Version2.0 2019-11-12T09:05:34Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 25-Oct-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE COc1ccc(c(c1)NC(=O)c2cc3cc(ccc3o2)C4(CC[NH+](CC4)C[C@@H]5CCC=CC5)O)OC C12155722 RHF 6-31G(d) (6D,7F) COc1ccc(c(c1)NC(=O)c2cc3cc(ccc3o2)C4(CC[NH+](CC4)C[C@@H]5CCC=CC5)O)OC C01[X(C29H35N2O5)] 207 C1 610 COc1ccc(cc1NC(=O)c1oc2c(c1)cc(cc2)C1(O)CC[NH+](CC1)C[C@@H]1CCC=CC1)OC COc1ccc(cc1NC(=O)c1oc2c(c1)cc(cc2)[C@]1(O)CC[NH](CC1)C[C@@H]1CCC=CC1)OC COc1ccc(OC)c(NC(=O)c2oc3ccc(cc3c2)[C@]4(O)CC[NH](CC4)C[C@@H]5CCC=CC5)c1 InChIKey=ANSDOWYVGVCGCG-FQEVSTJZSA-N InChI=1S/C29H35N2O5/c1-34-23-9-11-26(35-2)24(18-23)30-28(32)27-17-21-16-22(8-10-25(21)36-27)29(33)12-14-31(15-13-29)19-20-6-4-3-5-7-20/h3-4,8-11,16-18,20,31,33H,5-7,12-15,19H2,1-2H3,(H,30,32)/t20-/m0/s1 InChI=1/C29H35N2O5/c1-34-23-9-11-26(35-2)24(18-23)30-28(32)27-17-21-16-22(8-10-25(21)36-27)29(33)12-14-31(15-13-29)19-20-6-4-3-5-7-20/h3-4,8-11,16-18,20,31,33H,5-7,12-15,19H2,1-2H3,(H,30,32)/t20-/m0/s1/f/h30H COc1ccc(c(c1)NC(=O)c2cc3cc(ccc3o2)C4(CC[NH+](CC4)C[C@@H]5CCC=CC5)O)OC C01[X(C29H35N2O5)] 207 C01 610 COc1ccc(cc1NC(=O)c1oc2c(c1)cc(cc2)C1(O)CC[NH+](CC1)C[C@@H]1CCC=CC1)OC COc1ccc(cc1NC(=O)c1oc2c(c1)cc(cc2)[C@]1(O)CC[NH](CC1)C[C@@H]1CCC=CC1)OC COc1ccc(OC)c(NC(=O)c2oc3ccc(cc3c2)[C@]4(O)CC[NH](CC4)C[C@@H]5CCC=CC5)c1 InChIKey=ANSDOWYVGVCGCG-FQEVSTJZSA-N InChI=1S/C29H35N2O5/c1-34-23-9-11-26(35-2)24(18-23)30-28(32)27-17-21-16-22(8-10-25(21)36-27)29(33)12-14-31(15-13-29)19-20-6-4-3-5-7-20/h3-4,8-11,16-18,20,31,33H,5-7,12-15,19H2,1-2H3,(H,30,32)/t20-/m0/s1 InChI=1/C29H35N2O5/c1-34-23-9-11-26(35-2)24(18-23)30-28(32)27-17-21-16-22(8-10-25(21)36-27)29(33)12-14-31(15-13-29)19-20-6-4-3-5-7-20/h3-4,8-11,16-18,20,31,33H,5-7,12-15,19H2,1-2H3,(H,30,32)/t20-/m0/s1/f/h30H 3548.9555824168 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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|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| 9.4413 11.6367 23.8726 26.0139 35.8859 43.0753 50.3437 56.7833 67.9394 80.7930 83.8532 85.8640 117.5371 119.9465 144.3279 154.9573 166.7905 175.6638 199.3467 219.3978 235.7516 244.0463 258.6953 263.1157 276.8753 280.6283 289.8846 308.3667 314.4781 326.3781 337.8738 354.5426 371.3287 404.1890 409.1997 411.4139 424.9795 439.5387 440.9187 450.1397 467.4483 477.5500 496.8318 508.8343 510.3268 537.5216 541.9159 560.5237 563.9764 588.5248 595.9462 618.4994 653.6925 661.9860 675.5479 697.0157 699.8115 710.0437 721.7067 741.8728 775.7224 780.7808 795.0881 805.9405 833.8985 835.9802 847.2380 848.4115 866.0959 887.4930 894.3981 915.4293 923.4468 938.5977 954.8000 959.7148 960.4424 980.5363 1005.8372 1011.2496 1017.8086 1031.1800 1033.9635 1038.9109 1039.8047 1043.7749 1051.5132 1055.2461 1070.1353 1076.3321 1082.3027 1092.6527 1124.8204 1131.6700 1133.1993 1143.1016 1151.9539 1153.9461 1187.4387 1198.4432 1201.2584 1205.4987 1207.3342 1229.4321 1237.3958 1246.3074 1254.4356 1277.9075 1281.0292 1288.2936 1292.1280 1294.0248 1294.4065 1307.8382 1320.2519 1327.0270 1330.9143 1345.9570 1355.4820 1358.5355 1374.1151 1379.2886 1382.7343 1388.8973 1409.7335 1418.3711 1429.6079 1434.5800 1438.9273 1441.6726 1454.1219 1462.7362 1472.5225 1486.2423 1486.7505 1500.2345 1516.2794 1523.1063 1526.8611 1534.7055 1547.6550 