Version2.2 2021-02-18T22:44:53Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 06-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC[C@@H](C)N1C(=O)c2cc3c(n2C[C@@]1(C)C(=O)NC4CCCCCCC4)cco3 C15675578 RHF 6-31G(d) (6D,7F) CC[C@@H](C)N1C(=O)c2cc3c(n2C[C@@]1(C)C(=O)NC4CCCCCCC4)cco3 C01[X(C23H33N3O3)] 180 C1 501 CC[C@H](N1C(=O)c2cc3c(n2C[C@@]1(C)C(=O)NC1CCCCCCC1)cco3)C CC[C@H](N1C(=O)c2cc3c(n2C[C@@]1(C)C(=O)NC1CCCCCCC1)cco3)C CC[C@@H](C)N1C(=O)c2cc3occc3n2C[C@@]1(C)C(=O)NC4CCCCCCC4 InChIKey=LACWXVBXDHILHN-MWTRTKDXSA-N InChI=1S/C23H33N3O3/c1-4-16(2)26-21(27)19-14-20-18(12-13-29-20)25(19)15-23(26,3)22(28)24-17-10-8-6-5-7-9-11-17/h12-14,16-17H,4-11,15H2,1-3H3,(H,24,28)/t16-,23+/m1/s1 InChI=1/C23H33N3O3/c1-4-16(2)26-21(27)19-14-20-18(12-13-29-20)25(19)15-23(26,3)22(28)24-17-10-8-6-5-7-9-11-17/h12-14,16-17H,4-11,15H2,1-3H3,(H,24,28)/t16-,23+/m1/s1/f/h24H CC[C@@H](C)N1C(=O)c2cc3c(n2C[C@@]1(C)C(=O)NC4CCCCCCC4)cco3 C01[X(C23H33N3O3)] 180 C01 501 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1495.1426 1509.2619 1513.0638 1516.5256 1531.4871 1534.3209 1540.1096 1545.3280 1556.6710 1560.2133 1563.4230 1564.8561 1566.9194 1572.1676 1576.9310 1585.5613 1619.6133 1628.6570 1635.0848 1637.3708 1640.8828 1643.2601 1645.3779 1646.4598 1646.5951 1649.6507 1651.9224 1656.0236 1656.9737 1666.1595 1669.0816 1673.1111 1703.4215 1717.1304 1719.3928 1767.4050 1906.5059 1916.3016 3175.9430 3179.8047 3187.2845 3190.0341 3194.0028 3197.2052 3200.3582 3211.1140 3212.0524 3212.5145 3220.3155 3221.6942 3224.1563 3228.9583 3231.7062 3237.5214 3238.8490 3247.1000 3256.7216 3267.4786 3267.7246 3277.0616 3296.5905 3307.7058 3321.4232 3324.0651 3326.9252 3346.7396 3351.8472 3449.3446 3469.0370 3480.6081 3930.1048 3.4993 5.3033 4.2519 3.9695 7.0479 3.8592 4.0469 4.5897 6.3284 2.8501 2.1641 6.7587 3.8469 5.0872 2.6823 2.6940 2.2090 1.5929 1.4648 3.3650 3.5901 2.8516 2.3120 2.9211 1.3795 2.1449 2.1518 4.4909 1.5713 3.3228 3.3958 2.6208 3.2149 2.7114 3.5270 4.8246 3.0668 3.0129 4.0646 1.6156 3.0565 4.3719 1.1826 4.2842 3.7186 5.4338 3.7707 2.3432 4.4002 2.4611 3.3959 4.4216 1.9779 2.3247 1.8960 1.5852 2.4335 4.2210 2.0057 2.0558 2.3015 2.3418 1.5211 1.6703 3.0054 3.0108 1.3673 3.0902 2.0887 2.0219 1.6914 1.5548 2.1319 1.5083 2.2018 2.1516 1.9859 1.6915 2.3299 2.4525 2.0953 2.7984 2.5598 2.3396 3.4306 1.2434 2.3933 1.6861 2.1736 1.9186 2.3524 2.2719 2.2623 2.4100 1.2437 2.6151 2.2937 1.4688 1.3213 1.4115 1.3084 1.6492 1.1646 1.4087 1.4185 1.8361 1.2565 1.8521 1.3324 1.2341 1.3350 2.4047 1.3231 1.3893 1.4144 1.4824 1.5063 1.3327 1.4670 1.4592 2.1944 1.8233 1.5619 1.8875 1.4094 5.2794 1.0853 1.0885 1.0612 1.0641 1.0907 1.0665 1.0919 1.0673 1.0948 1.0571 1.0936 1.1417 1.0582 1.0742 1.0879 4.8403 8.5307 2.1276 7.0621 9.8552 11.4622 1.0659 1.0661 1.0659 1.0713 1.0733 1.0654 1.0432 1.0841 1.0400 1.0733 1.0714 1.0973 1.0828 1.0972 1.0973 1.0957 1.0395 1.1006 1.0989 1.1012 1.0951 1.1009 1.1004 1.1035 1.0901 1.0858 1.1015 1.0873 1.0954 1.0932 1.0988 1.1053 1.0774 0.0005 0.0011 0.0028 0.0057 0.0145 0.0097 0.0157 0.0220 0.0580 0.0311 0.0250 0.0999 0.0710 0.1045 0.0730 0.0738 0.0669 0.0596 0.0606 0.1494 0.1623 0.1318 0.1263 0.1670 0.0822 0.1480 0.1619 0.3613 0.1320 0.2906 0.3259 0.2589 0.3225 0.3331 0.4494 0.6405 0.4463 0.4594 0.6516 0.2633 0.5563 0.8480 0.2476 1.0047 0.9014 