783 1.00783 1.00783
5161.3042 30929.7293 34308.9341
0.99999 0.00444 -0.00142 -0.00445 0.99999 -0.00252 0.00141 0.00252 1.00000
1
0.01678 0.00280 0.00252
0.34967 0.05835 0.05260
20.96 23.76 36.90 40.90 56.07 57.65 85.29 87.75 118.59 132.25 147.72 197.99 231.75 242.33 282.71 342.98 359.85 407.49 416.46 429.38 448.07 461.43 474.33 502.73 522.83 581.06 598.16 603.39 648.56 667.45 670.45 687.53 738.39 817.39 820.90 834.36 846.45 911.66 913.49 938.10 1011.89 1015.58 1039.32 1080.92 1120.57 1121.69 1151.80 1174.94 1219.98 1233.64 1261.12 1278.04 1322.97 1327.95 1344.18 1357.58 1390.39 1411.99 1418.67 1440.25 1484.90 1499.89 1517.19 1527.60 1537.61 1552.73 1570.79 1585.57 1600.20 1605.82 1626.07 1667.50 1671.24 1697.00 1712.16 1714.61 1718.88 1764.03 1766.20 1790.03 1812.61 1814.03 1862.06 1870.90 1887.99 1903.19 1905.99 1919.81 1934.59 1957.06 1972.72 1984.67 2001.90 2018.71 2022.45 2027.27 2064.57 2066.38 2076.74 2104.04 2108.01 2111.50 2139.60 2141.08 2155.00 2165.71 2166.79 2206.27 2222.51 2236.61 2246.52 2260.17 2271.60 2311.84 2313.50 2339.24 2350.32 2356.67 2363.11 2371.60 2378.88 2381.55 2386.98 2409.95 2425.94 2441.08 2473.84 2519.95 2552.18 2582.82 2624.96 2764.39 4493.15 4506.43 4631.71 4640.01 4640.17 4649.70 4654.30 4655.52 4665.45 4673.58 4687.22 4688.37 4718.52 4720.28 4724.79 4731.72 4733.13 4735.55 4764.63 4768.77 4780.70 4807.97 4829.10 4867.70 4881.98 5611.94 5924.86
0.503387
0.527334
0.528279
0.444488
-1269.400595
-1269.376648
-1269.375704
-1269.459494
2.810330D-04
MUNgauss
RevisionA2.0
retrievium
30-Jul-2020
DUDE c1cc(ccc1CN2CCc3nnc(n3CC2)CCNC(=O)[C@H]4CCCO4)O C23130479
RHF
6-31G(d)
(6D,10F)
C1
385.211390
|X|Y|Z|
49.180631 25.631559 127.687532
54.396698
26
|36.858105|
|13.762963|36.858105|
|7.961675|13.759156|36.858105|
|6.911955|7.945302|13.726392|36.858105|
|8.006823|6.891141|7.941279|13.772681|36.858105|
|13.721375|7.869611|6.812831|7.885205|13.712647|36.858105|
|7.519108|4.994764|4.417814|5.005914|7.540531|12.562483|36.858105|
|5.248137|3.973145|3.750711|4.397348|6.341812|7.684957|13.096017|53.358707|
|4.998661|3.914551|3.643381|4.079439|5.343740|6.349742|7.894842|17.802226|36.858105|
|3.590969|3.036342|2.935075|3.284291|4.014036|4.295479|5.027969|10.387318|12.467400|36.858105|
|3.035350|2.577906|2.454260|2.677647|3.197900|3.495689|4.257902|8.013444|7.487247|12.696712|36.858105|
|2.570302|2.246658|2.150994|2.311153|2.665602|2.860067|3.321878|5.747357|5.162226|7.726087|14.835206|53.358707|
|2.328082|2.036778|1.937478|2.063144|2.366115|2.559343|3.012047|4.985299|4.133801|5.300135|8.908014|19.045543|53.358707|
|2.494015|2.140984|2.019050|2.157721|2.519052|2.775421|3.408210|5.651795|4.429931|5.273870|8.865819|12.124950|20.204588|36.858105|
|2.988520|2.498067|2.348128|2.548276|3.072801|3.444297|4.455795|8.044995|6.289741|7.486805|13.974154|11.936743|11.933744|13.948112|53.358707|
|3.388239|2.742255|2.548982|2.786776|3.470215|4.027530|5.778569|10.201204|6.429129|6.076599|7.501628|7.227557|7.230417|7.507624|17.774475|36.858105|
|3.880537|3.102402|2.958476|3.389994|4.483016|5.061671|7.804311|17.843590|7.739392|6.669593|6.414962|6.171929|5.662664|5.078506|10.467724|12.436556|36.858105|