1559.8187 1561.6975 1574.0634 1591.9520 1593.6692 1597.3937 1609.6171 1621.4955 1626.0581 1627.7765 1631.8107 1636.0477 1636.2904 1639.6061 1643.1379 1648.6327 1648.8220 1649.8533 1650.5322 1659.9399 1661.5792 1663.1429 1673.2252 1743.3584 1784.6084 1802.1060 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3.2475 4.2092 11.8500 11.2156 11.5456 13.6285 9.9418 13.1401 22.7417 6.2178 6.5515 6.4464 6.4349 6.2699 6.2883 6.6495 6.5544 6.5709 6.7861 6.8724 6.6499 6.9730 6.9554 7.0250 6.8045 6.9073 6.9421 7.2134 7.1945 7.2032 7.1988 7.3454 7.4023 7.3797 7.3878 7.3849 7.4152 7.5145 7.5289 7.7486 7.8026 8.7053 9.5201 10.4831 0.3530 0.3105 0.7425 1.7081 2.0155 0.1943 3.9082 2.1797 0.0170 0.2360 3.3608 0.7344 0.5903 1.1272 0.9927 3.1195 6.5525 4.4451 0.9672 0.3198 2.1375 2.9703 3.3869 0.4453 2.0227 0.3975 1.1625 1.2114 19.5295 15.5846 8.7316 4.1818 31.9935 11.4727 73.3353 29.8783 3.4295 41.8646 13.6553 4.3897 2.2275 1.9230 3.6139 6.5779 2.4698 23.1388 4.6616 9.4652 0.0767 2.9141 0.7476 4.8790 13.7765 6.9017 0.1835 36.4455 46.9420 12.1048 24.2087 23.2341 3.3188 40.0786 0.2461 9.0321 23.0563 13.3169 15.0661 5.9127 3.3040 5.2740 3.7176 48.7059 37.4595 3.9259 0.7911 16.0361 47.2730 9.6708 32.7680 1.7041 30.4825 29.7320 1.6543 13.0309 19.2233 26.0118 7.0183 14.4051 15.6736 5.3874 16.0918 16.1612 0.3941 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0.2349 1.2919 1.3606 0.8600 0.3838 0.7814 0.7831 1.0299 1.0791 0.8550 0.0304 0.2439 0.9695 0.5617 0.9541 1.3865 0.6020 1.6582 6.4546 1.3340 3.9036 1.0110 3.0724 2.1165 0.1700 0.3840 1.3534 1.5884 0.1102 2.8829 1.7923 1.0863 1.1399 1.7339 0.6786 0.0907 2.2911 4.9382 4.4044 2.5031 1.2751 1.9867 10.2037 7.6372 11.1072 1.7263 0.4988 5.7305 5.1463 11.1262 3.6375 1.9341 1.9617 23.1677 18.4369 0.4994 2.7610 12.9942 25.0498 1.4033 0.5030 11.8050 2.9430 0.6011 3.6520 5.8381 2.0183 1.4172 6.7354 6.5266 2.3217 22.7216 5.0558 0.4304 0.7890 22.5376 1.1057 17.5025 6.9282 2.8230 3.7695 4.7107 11.4637 2.3938 13.6817 15.5685 1.7257 6.5421 17.3912 61.9072 10.3143 18.8839 8.1410 24.3164 16.9195 3.6430 5.9905 4.0787 12.9840 1.2840 6.0385 10.6947 21.4234 2.6722 18.1985 20.1981 14.2431 82.1891 120.1774 34.5313 43.3344 6.4477 2.5250 1.8235 9.0504 3.2171 13.6884 30.3558 174.5999 7.5381 2.6075 4.0037 1.9892 0.3422 3.5049 1.8613 1.7529 2.3404 7.2101 5.1741 57.5298 26.8925 9.1931 43.0297 30.3510 2.2128 63.0717 1.5775 5.0036 15.7887 21.3937 60.1865 9.3821 26.1693 6.6288 17.7905 12.0509 32.3595 2.2221 179.5096 3.8543 302.0083 891.6617 125.8791 26.8994 173.6961 98.9964 77.7416 97.8056 84.1942 99.5307 113.3842 43.4743 11.2276 88.5747 129.1195 73.1943 27.1922 49.7180 54.4100 54.8389 102.5089 41.9035 96.6759 28.7588 84.5563 141.5169 75.5868 37.7902 52.2709 190.1981 45.5305 50.0976 49.3975 117.4590 145.3571 33.9814 58.6075 20.9648 61.5471 62.6558 0.7499 0.7480 0.7497 0.7474 0.7488 0.7403 0.7399 0.7284 0.7380 0.7349 0.7494 0.7407 0.3252 0.7485 0.4389 0.7474 0.5170 0.2749 0.2644 0.7480 0.7487 0.6727 0.7486 0.7500 0.7443 0.4994 0.7462 0.4782 0.2420 0.7271 0.5822 0.1403 0.3272 0.4876 0.3833 0.1688 0.7404 0.6623 0.7312 0.3833 0.4990 0.5452 0.2221 0.7365 0.5657 0.6086 0.7164 0.6486 0.4067 0.6626 0.5730 0.2220 0.7476 0.7495 0.3672 0.7448 0.7304 0.3189 0.6025 0.6548 0.0541 0.3368 0.7500 0.3013 0.6983 0.1192 0.5978 