1.3980 1.0479 0.7765 1.4983 0.8570 1.2894 1.7769 0.8116 0.9754 0.8099 0.6810 1.0501 1.9013 0.9263 0.9637 1.1031 1.1540 0.8095 0.9094 1.6888 1.7273 0.7890 1.8426 1.2787 1.2771 1.1171 1.0297 1.4819 1.0617 1.5588 1.5348 1.4370 1.2334 1.8101 1.9531 1.7302 2.3368 2.1630 2.0032 2.9590 1.0847 2.1014 1.5241 1.9996 1.8093 2.2438 2.2093 2.2530 2.4407 1.3125 2.7625 2.4392 1.6262 1.4706 1.5882 1.5053 1.9388 1.3882 1.7091 1.7522 2.2873 1.5888 2.3587 1.7363 1.6254 1.7917 3.2436 1.7928 1.9198 1.9618 2.0717 2.1194 1.9027 2.1041 2.1015 3.1660 2.6375 2.2745 2.7655 2.0877 8.1594 1.6962 1.7146 1.6762 1.6880 1.7352 1.7012 1.7440 1.7050 1.7553 1.6995 1.7671 1.8468 1.7309 1.7631 1.7943 8.2750 14.8197 3.7059 12.9974 21.1054 24.7997 6.3346 6.3513 6.3800 6.4233 6.4514 6.4167 6.2951 6.5864 6.3217 6.5261 6.5460 6.7105 6.6319 6.7403 6.7520 6.7665 6.4248 6.8369 6.8672 6.9267 6.8894 6.9656 7.0457 7.1137 7.0854 7.0690 7.1834 7.1751 7.2509 7.6638 7.7909 7.8893 9.8045 0.2348 0.1502 1.8390 0.2039 4.0542 0.7743 1.0180 2.2739 0.9474 0.1363 0.2074 1.0375 0.6254 2.6662 1.0429 0.1978 0.0072 0.0631 0.5446 0.8269 5.3610 0.2990 1.2669 0.9230 1.2891 4.1374 3.7889 6.7317 4.7536 2.1765 6.9813 3.1053 9.0705 2.1542 8.6211 39.7911 2.7347 8.3188 5.8918 1.9048 1.9159 22.9291 71.9369 8.3111 12.5888 7.9961 4.0604 4.9124 15.6453 3.7089 2.8727 18.0714 0.0499 80.5286 3.7496 12.8445 3.9320 6.1983 6.6303 0.1429 0.4439 0.4142 15.3113 0.9425 6.8147 6.3666 0.7017 7.8069 3.5618 2.0236 7.8356 0.6607 1.4938 2.5734 1.0523 7.4686 4.0848 0.3524 23.8595 23.1266 1.2789 14.6802 9.7328 12.6690 19.5044 2.4063 7.8927 1.6508 23.0976 32.4815 3.8827 68.4969 9.5869 107.1158 2.3755 11.5755 11.7535 16.6910 6.0257 14.8585 63.2724 81.3363 1.0515 26.2407 32.1131 148.2399 36.8676 90.1707 25.4301 5.7889 6.8996 100.1331 15.0364 1.7754 2.8302 1.0200 0.3963 27.4131 1.0480 2.5424 29.5529 87.6313 42.8743 102.0299 45.0629 205.5866 0.1331 3.3455 5.1918 3.7712 5.1159 7.9203 1.8365 3.1661 4.9628 11.8366 5.9980 16.7203 12.1775 12.6951 3.9296 51.7868 9.3085 354.5556 49.2332 274.4360 419.7316 29.9471 15.0146 55.5221 38.9264 16.6734 7.4252 28.5051 95.8524 24.1352 38.3706 51.8338 2.4925 23.7967 26.1954 61.0957 97.4906 22.9325 84.5803 39.5057 21.2668 114.9810 74.0864 7.6556 24.0187 1.2247 12.8998 13.7089 45.7996 4.5024 3.2865 0.7347 2.6035 85.2918 0.4250 2.2747 2.1488 0.5614 2.1801 0.6620 0.4494 2.2516 0.9514 0.1913 0.0900 2.2561 0.2410 0.4582 0.0819 0.5077 0.1005 0.6558 0.2981 0.3549 0.5181 0.4012 0.1772 0.4801 0.2370 0.6523 0.5286 2.4247 0.5336 0.6954 0.6524 0.4622 0.8543 1.0083 6.7383 2.2439 1.4433 1.6878 1.8710 0.4224 0.5177 5.5918 1.6283 0.7248 6.3669 3.2730 2.2234 8.2339 27.9462 10.7341 1.2823 5.1174 4.8574 3.4199 2.4814 0.8349 2.4697 0.3367 4.2712 0.5133 3.3908 4.5012 8.6297 1.2114 2.7654 7.4087 2.9642 6.2112 4.2690 8.9633 2.4641 0.7595 6.1060 1.9298 7.3737 1.6401 4.1621 2.4721 9.8989 3.9135 11.4175 1.8436 3.7178 5.9224 10.8751 1.9327 6.0806 1.9149 5.7386 9.7440 1.7717 10.0881 6.8660 24.7983 5.8460 45.3969 1.9863 3.1945 2.2062 3.6282 8.1003 16.3562 15.3906 6.0409 5.0104 4.1806 13.8587 8.2014 6.9962 5.6335 0.8646 12.8373 2.6239 3.6599 2.4057 4.3246 0.5357 9.6377 1.9716 18.3185 132.5646 33.2539 13.8107 35.6774 59.0406 603.4113 12.8216 19.8587 25.3222 21.6014 4.5421 8.0725 22.0916 11.5661 0.8536 17.6624 3.2160 17.1172 9.2888 