|2.241604|1.939008|1.823470|1.930919|2.228355|2.455462|2.995677|4.668502|3.459633|3.796747|5.282756|7.218784|10.516310|12.733169|10.212104|6.106263|4.222001|36.858105|
|2.281613|1.965171|1.815113|1.887043|2.161881|2.434849|2.958961|4.370798|3.255968|3.352930|4.352654|5.816074|7.552439|7.545477|7.903992|5.383982|3.760642|12.414755|36.858105|
|2.042241|1.781118|1.651843|1.710468|1.937908|2.160763|2.581629|3.699915|2.678867|2.713238|3.321689|4.444904|5.484643|5.012354|5.703617|4.189129|3.162911|7.692803|13.160480|53.358707|
|2.060849|1.792983|1.665049|1.729706|1.966602|2.192210|2.640666|3.708969|2.588904|2.562818|3.035352|3.933668|4.638171|4.245505|5.222385|4.153986|3.219944|5.968077|7.826360|19.355525|36.858105|
|2.277368|1.954779|1.813348|1.899271|2.191023|2.460878|3.047614|4.255579|2.867979|2.783198|3.259851|4.067577|4.668161|4.403912|5.778683|5.004041|3.819905|5.825397|6.858360|11.544657|15.776007|73.516695|
|1.808959|1.600397|1.493912|1.542473|1.726865|1.900969|2.226607|3.077317|2.151197|2.127131|2.445251|3.217669|3.709655|3.206024|4.001232|3.140456|2.598441|4.176034|5.010617|10.645096|12.481808|14.265247|36.858105|
|1.840311|1.628159|1.510053|1.548016|1.727435|1.914247|2.231563|3.018591|2.102661|2.041501|2.305367|3.004709|3.391665|2.905742|3.731121|2.984482|2.506508|3.610149|4.406226|8.476793|9.066887|12.630861|17.580635|0.500000|
|1.690640|1.507207|1.423980|1.482098|1.655487|1.793690|2.086993|2.901509|1.999289|1.992846|2.263104|2.975455|3.391369|2.895815|3.659002|2.883902|2.473305|3.673895|3.947401|7.280477|7.496881|11.396288|12.414950|0.242473|36.858105|
|1.549665|1.393054|1.324566|1.379894|1.531541|1.643055|1.889396|2.671002|1.872982|1.907995|2.186458|2.946805|3.409648|2.839586|3.475667|2.625693|2.262123|3.634769|3.752892|6.806002|5.852773|8.569105|8.001823|0.161072|12.455767|36.858105|
|1.505455|1.357429|1.282864|1.324048|1.460429|1.575815|1.796908|2.522533|1.799656|1.827894|2.095361|2.857675|3.315611|2.714733|3.290722|2.446839|2.093389|3.448600|3.790225|7.118222|5.582140|7.654846|8.166888|0.171137|8.060619|12.497639|36.858105|
|1.653535|1.477829|1.382898|1.421143|1.575566|1.723221|1.984316|2.763362|1.975050|1.981351|2.285549|3.086807|3.594834|3.004286|3.648145|2.743985|2.291284|3.888610|4.670680|9.823161|7.850129|9.558987|13.520496|0.259532|8.082861|8.137546|13.453688|73.516695|
|5.274872|8.128838|14.084181|7.929009|5.216004|4.592500|3.363433|4.049709|2.944826|2.486231|2.120534|2.585309|2.344902|1.777144|2.756271|2.161474|2.451212|1.619376|1.614474|2.017940|1.491708|2.859952|1.353725|0.038042|1.294861|1.211208|1.177280|2.244264|73.516695|
|17.697661|8.972171|5.667626|4.970742|5.670807|8.918626|6.969348|6.647954|4.781388|3.465968|3.040711|3.525184|3.238839|2.569145|4.154762|3.479079|3.776676|2.331821|2.430272|2.957009|2.188013|4.288752|1.914303|0.054512|1.765244|1.609110|1.575225|3.107349|7.585156|0.500000|
|8.869629|17.735785|8.961190|5.659002|4.962923|5.607973|4.070400|4.541648|3.361453|2.692064|2.340636|2.825793|2.586152|1.986456|3.098052|2.468866|2.706442|1.816982|1.862408|2.313222|1.706320|3.276560|1.535842|0.043610|1.440983|1.333887|1.308994|2.535982|13.274831|0.215138|0.500000|