0.7409 0.6614 0.1772 0.0551 0.7494 0.4246 0.0901 0.1943 0.3643 0.2709 0.7447 0.7441 0.1878 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12.00000 12.00000 15.99491 15.99491 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 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 5039.1140 74150.3726 75401.5235 1.00000 -0.00188 -0.00025 0.00188 0.99994 0.01090 0.00022 -0.01090 0.99994 1 0.01719 0.00117 0.00115 0.35815 0.02434 0.02394 13.58 16.74 34.35 37.43 51.63 61.98 72.43 81.70 97.75 116.24 120.65 123.54 169.11 172.58 207.66 222.95 239.97 252.74 286.82 315.66 339.19 351.13 372.20 378.56 398.36 403.76 417.08 443.67 452.46 469.59 486.13 510.11 534.26 581.54 588.75 591.93 611.45 632.40 634.38 647.65 672.55 687.09 714.83 732.10 734.25 773.37 779.70 806.47 811.44 846.76 857.43 889.88 940.52 952.45 971.96 1002.85 1006.87 1021.59 1038.37 1067.39 1116.09 1123.37 1143.95 1159.57 1199.79 1202.79 1218.99 1220.67 1246.12 1276.90 1286.84 1317.10 1328.63 1350.43 1373.74 1380.82 1381.86 1410.77 1447.18 1454.96 1464.40 1483.64 1487.64 1494.76 1496.05 1501.76 1512.89 1518.26 1539.69 1548.60 1557.19 1572.08 1618.37 1628.22 1630.42 1644.67 1657.40 1660.27 1708.46 1724.29 1728.34 1734.44 1737.08 1768.88 1780.34 1793.16 1804.85 1838.62 1843.12 1853.57 1859.08 1861.81 1862.36 1881.69 1899.55 1909.30 1914.89 1936.53 1950.24 1954.63 1977.05 1984.49 1989.45 1998.31 2028.29 2040.72 2056.89 2064.04 2070.30 2074.25 2092.16 2104.55 2118.63 2138.37 2139.10 2158.50 2181.59 2191.41 2196.81 2208.10 2226.73 2244.23 2246.93 2264.73 2290.46 2292.93 2298.29 2315.88 2332.97 2339.53 2342.01 2347.81 2353.91 2354.26 2359.03 2364.11 2372.01 2372.29 2373.77 2374.75 2388.28 2390.64 2392.89 2407.40 2508.30 2567.65 2592.83 2605.73 2616.02 2644.68 2721.74 2811.49 4540.01 4569.69 4601.17 4608.00 4614.30 4624.53 4638.52 4644.20 4655.57 4667.25 4679.03 4693.49 4703.42 4717.30 4719.93 4728.77 4740.74 4753.73 4780.01 4786.72 4793.25 4824.36 4824.89 4837.25 4856.73 4875.01 4881.67 4890.30 4907.19 4916.04 4991.01 4992.57 5327.78 5570.53 5875.32 0.651742 0.682629 0.683573 0.585096 -1600.903416 -1600.872529 -1600.871585 -1600.970062 3.302935D-04 MUNgauss RevisionA1.9 retrievium 12-Nov-2019 DUDE COc1ccc(c(c1)NC(=O)c2cc3cc(ccc3o2)C4(CC[NH+](CC4)C[C@@H]5CCC=CC5)O)OC C12155722 RHF 6-31G(d) (6D,10F) C1 491.254567 |X|Y|Z| 198.780334 44.138334 35.097529 67.528737 30 6 7 8 27 2 1 |36.858105| |13.617004|73.516695| |8.024360|25.117838|36.858105| |6.733950|14.016786|13.849935|36.858105| |4.508998|9.238643|7.951462|13.627984|36.858105| |3.792081|8.213383|6.856009|7.912262|13.905475|36.858105| |3.991341|9.441835|7.928315|6.854965|7.941924|13.529858|36.858105| |5.267998|14.630363|13.619583|7.922814|6.885639|7.908208|13.861495|36.858105| |3.146393|7.091662|5.115969|4.553487|5.224300|7.994747|13.536997|7.741556|53.358707| |2.900261|6.519160|4.319631|3.686413|3.920375|5.178922|7.692987|6.315962|19.261776|36.858105| |3.093149|7.115083|4.459316|3.599745|3.595869|4.415349|6.477635|6.530236|11.378794|15.892742|73.516695| |2.364303|5.065188|3.246692|2.920723|3.160552|4.029385|5.075152|4.248043|10.867554|12.773243|14.610763|36.858105| |2.117736|4.455828|2.748626|2.470881|2.605990|3.156264|3.825196|3.443580|7.073555|7.483068|11.700235|14.266303|36.858105| |1.858801|3.819587|2.356