Version2.1
2020-12-18T17:58:30Z
10.1021/jm300687e
Gaussian16
RevisionB.01
PWARBURT
19-Nov-2020
#N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2)
DUDE CC(C)CN(CCC(=O)NCc1ccco1)c2c3ccc(cc3nc(n2)c4ccccc4)Cl C37384711
RHF
6-31G(d)
(6D,7F)
CC(C)CN(CCC(=O)NCc1ccco1)c2c3ccc(cc3nc(n2)c4ccccc4)Cl
C01[X(C26H27Cl1N4O2)]
174
C1
553
CC(CN(c1nc(nc2c1ccc(c2)Cl)c1ccccc1)CCC(=O)NCc1ccco1)C
CC(CN(c1nc(nc2c1ccc(c2)Cl)c1ccccc1)CCC(=O)NCc1ccco1)C
CC(C)CN(CCC(=O)NCc1occc1)c2nc(nc3cc(Cl)ccc23)c4ccccc4
InChIKey=RIZRMVGZHITYNF-UHFFFAOYSA-N
InChI=1S/C26H27ClN4O2/c1-18(2)17-31(13-12-24(32)28-16-21-9-6-14-33-21)26-22-11-10-20(27)15-23(22)29-25(30-26)19-7-4-3-5-8-19/h3-11,14-15,18H,12-13,16-17H2,1-2H3,(H,28,32)
InChI=1/C26H27ClN4O2/c1-18(2)17-31(13-12-24(32)28-16-21-9-6-14-33-21)26-22-11-10-20(27)15-23(22)29-25(30-26)19-7-4-3-5-8-19/h3-11,14-15,18H,12-13,16-17H2,1-2H3,(H,28,32)/f/h28H
CC(C)CN(CCC(=O)NCc1ccco1)c2c3ccc(cc3nc(n2)c4ccccc4)Cl
C01[X(C26H27Cl1N4O2)]
174
C01
553
CC(CN(c1nc(nc2c1ccc(c2)Cl)c1ccccc1)CCC(=O)NCc1ccco1)C
CC(CN([C]1[N][C]([N][C]2[C]1[CH]=[CH][C]([CH]2)Cl)[C]1[CH][CH][CH][CH][CH]1)CCC(=O)NCC1=[CH][CH]=CO1)C
CC(C)CN(CCC(=O)NCc1occc1)[C]2[N][C]([N][C]3[CH][C](Cl)C=C[C]23)[C]4[CH][CH][CH][CH][CH]4
InChIKey=RIZRMVGZHITYNF-UHFFFAOYSA-N
InChI=1S/C26H27ClN4O2/c1-18(2)17-31(13-12-24(32)28-16-21-9-6-14-33-21)26-22-11-10-20(27)15-23(22)29-25(30-26)19-7-4-3-5-8-19/h3-11,14-15,18H,12-13,16-17H2,1-2H3,(H,28,32)
InChI=1/C26H27ClN4O2/c1-18(2)17-31(13-12-24(32)28-16-21-9-6-14-33-21)26-22-11-10-20(27)15-23(22)29-25(30-26)19-7-4-3-5-8-19/h3-11,14-15,18H,12-13,16-17H2,1-2H3,(H,28,32)/f/h28H
3286.8323869712
-1827.3228366
1-A
23977.6586
122
431
553
|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|
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10.08283
5.0077 -3.7447 2.0597
6.5835
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-172.6801 -204.4058 -204.7197 -1.9847 6.2690 3.4980
|XX|YY|ZZ|XY|XZ|YZ|
21.2551 -10.4705 -10.7845 -1.9847 6.2690 3.4980
|XXX|YYY|ZZZ|XYY|XXY|XXZ|XZZ|YZZ|YYZ|XYZ|
247.2667 -58.8615 7.0680 21.1243 -109.9747 -34.4058 54.2103 -3.8769 -0.0118 2.6357
|XXXX|YYYY|ZZZZ|XXXY|XXXZ|YYYX|YYYZ|ZZZX|ZZZY|XXYY|XXZZ|YYZZ|XXYZ|YYXZ|ZZXY|
-20435.0460 -7482.5882 -1747.6115 -607.3306 184.4366 269.0719 45.1937 -110.4485 -25.4670 -4961.9807 -4073.6647 -1545.4069 71.1685 100.8076 -69.9459
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4.3670 12.4102 15.3170 23.1084 29.3921 37.4252 45.0723 49.0604 50.5847 61.0539 68.7996 91.6337 101.4793 113.1479 142.0440 154.4443 175.9954 188.9150 205.3955 230.2718 239.8383 253.5337 262.3293 268.1097 287.7517 295.8380 311.7910 323.2317 325.4154 340.5518 361.0056 391.3415 410.5834 422.5536 449.4578 456.7563 472.0878 487.7595 501.5175 522.9510 531.3598 552.1321 606.4316 628.7268 648.3825 658.8639 665.8453 679.4641 680.7649 697.6727 727.3298 741.0972 759.9384 763.5542 780.5667 801.7890 819.9390 842.6889 858.7180 871.1444 878.3474 888.6956 904.1215 936.4050 939.9189 962.9611 966.7516 971.3162 996.7992 999.8159 1008.0163 1011.5477 1015.7064 1020.5998 1030.7324 1046.2450 1062.1889 1071.8086 1072.1702 1082.1646 1091.6772 1098.1949 1105.4512 1116.4367 1122.1062 1129.4236 1132.2260 1140.7480 1166.7436 1183.7426 1187.9967 1193.6709 1212.7531 1215.8728 1224.2421 1237.3811 1246.2578 1278.1258 1286.7876 1289.7943 1299.5127 1305.8244 1329.8132 1338.9332 1342.5422 1346.3061 1350.1070 1367.0937 1383.7877 1401.9662 1437.4086 1442.1409 1461.6219 1464.3964 1470.0250 1478.8472 1488.0632 1507.2233 1527.4672 1534.1092 1545.0270 1556.2597 1557.2441 1569.0814 1577.7725 1585.2940 1599.0780 1618.0643 1623.1015 1634.5824 1637.6641 1647.8743 1648.8982 1649.7134 1656.6127 1660.1913 1667.8971 1672.7514 1702.9319 1716.6359 1765.4844 1776.0895 1800.2048 1808.2546 1820.6135 1822.8964 1947.4381 3188.8391 3195.0416 3202.8692 3210.0714 3223.8678 3231.8934 3237.2603 3247.2310 3257.7319 3264.6829 3267.5350 3280.0645 3282.6295 3330.0480 3355.5728 3359.7521 3369.1184 3383.2074 3404.6882 3419.7596 3421.6587 3422.1879 3436.3941 3437.1116 3449.4321 3483.5194 3884.4735