18.5720 7.2675 0.9544 62.1923 1.1272 144.5909 2.7129 114.3293 47.3883 22.5933 74.6870 55.0012 80.6046 52.5141 126.3639 80.7611 138.6710 8.2363 82.7477 78.2005 234.4801 53.0791 76.8819 151.5439 136.8705 6.2181 114.4456 96.7602 37.5573 38.7689 43.3905 55.5787 60.9226 19.7752 24.0212 25.2888 45.7915 63.6897 68.0946 167.8117 46.1803 0.7332 0.7240 0.7382 0.7499 0.7295 0.7256 0.6958 0.7209 0.7350 0.6608 0.5168 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12.00000 12.00000 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 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 9331.6185 13366.0652 18043.0810 0.99869 -0.04986 0.01118 0.04981 0.99875 0.00413 -0.01138 -0.00357 0.99993 1 0.00928 0.00648 0.00480 0.19340 0.13502 0.10002 23.29 26.68 48.09 71.09 85.10 94.07 116.64 129.71 179.38 195.74 201.39 227.84 254.65 268.64 309.30 310.31 326.11 362.63 381.39 394.96 398.55 402.95 438.06 448.14 457.61 492.44 514.09 531.64 543.26 554.29 580.70 589.18 593.69 656.95 669.08 682.96 715.06 731.96 750.50 756.75 799.69 825.55 857.59 907.72 922.84 950.76 988.12 1079.03 1093.77 1106.06 1155.00 1188.26 1200.73 1214.12 1225.11 1228.60 1231.29 1258.00 1273.82 1283.36 1297.70 1315.83 1367.46 1383.09 1405.08 1419.75 1423.90 1447.42 1466.60 1489.69 1523.32 1525.40 1562.75 1572.69 1577.15 1583.12 1594.49 1600.62 1652.16 1672.74 1703.29 1712.88 1723.05 1734.44 1740.84 1750.72 1756.40 1782.09 1797.85 1820.24 1830.65 1848.41 1870.57 1886.34 1925.61 1926.52 1932.94 1972.29 1977.53 1988.32 2010.50 2032.38 2046.52 2064.64 2083.28 2092.12 2107.80 2115.33 2139.73 2151.18 2171.49 2176.96 2181.94 2203.47 2207.55 2215.87 2223.38 2239.70 2244.80 2249.42 2251.48 2254.45 2262.00 2268.85 2281.27 2330.26 2343.27 2352.52 2355.81 2360.86 2364.28 2367.33 2368.89 2369.08 2373.48 2376.75 2382.65 2384.02 2397.23 2401.44 2407.23 2450.84 2470.57 2473.82 2542.90 2743.04 2757.13 4569.47 4575.03 4585.79 4589.75 4595.46 4600.07 4604.60 4620.08 4621.43 4622.09 4633.32 4635.30 4638.84 4645.75 4649.70 4658.07 4659.98 4671.85 4685.70 4701.17 4701.53 4714.96 4743.06 4759.05 4778.79 4782.59 4786.70 4815.21 4822.56 4962.84 4991.17 5007.82 5654.54 0.582060 0.607788 0.608733 0.525362 -1277.515947 -1277.490219 -1277.489275 -1277.572645 2.796244D-04 MUNgauss RevisionA2.1 retrievium 18-Feb-2021 DUDE CC[C@@H](C)N1C(=O)c2cc3c(n2C[C@@]1(C)C(=O)NC4CCCCCCC4)cco3 C15675578 RHF 6-31G(d) (6D,10F) C1 399.252192 |X|Y|Z| 79.539393 63.427732 38.413672 57.869415 22 6 7 8 18 3 1 |36.858105| |12.492374|36.858105| |7.318452|12.368188|36.858105| |6.651672|9.067331|17.704577|0.500000| |4.862621|7.577724|12.430963|0.248411|36.858105| |6.180551|7.382995|12.799618|0.257685|7.666190|53.358707| |5.395948|6.166535|7.769820|0.160256|6.215089|18.794741|36.858105| |5.683715|6.699087|6.906607|0.140365|5.943642|11.441482|15.824893|73.516695| |3.936635|4.191741|5.063047|0.118347|4.516647|10.674111|12.979492|14.582392|36.858105| |3.308275|3.420834|3.813331|0.091572|3.550153|6.937539|7.434488|11.491833|13.874342|36.858105| |2.760987|2.837754|3.213453|0.080398|3.053557|5.685303|5.245302|7.976052|8.714975|13.557761|36.858105| |2.792203|2.899347|3.439670|0.087933|3.257706|6.270254|5.307207|7.516039|8.667313|8.402709|13.975741|36.858105| |3.390505|3.594446|4.528197|0.113429|4.140276|9.238810|7.727157|9.565109|13.860248|8.422115|8.