895|2.185248|2.341966|2.804609|3.207189|2.844879|5.706255|5.168471|7.940348|8.595726|13.175879|36.858105| |1.644159|3.321167|2.015414|1.884966|2.001803|2.331918|2.599260|2.363338|4.369872|3.776241|6.137024|5.298750|7.259761|13.708401|36.858105| |1.513105|3.018603|1.837104|1.749295|1.875741|2.167844|2.345258|2.116033|3.860616|3.162144|5.084104|4.202102|4.994051|7.949525|13.727722|36.858105| |1.539213|3.065333|1.891733|1.827890|1.996140|2.329082|2.467411|2.174575|4.084678|3.213922|5.000788|4.251263|4.572165|6.903660|7.897277|13.566195|36.858105| |1.707369|3.435232|2.159370|2.092611|2.327050|2.790388|2.956438|2.522884|5.080389|3.920998|5.808994|5.419880|5.312002|7.829852|6.751012|7.816940|13.791531|36.858105| |1.898206|3.892654|2.458831|2.329396|2.571478|3.154433|3.506398|2.967123|6.420429|5.318627|7.549865|8.782396|8.458869|13.712199|7.940973|6.928511|8.099565|13.805206|36.858105| |2.177266|4.554783|2.959448|2.786484|3.134952|4.044870|4.647201|3.709675|9.548057|7.728080|9.582032|13.977344|8.504548|8.491447|5.378807|4.668042|5.243415|7.830967|14.190238|73.516695| |1.357727|2.677278|1.608479|1.536332|1.630706|1.846991|1.978839|1.820238|3.154551|2.552087|4.228274|3.184595|3.721798|5.035486|7.619845|12.466774|7.409248|4.952119|4.453940|6.041397|36.858105| |1.312356|2.578270|1.539854|1.469643|1.551064|1.743429|1.866495|1.732443|2.941141|2.375356|3.985921|2.895737|3.361528|4.285940|5.945979|7.550273|5.480433|4.089649|3.799256|5.387280|12.410807|36.858105| 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|1.262008|2.465841|1.483208|1.433936|1.529525|1.718056|1.806086|1.657288|2.832999|2.228802|3.678238|2.698663|2.996389|3.846957|4.985909|7.398718|6.434729|4.399435|3.716408|5.243010|12.385638|7.677167|6.528430|10.375385|0.198199|12.509829|36.858105| |1.040898|2.001982|1.180662|1.141694|1.195582|1.307793|1.368348|1.290930|2.071242|1.620212|2.767191|1.851851|2.035174|2.354413|2.815707|3.255829|2.916742|2.412203|2.226594|3.425071|4.357483|4.939327|7.581801|17.212928|0.258809|7.677425|4.965100|36.858105| |1.002530|1.921570|1.129817|1.093678|1.142133|1.243095|1.297880|1.229600|1.950874|1.520661|2.608464|1.718566|1.874936|2.131278|2.490195|2.801398|2.554721|2.171271|2.024834|3.162525|3.525851|4.224295|6.084269|10.141745|0.197755|4.930125|3.778214|12.456838|36.858105| 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|2.698288|5.315091|3.786410|4.494776|6.704904|7.993499|5.237485|3.978134|6.491059|3.585320|5.423564|3.248852|2.652074|2.535651|2.170871|2.107554|2.350685|2.829711|2.974178|6.426862|1.808270|1.700838|1.500038|1.980924|0.041317|1.519714|1.729511|1.305632|1.240731|0.034609|1.131141|1.073792|1.100930|1.181622|1.270351|2.996861|24.184825|36.858105| |17.556833|16.442666|7.048629|6.736908|4.571774|3.741373|3.796210|4.768830|4.090562|2.739844|5.105579|2.261944|2.024528|1.794013|1.591698|1.473648|1.505486|1.669821|1.843276|3.749017|1.324244|1.272745|1.160290|1.501653|0.030612|1.134712|1.238447|1.018380|0.978366|0.027696|0.910252|0.874852|0.882265|0.923929|0.976889|2.319116|5.287787|2.735064|0.500000| 