|4.969383|5.644572|8.897405|17.681598|8.915644|5.622001|4.085998|5.181542|3.553455|3.017177|2.478795|2.953492|2.640217|2.011916|3.193975|2.529772|3.067133|1.806624|1.749643|2.171674|1.613732|3.135886|1.448992|0.040255|1.403650|1.314465|1.257900|2.382412|12.722114|0.107777|0.124340|0.500000|
|5.676573|4.961827|5.653294|8.950334|17.721866|8.933075|7.014813|9.318852|5.374090|4.250998|3.358309|3.778538|3.343279|2.621477|4.387448|3.647828|4.987726|2.307294|2.192149|2.674711|2.000285|3.982086|1.751983|0.048307|1.696359|1.574014|1.487330|2.834726|7.483483|0.124451|0.107700|0.215928|0.500000|
|7.334552|4.786363|3.984936|4.185916|5.591320|8.921122|17.425121|12.217979|7.122029|4.670608|4.208565|4.533587|4.195671|3.529891|6.185720|5.937207|6.641384|3.146634|3.235766|3.812785|2.853553|5.849515|2.382605|0.066996|2.185614|1.963237|1.888461|3.764979|5.553064|0.225912|0.113621|0.096172|0.140722|0.500000|
|6.037854|4.375875|4.009864|4.598615|6.653368|8.955724|17.563910|12.578033|5.720821|4.189383|3.736005|4.066180|3.792314|3.192300|5.525404|5.463800|7.543481|2.905410|2.861017|3.487616|2.691190|5.633500|2.287241|0.063921|2.174589|1.944335|1.827350|3.573351|5.572059|0.156969|0.101231|0.107835|0.184754|0.303275|0.500000|
|5.681928|4.559021|4.313783|4.868364|6.296161|7.146316|7.115817|12.573442|17.614089|8.919423|5.555387|5.825552|4.710068|3.580116|6.350881|4.736547|5.701849|2.900644|2.768149|3.180446|2.267855|4.416165|1.926548|0.052654|1.801468|1.694188|1.635321|3.169664|6.068537|0.142361|0.106188|0.115478|0.167082|0.173054|0.144391|0.500000|
|5.042916|3.875592|3.436772|3.643227|4.557307|5.780323|7.264609|12.248921|17.413967|8.871905|7.117960|6.997736|5.809010|4.631195|8.721537|6.509515|6.510990|3.646560|3.591208|3.942144|2.760485|5.394067|2.271920|0.062073|2.068690|1.929442|1.877728|3.716323|5.001089|0.144828|0.095120|0.087540|0.121378|0.219257|0.147233|0.303780|0.500000|
|3.351485|2.896188|2.893729|3.343936|4.095617|4.112394|4.700048|9.805168|8.854419|17.545410|8.916737|8.647225|6.331377|4.639369|8.493062|5.417081|6.633416|3.485012|3.012354|3.414383|2.408572|4.673977|2.024607|0.053813|1.932585|1.856709|1.758281|3.344987|4.381086|0.087611|0.070824|0.087495|0.127131|0.115466|0.113700|0.206178|0.174078|0.500000|
|3.374313|2.945881|2.859580|3.132847|3.657419|3.848718|4.189064|7.648195|8.880301|17.603458|9.163185|10.113118|6.707039|4.549837|7.769972|4.637731|4.855600|3.368517|3.039868|3.381637|2.320571|4.390447|1.956978|0.052322|1.829080|1.768107|1.713091|3.289251|4.383287|0.090657|0.073610|0.080659|0.104787|0.110915|0.097766|0.225629|0.206595|0.304144|0.500000|
|2.949595|2.441962|2.289692|2.493752|3.039952|3.438337|4.703750|7.583878|4.741389|4.655362|5.723590|6.176712|6.659957|7.098979|12.565904|17.635328|8.861818|6.897509|5.853133|6.497075|4.974329|11.391568|3.627263|0.093898|3.376888|3.021636|2.740360|5.461861|3.502364|0.084176|0.061722|0.063740|0.089343|0.133602|0.132748|0.104491|0.132431|0.121981|0.104238|0.500000|
|3.714827|2.934374|2.646473|2.822802|3.495042|4.270544|6.269466|9.561576|6.315845|5.357181|6.215315|6.361550|6.388824|6.293046|12.389680|17.569944|8.794786|5.498780|5.598967|5.903062|4.298420|9.196469|3.232915|0.087465|2.873741|2.574051|2.450697|5.000615|3.970014|0.110255|0.073935|0.070002|0.098155|0.203261|0.159325|0.131879|0.201335|0.127505|0.119967|0.304142|0.500000|