668256|14.082318|53.358707| |3.486157|3.792328|5.181362|0.137308|4.712873|10.466571|6.672773|8.403785|7.781630|5.264744|5.272466|7.489548|18.010793|36.858105| |4.618403|4.949403|7.340229|0.204218|5.516483|17.443728|7.697974|9.422287|6.852690|4.630434|4.224061|5.153263|10.747411|12.408193|36.858105| |4.116129|4.500406|6.589013|0.226858|5.329477|10.227631|5.021188|7.070208|4.474140|3.396981|3.216150|3.843068|6.924818|7.694290|12.387885|36.858105| |4.419098|4.166699|5.166538|0.147927|3.937928|10.211050|5.886434|7.885841|5.814672|4.358097|4.097754|4.878146|8.926551|7.713144|12.271012|7.750065|36.858105| |3.486789|3.319782|3.996882|0.116645|3.280939|7.132392|4.440470|6.268313|4.716604|3.803959|3.839173|4.726357|7.820302|6.821862|8.022516|6.594545|15.781777|73.516695| |5.354844|4.513563|5.026745|0.139699|3.692337|9.306238|5.829540|8.336412|5.382563|4.271830|3.812002|4.154149|7.124531|5.348977|7.686770|5.561244|14.275830|15.109288|53.358707| |4.294302|3.526360|3.678243|0.103404|2.889188|6.122674|4.172854|6.458120|4.093959|3.588880|3.330468|3.519468|5.486685|3.975722|4.931488|4.075683|7.753490|12.067732|17.732307|36.858105| |4.230054|3.389673|3.338246|0.090027|2.683716|5.428174|4.038384|6.629323|3.978235|3.722644|3.344765|3.310677|4.978188|3.385639|3.972821|3.261429|5.289937|8.225991|10.732700|12.433762|36.858105| |3.253277|2.692958|2.633307|0.071788|2.206422|4.110603|3.076185|5.185179|3.109668|3.046892|2.848746|2.787832|3.995415|2.728842|3.051391|2.631896|3.862839|6.504430|6.746666|7.262705|12.392178|36.858105| |2.694125|2.327916|2.349689|0.064758|2.012724|3.689635|2.738990|4.528068|2.877266|2.846067|2.796376|2.786575|3.866065|2.650881|2.859138|2.504849|3.653944|6.594941|5.862308|6.154693|7.297069|12.346773|36.858105| |2.473433|2.148810|2.177589|0.061324|1.874900|3.338695|2.402214|3.964697|2.479288|2.401728|2.383476|2.437609|3.408476|2.427865|2.636666|2.409137|3.348072|6.255940|5.180141|5.334471|5.321410|7.301578|12.399926|36.858105| |2.653274|2.299400|2.362051|0.068038|2.007753|3.603286|2.500392|4.063023|2.535616|2.376057|2.351152|2.474792|3.550210|2.623394|2.926620|2.747338|3.828027|7.349054|5.845783|6.151892|5.136617|5.779516|7.196596|12.399294|36.858105| |3.165694|2.638500|2.652527|0.077352|2.197138|3.965085|2.690376|4.404334|2.619791|2.404745|2.308436|2.420530|3.584557|2.690330|3.148888|2.987877|4.112923|7.399054|6.706287|7.242373|5.800585|5.942348|5.778265|7.304402|12.345817|36.858105| |4.082306|3.304799|3.371592|0.099323|2.670445|5.161728|3.375450|5.389148|3.199340|2.824398|2.653467|2.821210|4.352496|3.323756|4.149978|3.843284|5.839940|9.793433|10.616171|12.415521|7.294044|5.827152|5.145534|5.327878|7.295322|12.387824|36.858105| |2.326941|2.394396|2.780586|0.073124|2.682682|4.748595|3.796679|5.702488|5.241015|5.416262|8.472335|13.253733|9.739571|5.451923|3.972188|3.249046|3.920861|7.280946|4.589483|3.028215|2.842614|2.506764|2.599565|2.317654|2.338091|2.226532|2.510216|36.858105| |2.156337|2.199753|2.473721|0.064494|2.399344|4.117695|3.399408|5.338783|4.600783|5.363328|8.868070|8.707085|7.324494|4.109938|3.260356|2.704982|3.269824|5.938866|4.045296|2.752375|2.696875|2.437985|2.531475|2.223793|2.183378|2.069213|2.288344|14.162393|36.858105| |2.325721|2.366986|2.618416|0.066849|2.526523|4.392670|3.832041|6.143636|5.390783|7.375045|14.120