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|7.425269|12.451531|8.889517|17.773046|8.936762|5.661665|4.947333|5.622650|4.934889|3.057703|5.373792|2.508704|2.171071|1.945985|1.704221|1.593291|1.661171|1.878771|2.062001|4.288903|1.414483|1.358139|1.226752|1.593889|0.032737|1.205126|1.328386|1.073208|1.031061|0.029099|0.953872|0.915812|0.929715|0.980293|1.038626|2.436807|7.438772|3.913043|0.223232|0.223305|0.145411|0.500000| |3.916184|7.464111|5.674295|8.945216|17.761722|8.956917|5.637219|4.962225|5.751282|3.292656|5.365019|2.781255|2.334111|2.145801|1.859846|1.767258|1.894397|2.194833|2.370806|5.028830|1.547943|1.474137|1.319135|1.727828|0.035743|1.314288|1.466980|1.153822|1.104044|0.030984|1.015673|0.970935|0.990644|1.052590|1.121112|2.622680|12.494713|7.449758|0.113169|0.113161|0.089089|0.218199|0.500000| |4.890568|13.564253|8.941763|5.666578|4.967701|5.625589|8.935371|17.831940|9.490682|6.860316|14.933349|4.474064|3.729160|2.975956|2.469326|2.171042|2.189688|2.510431|3.000023|6.564434|1.871069|1.784979|1.574784|1.990205|0.040415|1.505893|1.684877|1.319223|1.256072|0.035854|1.146815|1.092535|1.100914|1.162837|1.247822|3.263958|7.577458|3.322469|0.120306|0.120262|0.121848|0.124178|0.107839|0.500000| |2.799717|6.055427|4.296096|4.104026|4.985486|7.762488|9.376337|5.770656|26.037675|9.475028|10.830901|7.720113|5.010841|4.353485|3.319843|3.007028|3.294568|4.267973|5.308307|15.013821|2.423363|2.241355|1.903529|2.438042|0.050267|1.877521|2.197634|1.570843|1.475301|0.041627|1.323221|1.244675|1.266598|1.363246|1.488775|4.017532|16.017716|5.559743|0.075386|0.075371|0.069779|0.093071|0.117472|0.142933|0.500000| |2.132710|4.494387|2.704334|2.388385|2.456460|2.903030|3.551159|3.362945|6.191689|6.575621|12.135284|8.899711|17.822152|8.373688|6.122647|4.283359|3.787617|4.144224|5.776693|10.376407|3.419468|3.165013|2.607680|3.106037|0.061530|2.366489|2.753142|1.972254|1.826942|0.052995|1.614817|1.502734|1.495221|1.594096|1.768612|6.130441|5.108480|2.394454|0.056285|0.056243|0.057252|0.058684|0.060975|0.104700|0.116795|0.500000| |1.598511|3.219630|1.926152|1.787659|1.871360|2.149914|2.410191|2.243415|3.962257|3.461659|5.874830|4.581051|6.433573|8.896391|17.731470|8.885156|5.615893|4.889442|5.643624|7.723927|7.094926|5.985858|4.389759|4.849713|0.092464|3.751536|4.587379|2.881291|2.551142|0.074519|2.165202|1.948772|1.915497|2.069918|2.399452|13.465479|3.971860|1.973313|0.042881|0.042860|0.043068|0.045135|0.048250|0.065963|0.081637|0.171922|0.500000| |1.436760|2.833113|1.743623|1.702558|1.862124|2.144647|2.229155|1.974184|3.598081|2.762742|4.347969|3.475827|3.639565|4.970960|5.623249|8.832043|17.755136|9.056092|5.741262|7.494174|6.820190|5.220476|3.959030|5.493615|0.118644|4.667615|7.295865|3.087152|2.681277|0.072638|2.242086|1.987333|2.034252|2.306368|2.759999|8.440193|4.259488|2.227191|0.039180|0.039175|0.038003|0.043314|0.049634|0.054820|0.080716|0.086718|0.123461|0.500000| |1.705199|3.409670|2.163821|2.135136|2.416725|2.903620|2.976052|2.499963|5.020333|3.664895|5.392649|4.722416|4.338659|5.593105|4.890759|5.578250|8.865559|17.748655|8.878176|12.329318|4.037283|3.462230|2.763397|3.673846|0.078002|2.946478|3.844156|2.230306|2.027418|0.055921|1.757621|1.607892|1.651913|1.834579|2.089026|5.898301|6.102261|3.115894|0.046556|0.046559|0.044381|0.053335|0.064098|0.067794|0.121091|0.097223|0.106484|0.216899|0.500000| |1.366305|2.696607|1.604262|1.517838|1.591872|1.791668|1.941862|1.814986|3.071039|2.525346|4.286673|3.089217|3.697158|4.629392