|3.796194|3.050025|2.919716|3.353634|4.426744|4.948957|7.615900|12.592681|5.680185|4.866716|4.736423|4.962034|4.736011|4.216633|7.721231|8.938488|17.602323|3.799792|3.477469|4.164783|3.238567|7.028429|2.651178|0.071694|2.565010|2.300859|2.103060|4.081514|4.310018|0.102420|0.073963|0.084610|0.137820|0.177330|0.251002|0.128638|0.140513|0.137902|0.106388|0.227340|0.203617|0.500000|
|3.352332|2.794458|2.744567|3.189084|4.096476|4.284992|5.747001|12.446028|6.674334|6.976067|6.689397|6.538348|5.878117|5.086502|10.028691|8.921734|17.562776|4.133146|3.491519|4.032173|2.985264|6.150311|2.446160|0.064700|2.373222|2.214863|2.032837|3.885425|4.114345|0.089130|0.068133|0.082568|0.131793|0.136418|0.156472|0.144612|0.149632|0.221668|0.139518|0.206361|0.174519|0.305313|0.500000|
|2.233316|1.929145|1.825159|1.949389|2.263834|2.478175|3.059850|4.753548|3.352093|3.606859|4.767061|6.166665|8.029086|8.941139|9.311260|6.427094|4.510946|17.586118|8.878131|9.828378|6.590976|12.434806|4.514241|0.106522|4.160710|4.018998|3.594197|7.077100|2.875819|0.064064|0.049961|0.050820|0.065817|0.087932|0.084686|0.078256|0.095668|0.095005|0.087246|0.233121|0.152865|0.116833|0.123718|0.500000|
|2.004243|1.761822|1.669635|1.763134|2.005451|2.175825|2.580678|3.991342|2.996332|3.352561|4.530029|6.686844|10.097825|9.118710|7.718776|4.611088|3.494455|17.600884|8.835580|9.259324|5.175841|8.453080|3.935418|0.093124|3.541863|3.721141|3.574806|6.898049|2.663645|0.057608|0.046131|0.046219|0.057718|0.074517|0.069659|0.071558|0.086708|0.086991|0.085155|0.140584|0.116891|0.088484|0.097781|0.302542|0.500000|
|2.189459|1.904640|1.755845|1.809136|2.048007|2.299973|2.725877|4.010834|3.097246|3.225842|4.163155|5.856650|7.666674|6.722827|6.960583|4.488870|3.307018|8.837876|17.601578|12.580652|5.811253|8.944306|4.263401|0.106934|3.394819|3.335198|3.515606|7.600223|2.795110|0.065009|0.050545|0.046649|0.057237|0.083007|0.072084|0.074280|0.096176|0.079561|0.083723|0.127313|0.131415|0.084084|0.086219|0.174426|0.217545|0.500000|
|2.585432|2.184687|1.990834|2.063867|2.391896|2.758566|3.442712|4.993748|3.681642|3.619004|4.595021|5.763373|6.921560|7.016025|8.623444|6.480892|4.282665|8.802110|17.615883|12.575940|7.283707|13.082764|4.691127|0.121538|3.710220|3.362598|3.357254|7.381139|3.115450|0.077596|0.057318|0.052566|0.066802|0.107917|0.091823|0.085602|0.116181|0.088745|0.089699|0.188894|0.208349|0.109859|0.105382|0.206553|0.173633|0.302936|0.500000|
|1.869186|1.649643|1.533877|1.579619|1.769392|1.957549|2.290777|3.266191|2.394168|2.440813|2.946181|4.043182|4.962709|4.263482|4.839146|3.471134|2.729101|6.080817|8.930882|26.089677|9.509036|10.902645|7.553651|0.166778|5.137494|5.178113|6.051260|15.623828|2.467637|0.055175|0.044021|0.041105|0.049694|0.068721|0.062975|0.058889|0.071721|0.062941|0.063158|0.106644|0.099525|0.073360|0.071906|0.154842|0.167612|0.228643|0.184384|0.500000|