5.9375 5.6529 5.4666 6.2948 3.6762 4.6022 3.9879 4.6724 3.2322 5.1145 5.0929 5.0671 6.1387 3.6657 5.1387 4.4098 4.5969 5.3423 3.7644 2.7847 1.2518 1.2355 5.6204 6.2718 6.4562 6.6502 3.4897 2.9264 2.4167 4.0513 3.6947 3.5927 3.4956 3.8833 2.9663 2.9363 1.3493 2.5483 2.9823 3.0231 3.6969 3.9039 5.2363 5.3709 4.9845 2.9673 3.3156 5.1121 6.1208 4.2307 6.5244 5.7761 4.4592 2.6343 4.0309 2.2227 5.1648 2.4218 1.2910 2.0514 2.2941 2.4040 1.9798 2.6063 1.4195 1.2491 3.3899 6.2341 1.7052 4.7830 1.4179 1.5240 1.4909 2.5569 2.1090 1.5545 3.2224 1.5326 2.8796 2.1723 6.2169 1.3536 1.6313 1.3592 3.9125 2.9283 1.3342 2.9196 2.5187 1.8765 1.8818 2.9897 3.2455 2.8069 2.1765 2.3007 2.3414 1.7395 1.8917 1.6652 1.2080 1.6955 2.3294 1.8274 1.7398 1.9947 2.0448 1.7864 1.7305 1.3393 1.3393 1.7382 1.3535 1.8738 1.5021 1.7053 2.1968 1.3430 1.5744 3.5161 2.1003 2.4680 1.3795 1.3620 1.4779 2.8205 2.0857 2.3702 1.1136 1.0649 1.0646 1.7090 1.0561 1.0839 1.1215 1.1513 1.3621 2.3651 2.7195 3.0415 6.6545 7.3803 7.4673 5.4545 6.7746 6.3700 9.4099 1.0418 1.0416 1.0762 1.0731 1.0638 1.0834 1.0653 1.0983 1.1001 1.0986 1.1015 1.1018 1.1005 1.0933 1.0872 1.0913 1.0921 1.0970 1.0915 1.0934 1.0943 1.0932 1.0938 1.0941 1.0986 1.1064 1.0791
0.0001 0.0005 0.0008 0.0020 0.0019 0.0038 0.0048 0.0066 0.0049 0.0112 0.0142 0.0251 0.0372 0.0277 0.0611 0.0620 0.0839 0.1123 0.0936 0.0870 0.0424 0.0468 0.2279 0.2656 0.3150 0.3429 0.1999 0.1801 0.1508 0.2768 0.2837 0.3242 0.3472 0.4085 0.3531 0.3609 0.1772 0.3572 0.4420 0.4871 0.6150 0.7012 1.1346 1.2509 1.2346 0.7589 0.8661 1.3905 1.6713 1.2133 2.0335 1.8691 1.5173 0.9049 1.4470 0.8419 2.0458 1.0133 0.5609 0.9173 1.0428 1.1187 0.9535 1.3465 0.7389 0.6824 1.8667 3.4653 0.9983 2.8170 0.8488 0.9188 0.9062 1.5692 1.3201 1.0025 2.1421 1.0373 1.9504 1.4989 4.3653 0.9619 1.1745 0.9982 2.9025 2.2008 1.0077 2.2385 2.0201 1.5492 1.5648 2.5098 2.8124 2.4449 1.9219 2.0755 2.1426 1.6743 1.8455 1.6321 1.2020 1.7034 2.4270 1.9302 1.8475 2.1302 2.1961 1.9671 1.9524 1.5510 1.6303 2.1299 1.7037 2.3675 1.9125 2.1974 2.8660 1.7975 2.1642 4.8755 2.9540 3.5217 1.9710 1.9757 2.1677 4.1763 3.1423 3.6562 1.7286 1.6764 1.6822 2.7343 1.6919 1.7380 1.8133 1.8696 2.2325 3.8991 4.6465 5.2807 12.2206 13.7168 14.2579 10.5081 13.2302 12.4713 21.0263 6.2414 6.2646 6.5044 6.5152 6.5143 6.6672 6.5775 6.8232 6.8788 6.8989 6.9288 6.9844 6.9871 7.1431 7.2125 7.2577 7.3039 7.3982 7.4547 7.5339 7.5487 7.5429 7.6099 7.6158 7.7016 7.9108 9.5931
0.1390 0.5988 0.2972 4.5934 0.0260 0.2469 0.0698 1.7634 0.1556 0.9703 1.8501 1.0140 0.9361 1.8069 1.3489 2.3026 2.0894 3.3925 0.4336 0.7579 0.5329 0.1310 0.1702 12.4569 7.2476 2.5069 2.0443 7.5024 5.2329 0.4620 2.0816 11.2285 3.1116 9.2697 0.1195 0.0139 88.5499 9.2443 5.5213 27.1359 4.0965 13.7683 1.2495 2.1643 16.4670 6.3688 5.3683 1.0803 2.5444 6.5001 15.7098 2.9263 34.8538 8.8500 18.9997 50.9421 0.5143 2.0554 53.8001 45.2363 8.7908 6.6309 10.8545 2.6574 17.0687 0.0666 21.0034 6.5304 17.7639 56.0821 1.7263 27.8472 10.8500 19.7667 15.6762 0.8338 9.0701 4.4604 24.0753 16.9751 0.1543 1.0582 9.3985 0.0783 10.6225 14.7013 0.0702 25.9521 31.1822 23.9070 23.9662 23.3178 21.0084 105.3296 18.3478 21.4420 21.4937 11.1123 39.0800 0.2502 37.3260 3.7948 151.8594 6.2410 1.5782 56.3432 93.9639 6.8100 14.2766 17.7744 25.7596 103.8908 4.3939 31.7232 45.8422 16.7342 35.9512 9.3586 47.0833 205.7857 192.8822 3.7636 10.9652 29.8916 31.7919 0.3565 107.6622 13.9647 14.2108 1.4168 1.1204 111.0077 0.3634 11.4975 8.5004 25.0720 53.6885 6.1576 454.6212 195.5752 168.1991 407.4271 94.9363 102.1804 381.9082 2.2750 302.2174 26.4082 38.8733 22.3464 38.3594 24.2996 9.0595 24.8339 11.3823 34.4889 24.4116 63.9346 48.1364 97.0610 4.3667 0.0830 9.9884 24.9972 52.3793 0.3490 5.1329 0.0987 4.3512 9.6127 5.7617 1.2089 2.8846 46.0719