265|8.540050|7.615302|4.014736|3.308882|2.674380|3.300668|5.735867|4.235908|2.861894|2.910076|2.601604|2.627008|2.251692|2.182332|2.099898|2.339715|8.439799|14.083778|73.516695| |17.524464|8.733697|6.767881|0.197736|4.467795|8.055825|4.790178|8.278946|3.684910|3.073144|2.646191|2.740696|4.531699|3.543789|4.882217|4.570278|4.897372|6.851881|8.206994|4.824696|4.422398|3.385153|2.826486|2.654945|2.939041|3.627614|4.893811|2.312817|2.118551|3.991699|0.500000| |17.574786|8.803736|6.392814|0.154053|4.435717|8.767136|6.238019|11.919581|4.524290|3.832367|3.102917|3.071078|5.073991|3.654636|4.756106|3.938314|4.761113|6.557601|8.405934|4.911119|5.161810|3.769040|3.024326|2.686698|2.822235|3.330547|4.325539|2.516419|2.350740|4.587086|0.299245|0.500000| |17.553872|8.840958|5.419428|0.141131|4.081443|6.269115|4.262755|8.292771|3.291991|2.887393|2.440860|2.435196|3.899149|2.911595|3.657283|3.373079|3.566091|5.231820|5.779467|3.683537|3.770202|3.046104|2.511024|2.324475|2.464222|2.945768|3.623304|2.070611|1.946371|3.733587|0.302252|0.303664|0.500000| |8.913392|17.503773|9.057311|0.231049|6.995141|7.544991|4.650497|8.790125|3.434728|2.882656|2.465720|2.535983|4.175932|3.303635|4.178046|4.128861|3.566484|5.248884|5.131734|3.074714|2.930276|2.405211|2.106659|1.980996|2.132979|2.451854|3.001939|2.147497|1.977351|3.734971|0.206621|0.174105|0.219846|0.500000| |8.905763|17.660134|8.801472|0.176643|7.142180|8.689247|6.296819|14.219468|4.260965|3.589185|2.904391|2.883396|4.777865|3.541856|4.310706|3.802248|3.663582|5.299079|5.385132|3.185992|3.188101|2.573412|2.223901|2.027793|2.126533|2.396482|2.922793|2.372800|2.215041|4.309038|0.173159|0.217270|0.210324|0.303676|0.500000| |4.003249|5.490005|8.746724|0.213379|17.555882|9.535540|5.616073|8.878812|4.482101|3.497617|3.123047|3.451073|6.001210|5.363471|5.853971|5.996327|3.992923|6.075202|4.835243|2.792917|2.545562|2.112895|1.964978|1.842363|1.982717|2.138370|2.581752|2.867454|2.512315|4.606348|0.106945|0.104178|0.094559|0.143939|0.142675|0.500000| |4.553084|7.039670|8.804758|0.214347|17.547675|7.570976|4.686401|8.364627|3.605484|2.972343|2.603743|2.749107|4.567284|3.778176|4.376594|4.528420|3.351625|5.095537|4.365917|2.597510|2.427817|2.033068|1.855095|1.747728|1.874710|2.063412|2.470592|2.332130|2.112087|3.930832|0.117207|0.110907|0.111384|0.214052|0.183356|0.301623|0.500000| |4.538708|6.806442|8.794634|0.174370|17.591687|9.322304|6.704491|12.597217|4.831820|3.890384|3.249704|3.354744|5.701967|4.425051|4.833280|4.343784|3.604661|5.381311|4.699479|2.748109|2.631552|2.175411|1.978268|1.819996|1.916944|2.077532|2.492422|2.732929|2.487542|4.753311|0.111133|0.120557|0.108459|0.166449|0.209984|0.301008|0.301457|0.500000| |3.291995|3.369218|3.559868|0.084924|3.334496|6.093041|6.494371|11.745477|8.742858|17.825795|8.468509|5.755085|7.884394|4.157017|3.894715|2.981507|3.723324|5.785227|5.217278|3.325177|3.616080|3.011431|2.752081|2.306645|2.249153|2.294343|2.658994|4.255074|4.432381|10.849438|0.083032|0.107389|0.081478|0.078934|0.101288|0.088796|0.079093|0.103604|0.500000| |3.269906|3.731159|5.215322|0.136825|5.299170|9.371910|6.056426|8.079579|6.542002|4.706007|4.672796|6.215381|12.426696|17.541020|8.820847|7.093660|5.560987|8.955905|5.789680|3.291505|2.889253|2.383993|2.307692|2.135767|2.295567|2.366014|2.861558|4.