|6.508493|6.956000|4.936980|3.936045|3.884721|5.570772|8.842061|17.603282|8.987514|7.593355|0.144637|4.916031|5.554063|4.118833|3.713615|0.113308|2.907310|2.589306|2.579320|2.870268|3.473651|13.095535|3.341361|1.713341|0.036625|0.037179|0.036896|0.038873|0.041765|0.052418|0.064250|0.098703|0.198344|0.123641|0.091708|0.500000| |1.314630|2.578860|1.548274|1.487177|1.579648|1.778109|1.887243|1.738381|2.971997|2.366129|3.925846|2.875077|3.239708|4.120156|5.311719|6.918483|5.760625|4.308829|3.854913|5.480148|8.827857|17.539997|8.822665|9.265512|0.206182|5.723151|6.914801|4.547636|4.102517|0.118506|3.089128|2.726892|2.820375|3.299568|4.179433|10.297026|3.379880|1.759558|0.035392|0.035993|0.035281|0.038178|0.041858|0.049377|0.063535|0.083254|0.138798|0.158973|0.103141|0.303326|0.500000| |1.184039|2.304959|1.357721|1.293838|1.348590|1.491366|1.593691|1.507583|2.454668|1.977086|3.402454|2.316499|2.669906|3.150934|4.074750|4.536537|3.582298|2.901499|2.787338|4.179223|6.788412|8.815866|17.651087|12.424304|0.182108|7.001168|5.744288|7.047620|5.486866|0.169581|4.111046|3.358102|3.113350|3.371666|4.314512|13.504520|2.769224|1.446229|0.031989|0.032160|0.032151|0.033505|0.035710|0.043370|0.051206|0.072908|0.124740|0.097704|0.071076|0.215614|0.173062|0.500000| |1.162511|2.256362|1.331769|1.275588|1.333291|1.471340|1.561189|1.472813|2.393734|1.906572|3.264188|2.216063|2.499570|2.926416|3.619680|4.073445|3.427631|2.819044|2.670160|4.044192|5.480805|8.821702|17.662894|12.352707|0.225031|5.610138|4.911435|7.042755|6.938244|0.239898|4.573156|3.902082|3.846546|4.400163|5.863794|8.895962|2.742409|1.440581|0.031309|0.031796|0.031513|0.033090|0.035432|0.042141|0.050162|0.067596|0.105642|0.095504|0.070241|0.213435|0.214426|0.300741|0.500000| |1.147679|2.225746|1.319783|1.270524|1.335738|1.477110|1.557552|1.458982|2.394244|1.893211|3.209897|2.216204|2.481298|2.972262|3.737243|4.526283|3.827648|3.014476|2.761234|4.119231|6.848165|5.795824|7.015417|12.421971|0.182204|17.659744|8.805334|7.106584|4.580148|0.118583|3.755701|2.936365|2.726266|2.970745|3.844424|13.469790|2.776257|1.465344|0.031309|0.031096|0.031019|0.032952|0.035612|0.041522|0.050601|0.066118|0.106024|0.111158|0.075225|0.129860|0.133175|0.210892|0.143598|0.500000| |1.104418|2.131440|1.270462|1.235924|1.309276|1.444476|1.501272|1.395676|2.294769|1.779559|2.984174|2.066629|2.244846|2.683659|3.223163|4.032203|3.777792|2.979480|2.618809|3.937496|5.488758|4.916588|5.614130|12.387078|0.225440|17.627063|8.809303|7.217616|4.753498|0.113833|3.880134|3.014686|2.900601|3.276468|4.393185|8.832669|2.744985|1.467911|0.030203|0.030072|0.029733|0.032141|0.035181|0.039314|0.049049|0.058883|0.087090|0.118506|0.076862|0.108183|0.128439|0.143679|0.126749|0.300658|0.500000| |1.258511|2.454463|1.483510|1.443977|1.550497|1.743171|1.814915|1.653412|2.842716|2.205019|3.604525|2.659252|2.880675|3.683794|4.533204|6.710366|6.855732|4.643151|3.733431|5.286661|8.748540|6.904930|5.742157|9.369924|0.209903|8.898443|17.563423|4.609252|3.701648|0.096604|2.947649|2.496429|2.533576|2.936224|3.776925|10.151412|3.372233|1.785616|0.034302|0.034336|0.033619|0.037174|0.041496|0.046355|0.061879|0.072651|0.112301|0.249671|0.116157|0.140707|0.204414|0.133012|0.129275|0.173708|0.215520|0.500000| |1.272660|2.486096|1.498497