1.2102 5.0448 1.4785 1.3535 7.7940 3.1477 0.5232 1.6156 0.2926 0.8278 0.9215 1.4431 0.3049 2.4499 1.2444 4.9147 0.9784 0.9988 2.6017 3.3822 1.0269 0.4330 2.9424 1.7165 2.3728 2.1106 0.1849 1.5578 2.1447 1.1707 1.5204 0.8005 3.0774 1.8354 0.6440 0.1031 0.7860 1.1421 0.7554 0.4743 0.9471 1.4709 0.7895 1.3015 1.3942 1.2762 1.5323 0.6232 5.7679 3.0583 2.1015 7.7797 3.2336 0.9209 0.4323 3.4413 8.6099 6.1239 1.7561 1.0628 8.1080 4.2413 1.1939 2.8118 2.0815 2.5416 12.2312 5.7637 1.7034 19.4844 2.4100 0.5215 2.5961 2.6376 7.2981 6.8085 15.7770 2.8276 2.9015 1.4551 60.1409 1.2132 1.8705 0.1486 28.6555 5.0770 1.8210 3.3017 13.2489 2.2813 1.1218 6.9241 9.1046 7.3767 19.2010 6.4137 6.9781 3.1240 7.8943 16.9698 11.8344 9.1434 13.8922 18.9255 6.2836 6.2950 7.5731 21.5835 6.4475 3.4265 22.4426 7.2419 24.5536 46.8137 15.1996 102.4078 137.1994 21.4334 62.0966 354.5135 25.6644 11.5452 5.4487 4.1761 3.6197 39.0980 70.3259 6.7481 17.2511 10.1672 14.8415 7.4184 30.2369 11.0722 3.4341 12.8219 7.0167 83.6835 17.1560 74.7206 38.1031 213.4247 40.2928 665.5302 41.9121 30.7599 5.0877 4.0656 174.0161 72.0732 106.1412 23.1089 139.6072 93.0262 17.7034 24.6513 53.9957 96.9093 54.5566 40.9195 31.3121 57.9063 25.0337 128.2801 254.1865 78.4824 34.5646 59.9884 94.7241 137.4020 80.5006 75.6218 119.8283 28.5233
0.7494 0.7471 0.7499 0.7249 0.7487 0.7500 0.7495 0.7496 0.6941 0.6177 0.7148 0.7410 0.7429 0.7149 0.7056 0.7499 0.3239 0.5967 0.1732 0.7486 0.7122 0.3205 0.3796 0.7500 0.6292 0.2020 0.7379 0.2508 0.7494 0.2867 0.3255 0.7228 0.1612 0.3389 0.5907 0.6119 0.7278 0.7435 0.6832 0.3080 0.7497 0.4165 0.3448 0.6710 0.7359 0.7362 0.5318 0.7133 0.7494 0.5345 0.1858 0.3562 0.4721 0.7439 0.3066 0.6342 0.2000 0.1626 0.7409 0.7257 0.1732 0.1101 0.7331 0.7458 0.6034 0.7407 0.3421 0.7500 0.5428 0.1819 0.7413 0.6614 0.5593 0.3972 0.5375 0.7216 0.1655 0.7042 0.3575 0.3592 0.1597 0.7418 0.6627 0.4995 0.1632 0.1659 0.7459 0.3039 0.1965 0.5579 0.7165 0.1624 0.5835 0.6894 0.7500 0.2334 0.3725 0.5006 0.3425 0.3171 0.2455 0.5970 0.5984 0.7227 0.2529 0.4089 0.4536 0.3326 0.7156 0.7247 0.6300 0.2114 0.4569 0.2941 0.5968 0.1952 0.1525 0.5147 0.3055 0.2692 0.3365 0.5888 0.3604 0.5208 0.4264 0.2412 0.1508 0.5533 0.6502 0.7476 0.7477 0.7063 0.7316 0.7129 0.4244 0.4651 0.7215 0.3004 0.1953 0.2751 0.1296 0.6117 0.1866 0.3887 0.5201 0.3349 0.4596 0.2897 0.0317 0.2950 0.1362 0.0963 0.5023 0.0732 0.7232 0.2478 0.1889 0.6517 0.6949 0.7500 0.4116 0.7245 0.3313 0.7500 0.1602 0.4625 0.1891 0.2989 0.1827 0.1929 0.7493 0.2012 0.1603 0.1700
0.8568 0.8552 0.8571 0.8405 0.8563 0.8571 0.8568 0.8569 0.8194 0.7637 0.8337 0.8512 0.8525 0.8337 0.8274 0.8571 0.4893 0.7474 0.2953 0.8562 0.8319 0.4854 0.5503 0.8571 0.7724 0.3361 0.8492 0.4011 0.8568 0.4457 0.4911 0.8391 0.2776 0.5062 0.7427 0.7592 0.8425 0.8529 0.8118 0.4709 0.8570 0.5881 0.5128 0.8031 0.8478 0.8480 0.6944 0.8327 0.8567 0.6966 0.3133 0.5253 0.6414 0.8532 0.4694 0.7762 0.3333 0.2798 0.8511 0.8411 0.2953 0.1983 0.8460 0.8544 0.7526 0.8510 0.5098 0.8571 0.7036 0.3079 0.8514 0.7962 0.7174 0.5685 0.6992 0.8383 0.2840 0.8264 0.5267 0.5285 0.2755 0.8518 0.7971 0.6662 0.2805 0.2846 0.8545 0.4661 0.3284 0.7162 0.8349 0.2794 0.7370 0.8161 0.8571 0.3785 0.5428 0.6672 0.5102 0.4815 0.3942 0.7476 0.7487 0.8391 0.4038 0.5804 0.6241 0.4992 0.8342 0.8404 0.7730 0.3491 0.6272 0.4546 0.7475 0.3267 0.2646 0.6796 0.4680 0.4242 0.5035 0.7412 0.5298 0.6849 0.5978 0.3886 0.2621 0.7124 0.7880 0.8556 0.8557 0.8279 0.8450 0.8324 0.5959 0.6349 0.8382 0.4620 0.3268 0.4315 0.2294 0.7591 0.3145 0.5598 0.6843 0.5017 0.6297 0.4493 0.0614 0.4556 0.2398 0.1757 0.6687 0.1365 0.8394 0.3972 0.3177 0.7892 0.8200 0.8571 0.5832 0.8402 0.4977 0.8571 0.2762 0.6324 0.3181 0.4603 0.3090 0.3234 0.8567 0.3350 0.2763 0.2906