844006|3.768582|6.542082|0.090961|0.092895|0.076938|0.092218|0.098167|0.182872|0.116126|0.137843|0.106658|0.500000| |3.052550|3.217496|4.173588|0.116079|3.825548|7.618986|4.935070|6.702019|5.771564|4.414772|4.749479|6.944311|12.568230|17.689532|8.866900|7.055526|7.325762|13.973893|6.716338|3.896011|3.234656|2.674439|2.679921|2.497188|2.729728|2.732268|3.315528|5.800455|4.175694|6.840195|0.088094|0.088293|0.072235|0.079927|0.083148|0.120353|0.089324|0.099286|0.099138|0.299785|0.500000| |3.413724|3.598823|4.808551|0.155745|4.167598|7.548644|4.166977|5.986012|4.009055|3.158237|3.117607|3.819419|6.552263|7.289565|8.931262|17.629719|7.237773|13.148811|6.824334|3.923745|3.091555|2.557479|2.506378|2.449368|2.827431|2.990523|3.746139|3.367198|2.753857|4.707356|0.105103|0.092519|0.080159|0.093204|0.087231|0.131100|0.101654|0.098948|0.076574|0.181797|0.221989|0.500000| |4.576165|4.805822|6.579164|0.257716|4.965842|9.024815|4.506710|6.653239|3.883091|3.047874|2.845675|3.273242|5.663691|5.536596|8.700293|17.600140|7.078036|10.589620|7.773094|4.265221|3.360099|2.708457|2.540268|2.480669|2.883584|3.253300|4.284374|2.811819|2.406804|4.274529|0.150621|0.116768|0.103712|0.125815|0.108111|0.144142|0.123670|0.111632|0.076279|0.142125|0.144519|0.303866|0.500000| |3.830958|4.481875|6.817554|0.232599|6.332891|9.282647|4.759603|6.918535|4.179394|3.221353|3.043534|3.592239|6.344500|6.866108|8.721898|17.600115|5.548739|8.696936|5.949622|3.354167|2.819160|2.323284|2.209325|2.122758|2.377115|2.567256|3.185354|3.067584|2.576984|4.535131|0.113846|0.099999|0.088953|0.117911|0.106897|0.220732|0.149285|0.136083|0.079307|0.208514|0.168973|0.300952|0.300471|0.500000| |7.227179|5.689619|6.033125|0.159519|4.157329|11.129554|6.959067|10.181721|5.664415|4.430790|3.738723|3.928451|6.834653|5.027285|7.376635|5.318732|9.504989|10.905568|26.134240|8.954632|7.369162|4.637137|3.836434|3.366125|3.680358|4.313071|6.423111|3.140056|2.819154|5.373367|0.218186|0.251374|0.147994|0.124952|0.136012|0.106604|0.099519|0.108605|0.113677|0.115953|0.122396|0.126013|0.154452|0.121342|0.500000| |3.529495|3.059520|3.283880|0.092365|2.675920|5.528434|3.835315|5.859735|4.010726|3.584690|3.490776|3.771866|5.670756|4.069545|4.712616|3.917627|7.569449|14.003228|12.760659|17.670221|8.901531|6.654437|6.865049|5.952916|6.878364|6.656501|8.909975|3.330904|2.998209|5.417046|0.107629|0.109837|0.085455|0.075117|0.078025|0.073445|0.066710|0.071051|0.090383|0.092158|0.115738|0.109632|0.109795|0.089707|0.182370|0.500000| |4.058870|3.398650|3.408947|0.089348|2.780688|5.772069|4.578830|7.449956|4.749017|4.589565|4.035959|3.863766|5.739772|3.680588|4.159770|3.265963|5.382976|8.267852|10.222351|9.010295|17.532867|8.897570|6.420561|4.536779|4.260920|4.470540|5.451265|3.230140|3.100489|6.119527|0.112842|0.141030|0.099392|0.080348|0.091063|0.073479|0.068808|0.077156|0.123827|0.086344|0.096178|0.085782|0.090449|0.079199|0.199955|0.217655|0.500000| |5.101705|3.814873|3.559365|0.095153|2.811894|5.566764|4.131613|7.068415|3.822144|3.545331|3.084975|3.022467|4.625683|3.191479|3.839486|3.200916|4.778006|7.174508|9.709369|8.843152|17.488059|8.864785|5.420512|4.350674|4.310631|5.217852|6.643099|2.577958|2.455413|4.751925|0.145597|0.180852|0.128091|0.090799|0.099507|0.072471|0.071268|0.076700|0.098260|0.077349|0.082954|0.082