|1.451866|1.552370|1.744961|1.828890|1.673555|2.867689|2.244461|3.690489|2.710765|2.976845|3.793761|4.746367|6.736682|6.288816|4.448024|3.733769|5.302759|8.780041|5.540836|4.883835|7.582975|0.145173|8.972177|17.567243|4.141722|3.215871|0.084673|2.694896|2.265961|2.222436|2.474945|3.075546|12.627789|3.352749|1.765262|0.034851|0.034456|0.034060|0.037352|0.041406|0.047135|0.061995|0.075640|0.119881|0.198604|0.109363|0.123652|0.140947|0.128301|0.107848|0.213921|0.213817|0.303410|0.500000| |1.009982|1.937011|1.143972|1.111240|1.166459|1.273083|1.323786|1.246345|1.996375|1.549232|2.637015|1.762226|1.914310|2.208658|2.598465|3.026778|2.795904|2.326523|2.123696|3.284624|3.926785|4.161123|5.595901|12.444849|0.220747|7.450039|4.778722|17.605803|8.848375|0.173898|7.062697|4.589004|4.146740|4.617178|6.730589|6.725786|2.391442|1.283219|0.027533|0.027589|0.027340|0.029070|0.031384|0.035232|0.042210|0.051275|0.072721|0.083847|0.060545|0.096975|0.109763|0.146111|0.143084|0.186457|0.234739|0.126065|0.115316|0.500000| |1.038558|1.998213|1.173947|1.130768|1.178940|1.287870|1.353976|1.284027|2.047326|1.611465|2.771682|1.837362|2.036914|2.336081|2.808526|3.166667|2.774906|2.315759|2.174674|3.358229|4.242199|4.656089|7.109864|12.438479|0.182265|6.960338|4.606213|17.615594|8.773111|0.214387|6.915045|4.600358|3.882535|4.068383|5.450451|7.927318|2.397137|1.273898|0.028229|0.028281|0.028222|0.029534|0.031529|0.036605|0.042885|0.055402|0.081637|0.079864|0.059096|0.112210|0.113506|0.218818|0.177501|0.212512|0.173502|0.113313|0.110503|0.301827|0.500000| |0.908757|1.729365|1.014007|0.986856|1.029052|1.110770|1.150556|1.093718|1.710252|1.319650|2.268614|1.469042|1.579042|1.765292|2.008354|2.231944|2.096548|1.824850|1.702265|2.705594|2.686572|2.950598|3.749195|6.260210|0.124610|3.795328|2.975376|6.927044|8.849844|0.174789|17.520483|8.858068|6.625811|6.189448|6.988808|4.681600|2.069940|1.118012|0.024743|0.024916|0.024699|0.025988|0.027783|0.030914|0.035918|0.042820|0.056725|0.061627|0.048201|0.073836|0.080256|0.100628|0.108731|0.101602|0.111663|0.081445|0.074707|0.210765|0.167875|0.500000| |0.926781|1.767332|1.031665|0.997597|1.034647|1.117300|1.166690|1.115537|1.736653|1.353262|2.345292|1.507134|1.640893|1.823488|2.096396|2.283431|2.084497|1.815593|1.723588|2.738339|2.783625|3.095865|4.101951|6.297465|0.116138|3.774531|2.947393|7.142624|8.778558|0.211341|17.540658|8.834404|5.538827|4.905605|5.498196|5.059629|2.067771|1.108860|0.025184|0.025341|0.025273|0.026244|0.027807|0.031731|0.036223|0.045003|0.060551|0.059945|0.047356|0.079354|0.081018|0.117512|0.120156|0.107300|0.104242|0.077830|0.073909|0.180145|0.212901|0.302747|0.500000| |0.853877|1.617752|0.942504|0.916127|0.949081|1.017343|1.054471|1.010824|1.553731|1.198458|2.078631|1.316146|1.410222|1.543920|1.725721|1.859664|1.748036|1.560156|1.482871|2.395624|2.158212|2.410507|2.940299|4.351879|0.087669|2.686655|2.266178|4.112744|5.519680|0.141953|8.859175|17.553710|8.934819|5.840902|4.914787|3.799003|1.880744|1.016784|0.023188|0.023470|0.023298|0.024220|0.025631|0.028631|0.032410|0.038643|0.049178|0.050418|0.041348|0.063050|0.066040|0.080191|0.089296|0.073325|0.075713|0.062324|0.057535|0.111329|0.109192|0.221093|0.207376|0.500000| |0.904461|1.720009|1.000857|0.967842|1.000538|1.075890|1.122659