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 7 6 6 6 8 7 6 6 6 6 6 8 6 6 6 6 6 6 6 7 6 7 6 6 6 6 6 6 17 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 1
12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 34.96885 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 1.00783
11909.6287 34299.2106 42348.8247
0.99996 0.00937 0.00070 -0.00936 0.99983 -0.01595 -0.00085 0.01595 0.99987
1
0.00727 0.00253 0.00205
0.15154 0.05262 0.04262
6.28 17.86 22.04 33.25 42.29 53.85 64.85 70.59 72.78 87.84 98.99 131.84 146.01 162.79 204.37 222.21 253.22 271.81 295.52 331.31 345.07 364.78 377.43 385.75 414.01 425.64 448.60 465.06 468.20 489.98 519.41 563.05 590.74 607.96 646.67 657.17 679.23 701.78 721.57 752.41 764.51 794.39 872.52 904.60 932.88 947.96 958.00 977.60 979.47 1003.80 1046.47 1066.27 1093.38 1098.58 1123.06 1153.60 1179.71 1212.44 1235.50 1253.38 1263.75 1278.63 1300.83 1347.28 1352.33 1385.49 1390.94 1397.51 1434.17 1438.51 1450.31 1455.39 1461.38 1468.42 1482.99 1505.31 1528.25 1542.09 1542.61 1556.99 1570.68 1580.06 1590.50 1606.30 1614.46 1624.99 1629.02 1641.28 1678.68 1703.14 1709.26 1717.43 1744.88 1749.37 1761.41 1780.32 1793.09 1838.94 1851.40 1855.73 1869.71 1878.79 1913.30 1926.43 1931.62 1937.03 1942.50 1966.94 1990.96 2017.12 2068.11 2074.92 2102.95 2106.94 2115.04 2127.73 2140.99 2168.56 2197.68 2207.24 2222.95 2239.11 2240.53 2257.56 2270.06 2280.88 2300.72 2328.03 2335.28 2351.80 2356.23 2370.92 2372.40 2373.57 2383.50 2388.65 2399.73 2406.72 2450.14 2469.86 2540.14 2555.40 2590.09 2601.68 2619.46 2622.74 2801.93 4588.03 4596.95 4608.21 4618.58 4638.43 4649.97 4657.70 4672.04 4687.15 4697.15 4701.25 4719.28 4722.97 4791.20 4827.92 4833.93 4847.41 4867.68 4898.59 4920.27 4923.00 4923.77 4944.20 4945.24 4962.96 5012.01 5588.89
0.525842
0.554546
0.555490
0.458346
-1826.796994
-1826.768291
-1826.767346
-1826.864491
3.258259D-04
MUNgauss
RevisionA2.0
retrievium
18-Dec-2020
DUDE CC(C)CN(CCC(=O)NCc1ccco1)c2c3ccc(cc3nc(n2)c4ccccc4)Cl C37384711
RHF
6-31G(d)
(6D,10F)
C1
462.182254
|X|Y|Z|
131.501005 73.591582 35.628553
70.121597
27
|36.858105|
|12.438043|36.858105|
|7.552527|12.446190|36.858105|
|7.615562|12.426394|7.504352|36.858105|
|4.970056|7.574137|6.242757|12.998355|53.358707|
|3.873793|5.067677|4.658376|7.768698|17.657215|36.858105|
|3.595525|4.538484|4.742379|6.017795|10.405926|12.469771|36.858105|
|2.845857|3.353667|3.460686|4.199897|6.771178|7.566086|12.532164|36.858105|
|2.554392|2.982049|2.988891|3.719970|6.139039|6.820758|7.981179|15.846225|73.516695|
|2.634962|2.990743|3.173917|3.553327|5.300924|5.140847|7.852223|14.107916|15.114850|53.358707|
|2.202595|2.438159|2.559288|2.819085|4.159655|3.851825|5.016256|7.779501|12.202515|17.868023|36.858105|
|2.085818|2.242442|2.360632|2.531299|3.580931|3.154556|3.955773|5.193686|8.144609|10.708337|12.776046|36.858105|
|1.920437|2.022790|2.092389|2.271060|3.156876|2.729579|3.236698|4.039201|6.680906|7.251375|7.323371|14.223290|36.858105|
|1.843880|1.913209|2.000796|2.097228|2.863434|2.398132|2.827587|3.312071|5.388026|5.777669|5.140511|8.567797|13.212067|36.858105|
|1.945423|2.032586|2.174487|2.201528|3.008426|2.498787|3.036661|3.491757|5.487321|6.302879|5.342989|8.758252|8.597111|14.248523|36.858105|
|2.106933|2.253073|2.434764|2.474793|3.451780|2.936836|3.738954|4.494966|6.806132|8.976288|7.886986|14.104604|8.636604|8.628322|14.131184|73.516695|
|4.281788|6.084453|4.959607|7.860680|18.639667|7.842408|5.189894|3.925044|6.792359|4.292280|2.609161|2.261635|2.026806|1.846087|1.921978|3.865003|36.858105|
|3.323938|4.421434|4.070447|5.082619|10.531681|6.216416|4.626664|3.733854|6.706572|4.086982|2.545107|2.177342|1.942550|1.765412|1.841137|3.718553|13.230234|36.858105|