|1.607345|1.442498|1.363649|1.413011|1.567008|1.692914|1.946473|2.669492|1.836777|1.815214|2.026191|2.660354|2.980586|2.503032|3.218515|2.548793|2.238430|3.055304|3.295796|5.791054|5.594299|9.015806|8.831933|0.224820|17.562472|8.821506|6.877289|11.836788|2.215218|0.046630|0.038474|0.037238|0.044439|0.056582|0.056590|0.046429|0.052736|0.049029|0.046547|0.081244|0.071214|0.064974|0.059557|0.094072|0.082008|0.080933|0.088116|0.116134|0.500000|
|1.784198|1.582333|1.499964|1.573663|1.771666|1.915762|2.254389|3.147348|2.130299|2.119215|2.402088|3.112245|3.524669|3.059048|3.934039|3.176758|2.738629|3.854953|3.970161|6.906974|7.303108|13.030393|8.729590|0.192270|17.638363|8.626528|5.722127|10.402165|2.412650|0.051466|0.041741|0.041409|0.050794|0.065019|0.066058|0.053029|0.060662|0.057518|0.053435|0.106365|0.086479|0.080165|0.073087|0.127208|0.100760|0.092540|0.105806|0.127587|0.301607|0.500000|
|1.443890|1.307403|1.250177|1.303374|1.438347|1.529946|1.741564|2.457027|1.719484|1.753571|1.983036|2.676938|3.052610|2.499015|3.099772|2.340316|2.065364|3.083103|3.110139|5.305702|4.439177|6.937644|5.700783|0.128337|8.667364|17.588232|8.719867|10.344741|2.042007|0.041433|0.034811|0.034660|0.041145|0.049871|0.049963|0.043547|0.048838|0.047795|0.045326|0.074019|0.063414|0.058648|0.056634|0.094306|0.088197|0.078226|0.078796|0.111660|0.217350|0.193238|0.500000|
|1.594638|1.429525|1.363213|1.428165|1.592505|1.704178|1.971257|2.833844|1.993076|2.061083|2.400279|3.259526|3.842997|3.220596|3.848577|2.855492|2.432388|4.258208|4.166902|7.411472|6.028027|8.909815|6.806869|0.137834|8.799236|17.546903|8.827159|12.121709|2.209823|0.045814|0.037858|0.037827|0.045717|0.056593|0.056105|0.049741|0.056772|0.055841|0.052847|0.092296|0.076269|0.068039|0.066902|0.133560|0.124533|0.101398|0.100527|0.153111|0.173887|0.215674|0.301381|0.500000|
|1.418882|1.287174|1.217353|1.251529|1.371747|1.476143|1.667033|2.317532|1.651620|1.666018|1.881338|2.558858|2.917682|2.360685|2.914815|2.182420|1.900692|2.895162|3.176551|5.664109|4.494379|6.509779|6.521457|0.155905|6.761776|8.779431|17.546965|16.545112|1.995368|0.041242|0.034618|0.033085|0.038693|0.048626|0.047213|0.042032|0.047811|0.044632|0.043581|0.067122|0.061091|0.053346|0.051211|0.083477|0.082566|0.083182|0.080461|0.130561|0.188686|0.136861|0.218379|0.174012|0.500000|
|1.456031|1.317365|1.247813|1.287701|1.416351|1.522867|1.727360|2.446932|1.767123|1.816889|2.096625|2.908403|3.409584|2.738632|3.256325|2.362015|2.020465|3.472900|3.751429|6.786103|4.828101|6.734147|6.022076|0.132890|5.748479|8.664923|17.607285|16.642259|2.040463|0.042232|0.035317|0.034051|0.040088|0.050299|0.048392|0.044672|0.051201|0.048497|0.047629|0.072591|0.065322|0.055715|0.054948|0.097823|0.103914|0.099757|0.090027|0.167872|0.138359|0.126763|0.192966|0.218796|0.300976|0.500000|
|4.435365|6.056166|9.998321|7.778737|4.986048|4.150110|3.129564|3.869788|2.796092|2.411173|2.052810|2.512842|2.276364|1.718826|2.657970|2.073715|2.369741|1.565926|1.548059|1.939265|1.434600|2.748707|1.305091|0.036551|1.255972|1.178886|1.142140|2.166172|35.767828|0.101156|0.152038|0.230167|0.116859|0.079569|0.082117|0.089669|0.073053|0.067454|0.066469|0.052776|0.058771|0.065230|0.063055|0.043587|0.040406|0.041824|0.046385|0.037097|0.033579|0.036625|0.031148|0.033659|0.030255|0.030966|0.500000|
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