234|0.093449|0.077932|0.216005|0.174298|0.303890|0.500000| |3.084863|2.584440|2.494217|0.066917|2.122766|3.868370|2.988064|5.162483|3.042336|3.085017|2.856263|2.710506|3.822041|2.555006|2.799056|2.402246|3.392249|5.661952|5.750260|5.462816|9.005940|17.542158|8.846547|5.564534|4.405760|4.464695|4.454209|2.438552|2.425735|4.693610|0.086387|0.100387|0.081507|0.064039|0.070084|0.056201|0.054408|0.058980|0.087013|0.062749|0.068859|0.064464|0.067979|0.059885|0.114494|0.141777|0.228309|0.212348|0.500000| |3.209522|2.615288|2.511420|0.069323|2.105517|3.798613|2.785401|4.757455|2.742046|2.656488|2.479296|2.447291|3.535669|2.474855|2.801424|2.490952|3.470667|5.854444|5.991099|6.234176|8.779932|17.573025|8.808301|7.176096|5.920110|6.717171|5.954543|2.218422|2.150146|4.044590|0.094149|0.100728|0.085466|0.065897|0.068928|0.055769|0.054600|0.057287|0.073336|0.060914|0.067452|0.067114|0.072532|0.061411|0.116945|0.152640|0.175073|0.221525|0.306842|0.500000| |2.708994|2.385856|2.465524|0.067688|2.116369|3.975045|2.968571|4.800891|3.223740|3.193424|3.212247|3.236221|4.424331|2.985003|3.155023|2.706444|4.132691|7.657569|6.430757|6.594652|7.140160|8.765995|17.520599|8.796870|6.509342|5.150802|5.018169|3.028411|2.927825|5.354230|0.078699|0.084784|0.068922|0.059532|0.063340|0.057923|0.053610|0.057833|0.083880|0.070944|0.084792|0.075968|0.074831|0.065817|0.113041|0.233093|0.194460|0.142101|0.194752|0.175173|0.500000| |2.408251|2.109658|2.115764|0.057914|1.844437|3.285717|2.479788|4.164377|2.625997|2.667933|2.643897|2.583250|3.507233|2.378765|2.511341|2.214353|3.083513|5.556530|4.808048|4.618340|5.569149|8.873740|17.535496|8.994824|5.414245|4.469357|3.996408|2.449007|2.441628|4.526757|0.069064|0.074809|0.063203|0.053340|0.056721|0.050036|0.047438|0.050798|0.072733|0.058331|0.066673|0.061540|0.061971|0.055106|0.090057|0.139547|0.146891|0.124684|0.233852|0.196055|0.305968|0.500000| |2.197323|1.950109|1.995864|0.056169|1.746154|3.057549|2.210826|3.644541|2.318007|2.269496|2.299924|2.359921|3.234243|2.300367|2.436008|2.243154|3.034409|5.810046|4.500767|4.337920|4.258025|5.433353|8.932531|17.515709|8.929157|5.433800|4.259297|2.297573|2.217945|3.935899|0.064998|0.065818|0.057442|0.050201|0.051421|0.048057|0.045263|0.047206|0.060322|0.056514|0.066564|0.064157|0.063401|0.055341|0.081504|0.138926|0.107118|0.098796|0.126361|0.144140|0.214151|0.224470|0.500000| |2.376012|2.050176|2.041384|0.057475|1.765590|3.067972|2.212266|3.712724|2.248026|2.188850|2.148510|2.173461|3.047539|2.176514|2.373832|2.194664|2.924817|5.342507|4.554268|4.502217|4.726657|6.732822|8.894978|17.490177|8.893261|6.739680|4.735497|2.063576|1.997251|3.622055|0.070598|0.071217|0.063140|0.052925|0.053929|0.047894|0.046122|0.047701|0.059212|0.053922|0.061565|0.061419|0.063327|0.054324|0.084869|0.129895|0.111174|0.114142|0.150437|0.212048|0.173748|0.218092|0.304718|0.500000| |2.666859|2.354781|2.481880|0.071721|2.111180|3.864236|2.659051|4.234197|2.744790|2.543882|2.558898|2.754803|3.948398|2.945059|3.253409|3.042011|4.408369|9.009613|6.413668|6.599157|5.018515|5.155859|6.508181|8.790256|17.523842|8.766770|7.133792|2.618626|2.402512|4.204616|0.082084|0.078793|0.067637|0.060374|0.060317|0.058568|0.054281|0.055779|0.065702|0.070489|0.087000|0.088883|0.087362|0.072063|0.107732|0.234088|0.120856|0.114382|0.112