|2.959932|3.866128|3.900756|4.338777|8.705712|5.999818|5.061558|4.165191|7.481725|4.517678|2.806943|2.350109|2.058615|1.863395|1.963376|4.028939|7.505187|13.469215|36.858105|
|2.467035|3.070467|3.140119|3.316789|5.981483|4.303138|3.888649|3.478008|6.428183|3.930759|2.548560|2.150429|1.899169|1.726590|1.813920|3.692825|5.061129|7.893820|14.015352|36.858105|
|2.279017|2.765201|2.741799|2.941614|5.062551|3.550703|3.129626|2.851170|5.328225|3.294300|2.181931|1.878651|1.690490|1.545893|1.608338|3.219927|4.525760|6.869581|7.973415|13.492306|36.858105|
|2.417875|2.927985|2.786886|3.116042|5.301719|3.561155|3.001792|2.688732|5.001325|3.105488|2.046692|1.782563|1.620266|1.485285|1.536217|3.049099|5.130218|7.824852|6.830819|7.874737|14.048141|36.858105|
|2.903811|3.634739|3.307969|3.963617|7.027895|4.394989|3.470847|2.979044|5.460289|3.379397|2.176109|1.894172|1.718311|1.572084|1.626519|3.235483|7.942999|13.611928|7.853813|6.816965|7.960319|13.445357|36.858105|
|2.981411|3.606955|3.129525|3.863332|6.276321|3.842516|3.038908|2.626963|4.782016|3.038428|1.971198|1.746473|1.605406|1.478059|1.520002|2.986315|6.949573|7.902620|5.176183|4.595372|5.277988|8.018428|14.077746|53.358707|
|3.585388|4.356100|3.518690|4.723354|7.282256|4.183129|3.217628|2.715099|4.853711|3.144223|2.014385|1.798557|1.657706|1.529555|1.571888|3.079241|8.323711|7.082538|4.648786|3.893466|4.098360|5.373352|8.437582|20.056029|36.858105|
|4.515290|5.950992|4.435879|7.089856|11.205243|5.569820|4.012396|3.212040|5.606325|3.653616|2.277126|2.021647|1.846513|1.697439|1.752627|3.461585|14.699725|8.025684|5.160588|3.983062|3.861545|4.631864|7.064801|11.025487|14.074230|53.358707|
|3.405924|3.797136|3.047972|3.941813|5.486233|3.311943|2.666740|2.308305|4.115950|2.743773|1.784805|1.622942|1.516561|1.411202|1.441944|2.786348|5.263450|4.559296|3.410755|3.001190|3.186139|3.999189|5.250090|10.848311|12.790679|10.730440|36.858105|
|2.762740|3.008699|2.540906|3.069417|4.323855|2.732569|2.273000|2.018692|3.634873|2.428703|1.606521|1.467708|1.379478|1.287999|1.312485|2.521923|3.984445|3.777654|2.974931|2.745549|3.024271|3.829733|4.587969|9.260726|7.627730|7.025354|13.672776|36.858105|
|2.537022|2.649866|2.256987|2.665178|3.634463|2.344115|1.996236|1.795372|3.222333|2.193156|1.463747|1.352844|1.282388|1.204757|1.223460|2.330095|3.170515|2.980877|2.453352|2.289773|2.486871|3.011585|3.442132|6.199985|5.052173|5.373275|7.907268|13.780661|36.858105|
|2.719097|2.734903|2.287701|2.730482|3.581362|2.306482|1.975549|1.772458|3.153368|2.181447|1.453039|1.354267|1.289696|1.216433|1.233345|2.336867|3.021025|2.735815|2.276345|2.094540|2.214532|2.606347|3.007822|5.172587|4.456459|5.155855|6.839329|7.936587|13.735935|36.858105|
|3.321917|3.282536|2.633951|3.286409|4.157514|2.621049|2.215486|1.957013|3.449010|2.399003|1.579655|1.472194|1.398605|1.317702|1.337946|2.540598|3.473192|2.989486|2.452159|2.199642|2.273981|2.655909|3.170328|5.402431|5.041242|6.188298|7.906042|6.879877|7.946525|13.759017|36.858105|
|3.887274|4.056608|3.121817|4.157834|5.301360|3.204612|2.615369|2.258232|3.971732|2.718815|1.764266|1.624382|1.527838|1.429320|1.457386|2.796196|4.646242|3.797424|2.974102|2.594855|2.663538|3.168057|3.998669|7.091105|7.599663|9.243401|13.695154|7.940183|6.880882|7.937007|13.755690|36.858105|
|1.895525|2.222680|2.235556|2.323167|3.795885|2.732092|2.518385|2.385564|4.477989|2.847481|1.942845|1.693963|1.538010|1.415558|1.468828|2.913356|3.201923|4.220997|4.793498|7.027376|10.945859|7.089022|4.756433|5.124565|3.063385|3.907569|2.559858|2.526144|2.153920|1.920774|1.934243|2.190653|448.794386|
|17.553132|8.777800|6.921568|5.511354|5.560336|3.264237|3.104858|2.516195|4.042689|3.218408|2.008007|1.917383|1.771433|1.719055|1.821389|3.479237|3.689485|3.004547|2.715580|2.312915|2.156032|2.280386|2.686925|3.765710|3.255353|5.298518|3.154655|2.628266|2.447269|2.624209|3.145146|3.562323|14.596012|0.500000|
|17.545583|8.750753|5.482097|6.933258|6.326014|3.685144|3.288488|2.673014|4.358030|3.343064|2.083352|1.972282|1.837206|1.755325|1.827493|3.495689|4.214536|3.237841|2.811237|2.362829|2.223574|2.399957|2.903051|4.188294|3.809146|6.468784|3.782887|3.013468|2.799962|3.086151|3.926435|4.595606|14.875695|0.301860|0.500000|
|17.513349|8.753311|6.799765|6.890105|6.228615|3.819412|3.706931|2.963171|4.649338|3.819133|2.331886|2.241335|2.067918|1.998891|2.114988|4.051699|3.783438|3.009073|2.758872|2.316063|2.119935|2.214473|2.613146|3.592844|3.097133|5.230036|2.934815|2.433376|2.256021|2.413284|2.897096|3.307012|14.317162|0.301827|0.301274|0.500000|
|8.941810|17.566276|8.915336|8.913316|9.490223|4.580246|3.951689|3.019538|4.915204|3.636669|2.224922|2.036606|1.847505|1.745335|1.844015|3.619595|6.723396|4.872711|4.047763|3.231738|2.980665|3.243010|4.127265|5.738287|5.251665|9.730806|4.518216|3.489901|3.010369|3.073630|3.703484|4.735667|18.993459|0.213226|0.214147|0.173670|0.500000|
|5.483135|8.757400|17.578046|6.830690|9.470752|5.137161|5.310426|3.765541|5.779375|4.589652|2.697549|2.431671|2.126301|2.013553|2.196200|4.442045|5.550067|4.779610|4.792404|3.741621|3.153665|3.138970|3.719357|4.584226|3.668704|6.252397|3.056937|2.568059|2.244889|2.228982|2.523755|3.013885|20.223390|0.140981|0.122489|0.139324|0.212143|0.500000|
|6.888062|8.788144|17.545531|5.470303|6.432715|3.701119|3.762484|2.913911|4.564230|3.717138|2.267166|2.122842|1.901831|1.841697|2.002652|3.927726|4.116823|3.541730|3.406626|2.854733|2.547714|2.594553|3.012600|3.942030|3.217233|5.247969|2.871265|2.441261|2.197072|2.232716|2.544877|2.949714|17.026006|0.207447|0.140947|0.168009|0.214076|0.301757|0.500000|
|6.853556|8.765522|17.505530|6.765455|7.518441|4.572973|5.054746|3.698313|5.505983|4.776609|2.781651|2.603947|2.292125|2.208997|2.430535|4.851197|4.228726|3.541891|3.498577|2.865238|2.488418|2.494113|2.900688|3.727235|3.044717|5.143608|2.683656|2.269026|2.043297|2.084772|2.390023|2.777246|16.593181|0.170949|0.139603|0.202101|0.173491|0.301046|0.301842|0.500000|
|6.897300|8.923243|6.987127|17.587511|12.590776|7.760275|6.971548|4.756738|7.132970|5.599547|3.162548|2.864194|2.551542|2.353430|2.482040|4.989825|5.775843|4.218922|3.865281|3.032438|2.659558|2.746154|3.349615|4.380679|3.763837|6.992725|3.252105|2.631897|2.336556|2.406191|2.849018|3.444668|17.268716|0.141113|0.168449|0.204776|0.175227|0.172856|0.141812|0.206531|0.500000|
|7.164761|8.815719|5.485393|17.575769|12.323360|6.498340|4.864426|3.715827|6.092900|4.317661|2.597277|2.354806|2.155377|1.987401|2.052865|4.042399|7.187356|4.667600|3.838705|3.029650|2.779748|3.019412|3.865383|5.407355|5.105565|10.560091|4.451265|3.359635|2.931664|3.066163|3.823009|4.964559|17.797791|0.144000|0.215548|0.177343|0.210342|0.139050|0.122973|0.140396|0.303671|0.500000|
|3.830184|4.671526|4.086620|7.381170|12.359305|17.517248|8.856682|6.857518|11.533369|6.696891|3.797770|3.175807|2.815500|2.452365|2.503942|5.149400|6.411156|4.995658|4.609323|3.559088|3.085658|3.163139|3.862161|4.849173|3.977777|7.111538|3.283647|2.703178|2.351765|2.348698|2.696943|3.271968|19.650201|0.088360|0.104677|0.107087|0.116290|0.117844|0.092371|0.113993|0.218029|0.195226|0.500000|
|3.263572|4.151461|3.893545|5.683924|12.358311|17.701684|8.924212|7.098487|13.398148|6.460395|3.757900|3.008975|2.614078|2.277209|2.354120|4.915114|7.620634|7.177612|7.279116|5.132222|4.141899|4.081483|4.973689|5.621485|4.262324|7.251931|3.300275|2.776804|2.355284|2.272320|2.530695|3.079506|24.916645|0.078720|0.087677|0.088195|0.110132|0.121785|0.089616|0.104271|0.150853|0.142150|0.305919|0.500000|