344|0.136200|0.189692|0.137547|0.213806|0.173667|0.500000| |2.361444|2.075612|2.129961|0.061737|1.838156|3.188871|2.207331|3.614570|2.233025|2.102298|2.095364|2.208898|3.144040|2.347177|2.584889|2.492325|3.252238|6.295288|4.792894|4.615756|3.989921|4.468989|5.415441|8.998613|17.533731|8.872813|5.563692|2.119828|1.985984|3.498799|0.072498|0.068623|0.061658|0.054221|0.053441|0.050642|0.048116|0.048679|0.055470|0.057926|0.068277|0.071900|0.072824|0.060684|0.085898|0.139782|0.095261|0.097432|0.100740|0.130806|0.137634|0.125103|0.224559|0.218060|0.305900|0.500000| |2.964612|2.507208|2.523389|0.074868|2.110602|3.675578|2.457500|4.040726|2.371290|2.167461|2.089559|2.206627|3.271467|2.505946|2.929805|2.894482|3.686552|6.709294|5.716354|5.455359|4.438414|4.462403|4.404349|5.563956|8.849465|17.537649|8.997808|2.048447|1.897356|3.395727|0.095488|0.084048|0.077494|0.065990|0.062865|0.057285|0.055708|0.054980|0.057454|0.062113|0.071097|0.081115|0.089016|0.069615|0.104436|0.142036|0.100285|0.116457|0.099581|0.139506|0.112298|0.100716|0.126353|0.150389|0.195045|0.233810|0.500000| |3.145542|2.576899|2.518157|0.072412|2.097088|3.712788|2.571672|4.303767|2.485451|2.318962|2.201111|2.260847|3.325062|2.451657|2.845619|2.673201|3.578714|6.240636|5.953591|6.198289|5.897097|6.688099|5.907888|7.177584|8.809900|17.567037|8.771906|2.075081|1.958926|3.579228|0.098286|0.092740|0.083349|0.066616|0.065750|0.056098|0.055033|0.055615|0.062513|0.060569|0.068150|0.073151|0.080509|0.064997|0.111881|0.152182|0.123579|0.155130|0.139243|0.245764|0.135836|0.130695|0.144212|0.212530|0.175099|0.196400|0.306880|0.500000| |4.844505|3.692960|3.602148|0.106757|2.796690|5.274893|3.415165|5.589165|3.102400|2.729515|2.506541|2.627964|4.099696|3.138869|4.005243|3.766645|5.188322|8.183484|9.634064|8.857148|6.660205|5.251772|4.323371|4.357149|5.415971|8.839570|17.498415|2.316484|2.128103|3.913661|0.169984|0.139043|0.120696|0.093695|0.089148|0.073598|0.072726|0.072166|0.072528|0.076656|0.084786|0.098380|0.120390|0.088307|0.185294|0.174596|0.139652|0.196974|0.117160|0.156941|0.114537|0.097719|0.098862|0.114374|0.141974|0.124439|0.211073|0.221065|0.500000| |3.860985|3.269790|3.474633|0.105846|2.761779|5.296837|3.331913|5.215510|3.166160|2.741274|2.616150|2.860081|4.460180|3.562604|4.519934|4.430254|6.462056|11.511668|10.107530|9.030139|5.460356|4.485986|4.264606|4.537899|6.415542|8.908069|17.545061|2.565009|2.293506|4.095565|0.130628|0.109587|0.094045|0.083650|0.079262|0.075461|0.070997|0.070352|0.070574|0.084969|0.100972|0.123389|0.140703|0.099075|0.164527|0.218365|0.125500|0.139623|0.100559|0.124451|0.120796|0.095331|0.107043|0.111275|0.194106|0.146644|0.228769|0.175198|0.303761|0.500000| |2.181343|2.246246|2.622541|0.070396|2.543537|4.380479|3.346719|5.052085|4.317969|4.235927|5.782118|8.365875|8.014529|5.187409|3.786099|3.246625|3.749843|7.276442|4.297145|2.865475|2.627465|2.345084|2.466593|2.254703|2.307495|2.179584|2.436110|17.813384|8.825496|10.321620|0.060999|0.064548|0.054109|0.056696|0.061153|0.076571|0.062079|0.070757|0.096322|0.130472|0.166840|0.096588|0.077720|0.085307|0.080721|0.088375|0.080802|0.066257|0.062675|0.058313|0.079448|0.064391|0.062677|0.055698|0.072467|0.058755|0.056294|0.055936|0.062108|0.070308|0.500000| 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