|3.442534|4.449328|5.033108|5.349149|9.542953|8.835889|17.534124|8.986181|11.596160|9.080327|4.576636|3.651214|2.970797|2.651494|2.904638|6.372455|5.089843|4.861624|5.807883|4.414247|3.397392|3.161861|3.588884|4.160887|3.160872|5.252664|2.595435|2.235243|1.955466|1.917164|2.127923|2.505257|21.825609|0.084874|0.086026|0.096689|0.110195|0.169663|0.111713|0.145730|0.160294|0.118635|0.173501|0.210750|0.500000|
|4.045446|4.972062|5.308676|6.499690|9.316923|8.771419|17.574062|8.876665|10.587749|10.173118|4.771357|4.047474|3.336058|2.982927|3.246594|7.034263|4.608568|3.945268|4.126721|3.276884|2.726131|2.658125|3.072795|3.785711|3.009250|5.130521|2.564268|2.180139|1.940295|1.948660|2.206082|2.581196|17.973819|0.095582|0.100222|0.121041|0.113839|0.154737|0.114492|0.170850|0.241341|0.142056|0.211421|0.173849|0.304611|0.500000|
|2.783985|3.141775|3.444721|3.633041|5.236651|4.779335|7.494065|9.371307|10.871615|26.070200|9.048899|7.377444|5.054895|4.347192|5.060022|13.170030|3.072441|2.890139|3.178003|2.756978|2.315542|2.190453|2.391151|2.944963|2.254822|3.582837|1.979031|1.748643|1.584928|1.584144|1.747769|1.975958|16.098159|0.069692|0.070826|0.083592|0.076720|0.100707|0.082198|0.109430|0.119364|0.088426|0.125276|0.118266|0.187561|0.228577|0.500000|
|2.125658|2.343356|2.398136|2.750134|4.081075|3.843978|4.665396|7.326406|13.576241|12.560626|17.661528|9.018033|6.865682|4.628726|4.443544|10.227972|2.600972|2.539976|2.763120|2.520197|2.184941|2.063040|2.192205|2.714450|2.034733|3.112300|1.807030|1.630139|1.485741|1.473168|1.598542|1.783351|15.635384|0.053615|0.056637|0.062118|0.059915|0.069928|0.059093|0.071309|0.084728|0.071792|0.108680|0.106730|0.114958|0.120278|0.181045|0.500000|
|2.056742|2.292640|2.438733|2.599288|3.898919|3.527207|4.518145|6.553266|10.920740|12.377430|17.531533|8.973475|5.860850|4.506401|4.836154|12.372329|2.496565|2.499319|2.822922|2.622554|2.229082|2.055849|2.149250|2.623612|1.943057|2.953561|1.716276|1.557143|1.416641|1.396882|1.507118|1.680311|16.154588|0.052649|0.053927|0.059804|0.058840|0.072444|0.060630|0.072765|0.079229|0.066300|0.093764|0.098352|0.122209|0.116124|0.200522|0.302766|0.500000|
|1.844149|1.937116|1.971116|2.192722|3.056554|2.655683|3.045175|3.815386|6.605887|6.401571|6.328984|8.840541|17.797867|8.434478|5.853712|10.456533|1.984377|1.903619|2.000599|1.852674|1.663712|1.602083|1.696968|2.167565|1.642853|2.477205|1.508826|1.376414|1.282002|1.289174|1.395075|1.519757|12.180853|0.047145|0.049534|0.054845|0.049476|0.055591|0.049807|0.059290|0.067827|0.058604|0.077343|0.071460|0.076871|0.085795|0.119258|0.190491|0.143219|0.500000|
|1.720355|1.763970|1.831413|1.918241|2.597504|2.145093|2.467531|2.822205|4.670743|4.702294|4.032537|5.841047|8.432292|17.802521|8.838804|10.449682|1.692351|1.617364|1.692997|1.577025|1.426113|1.377007|1.454342|1.874756|1.426378|2.140558|1.327401|1.217105|1.145172|1.159481|1.252839|1.349187|10.545173|0.044781|0.045764|0.051771|0.044915|0.050870|0.047223|0.055855|0.059346|0.050976|0.061289|0.056745|0.064468|0.072266|0.097913|0.105201|0.100824|0.192810|0.500000|
|1.905674|1.976466|2.139093|2.099908|2.845730|2.313001|2.789897|3.084890|4.845116|5.362308|4.280978|6.026767|5.813508|8.619595|17.837678|16.474065|1.826378|1.750935|1.865251|1.729604|1.538296|1.470007|1.553204|1.980921|1.505217|2.277406|1.386349|1.264902|1.182553|1.193664|1.293209|1.403580|11.324901|0.050050|0.049465|0.057640|0.049850|0.059727|0.055342|0.066679|0.065436|0.054248|0.063866|0.060393|0.075472|0.083531|0.122649|0.100567|0.112083|0.123062|0.195246|0.500000|
|3.107026|4.114104|4.360792|4.685652|9.600172|7.076839|6.577045|5.090593|8.704361|5.388852|3.225822|2.654619|2.277974|2.054834|2.190858|4.577073|6.815777|8.831015|17.790834|9.065660|5.667233|4.936384|5.610899|5.692033|4.006636|6.370609|3.063496|2.655894|2.240506|2.121277|2.309897|2.774960|31.779876|0.078590|0.080222|0.081941|0.114210|0.154473|0.102758|0.111127|0.120243|0.110210|0.141091|0.227440|0.233689|0.141387|0.105914|0.086401|0.090204|0.060790|0.051336|0.057676|0.500000|
|2.271426|2.777909|2.922861|2.969230|5.173146|3.861867|3.728683|3.457867|6.379432|3.991053|2.627576|2.206831|1.935243|1.761353|1.861095|3.809155|4.092345|5.613128|8.972682|17.760264|8.838851|5.639761|4.926752|4.970415|3.203518|4.505357|2.571488|2.379120|2.029282|1.874946|1.963187|2.275139|54.001424|0.059584|0.060000|0.060056|0.079646|0.096532|0.074466|0.075626|0.077482|0.074991|0.089708|0.125301|0.120303|0.087588|0.077781|0.071499|0.076793|0.052185|0.044560|0.049362|0.217086|0.500000|
|2.216007|2.611491|2.470104|2.740483|4.463339|3.018312|2.582368|2.351727|4.379396|2.763816|1.846404|1.627211|1.493642|1.375710|1.416485|2.785610|4.191024|5.609945|4.934510|5.600557|8.949959|17.772326|8.870296|10.046952|4.925681|5.504661|3.939301|4.019983|3.168956|2.669824|2.644315|3.082006|53.538709|0.058598|0.061746|0.056406|0.080515|0.075660|0.064871|0.061794|0.067599|0.075126|0.076593|0.094049|0.074660|0.064654|0.054281|0.051888|0.051491|0.041181|0.035638|0.037744|0.107320|0.123791|0.500000|
|2.517408|2.790327|2.424402|2.857027|4.159570|2.667891|2.232540|1.998827|3.629197|2.398699|1.594732|1.449176|1.358490|1.265932|1.291233|2.487989|3.879592|3.921182|3.108960|2.947394|3.371928|4.432605|5.090934|10.551447|7.096647|6.449167|8.935186|17.768796|8.920221|5.645872|4.959605|5.656285|22.701355|0.066819|0.074555|0.062231|0.089267|0.069309|0.064746|0.060230|0.068667|0.084698|0.072280|0.076884|0.061630|0.058782|0.047791|0.044978|0.043249|0.037657|0.033188|0.034554|0.075555|0.070399|0.136011|0.500000|
|2.228332|2.321922|2.024261|2.329084|3.204209|2.102769|1.816906|1.653290|2.979338|2.031964|1.367824|1.267265|1.204606|1.133928|1.150143|2.184201|2.758169|2.666760|2.247137|2.139930|2.350503|2.821016|3.098071|5.383442|4.116547|4.487209|5.634271|8.938245|17.715648|8.906509|5.648083|4.955960|16.755372|0.060243|0.067350|0.055705|0.072390|0.056227|0.055080|0.051271|0.057556|0.070072|0.058421|0.059139|0.049691|0.048967|0.040757|0.038591|0.036939|0.033492|0.030013|0.030922|0.057009|0.053130|0.084276|0.215228|0.500000|
|2.456998|2.425411|2.063962|2.407560|3.140014|2.054953|1.789365|1.621779|2.884004|2.015471|1.352380|1.269343|1.215424|1.151378|1.164840|2.194133|2.587262|2.369782|2.017188|1.874711|1.976231|2.286050|2.576417|4.275587|3.560548|4.265193|4.933992|5.644966|8.904564|17.710876|8.912211|5.644126|14.012337|0.066604|0.077039|0.061406|0.074436|0.055653|0.056387|0.052801|0.059997|0.074398|0.058313|0.056183|0.048263|0.049277|0.040726|0.038087|0.036141|0.033788|0.030613|0.031384|0.052651|0.047132|0.065288|0.124116|0.214637|0.500000|
|3.405658|3.207060|2.571527|3.184795|3.903513|2.489764|2.137397|1.895298|3.317595|2.347811|1.548503|1.456489|1.391086|1.316982|1.334876|2.519421|3.132402|2.678150|2.245804|2.013383|2.052739|2.346235|2.762943|4.510134|4.106780|5.384456|5.634359|4.955325|5.646942|8.913420|17.714171|8.928965|14.157569|0.089921|0.114758|0.083340|0.097821|0.067304|0.069341|0.065682|0.078185|0.103618|0.071970|0.065904|0.056691|0.059940|0.047734|0.043472|0.040859|0.038541|0.034902|0.035906|0.059714|0.050475|0.064433|0.107632|0.124103|0.214752|0.500000|
|4.821229|4.968384|3.587772|5.194536|6.184016|3.629881|2.924533|2.475723|4.295240|2.971674|1.902842|1.753024|1.643877|1.536664|1.569995|3.019701|5.195649|3.955632|3.104199|2.640408|2.633522|3.060024|3.911361|6.507588|7.042554|10.580297|8.933170|5.653256|4.960591|5.650281|8.924337|17.774957|17.239282|0.117320|0.166992|0.111431|0.159087|0.094052|0.092286|0.088523|0.116033|0.184942|0.104362|0.093776|0.076733|0.081328|0.060269|0.053262|0.049922|0.045287|0.040175|0.041946|0.082165|0.064543|0.080607|0.124467|0.107651|0.124192|0.215434|0.500000|
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