|1.078128|1.661261|1.291720|2.248287|1.424692|1.542116|1.688847|1.905990|2.035564|1.877876|1.669129|1.600600|2.574682|2.385011|2.760574|3.468329|4.836320|0.095753|2.861015|2.424492|4.510223|6.551061|0.199043|8.808603|17.506935|8.932819|6.105705|5.308291|4.223088|1.982979|1.064786|0.024476|0.024845|0.024708|0.025521|0.026906|0.030676|0.034536|0.042486|0.054987|0.053493|0.043775|0.073368|0.074797|0.095202|0.110538|0.078589|0.077552|0.066041|0.060548|0.111796|0.122388|0.174126|0.219602|0.304923|0.500000| |0.873495|1.654368|0.966340|0.941947|0.978369|1.048802|1.083348|1.035582|1.594931|1.224261|2.115196|1.342413|1.427498|1.562002|1.727396|1.863723|1.778177|1.599695|1.515065|2.456197|2.116958|2.431421|2.857543|4.112232|0.087673|2.489509|2.195054|3.527217|4.862395|0.131918|5.467795|8.608314|17.699372|9.197035|5.496346|3.599531|1.944126|1.053725|0.023651|0.024130|0.023784|0.024903|0.026467|0.029241|0.033360|0.038907|0.048668|0.051407|0.042664|0.063972|0.069266|0.074401|0.090110|0.065641|0.069445|0.062247|0.055055|0.093618|0.088785|0.139854|0.122220|0.213838|0.201212|0.500000| |0.946609|1.800473|1.060474|1.037132|1.086484|1.173007|1.207570|1.142250|1.791868|1.370091|2.339626|1.519334|1.608704|1.791922|1.988870|2.202141|2.136915|1.898749|1.761979|2.824330|2.504640|2.941493|3.386573|5.024041|0.115943|2.946483|2.644424|4.015129|5.459908|0.140979|4.873631|5.492267|9.163678|17.704202|8.624958|4.069151|2.196519|1.191659|0.025621|0.026200|0.025636|0.027310|0.029418|0.032108|0.037815|0.043226|0.054983|0.062912|0.050831|0.075186|0.087942|0.083005|0.107815|0.074098|0.082530|0.077914|0.064842|0.106915|0.094134|0.130559|0.106727|0.127929|0.130983|0.221815|0.500000| |1.053819|2.023680|1.198552|1.165669|1.226601|1.341194|1.392746|1.307232|2.102513|1.626264|2.757217|1.848704|1.992486|2.292125|2.644493|3.044312|2.877422|2.439233|2.227651|3.461327|3.685861|4.665736|5.791290|9.077849|0.238234|4.531125|3.937025|6.530156|8.753848|0.218588|5.508060|4.907084|5.851996|8.989326|17.471679|5.728938|2.525101|1.354480|0.028502|0.029036|0.028468|0.030455|0.033003|0.036875|0.044555|0.053069|0.072905|0.085511|0.063823|0.111404|0.143300|0.127324|0.193060|0.107475|0.121329|0.117228|0.090565|0.157638|0.137066|0.140285|0.122906|0.109273|0.123222|0.128483|0.216975|0.500000| |0.987724|1.887686|1.117321|1.092004|1.149949|1.251123|1.290127|1.211483|1.934579|1.484431|2.515915|1.673945|1.786739|2.042729|2.330624|2.693155|2.599382|2.217671|2.009102|3.147251|3.246059|3.707983|4.541710|8.219375|0.203440|4.563640|3.729221|7.072921|8.784539|0.173969|6.578437|5.317879|6.107943|8.913346|17.455460|5.194381|2.359770|1.276412|0.026850|0.027183|0.026682|0.028634|0.031088|0.034049|0.041077|0.047571|0.063972|0.078832|0.058888|0.088480|0.108783|0.108137|0.133918|0.108387|0.135448|0.110414|0.089195|0.207916|0.141938|0.197062|0.137843|0.123704|0.121193|0.131116|0.201124|0.303064|0.500000| |1.377820|2.721943|1.622395|1.535664|1.613470|1.819944|1.972576|1.838507|3.130204|2.575765|4.355309|3.173968|3.813872|4.860306|7.044815|7.699126|5.261632|4.124077|4.054950|5.748035|9.750060|6.011630|5.082600|6.190639|0.110214|5.639389|6.922278|3.607231|2.925791|0.082317|2.490183|2.141855|2.051851|2.211687|2.649921|35.664965|3.401739|1.742948|0.037480|0.036954|0.037167|0.039289|0.042322|0.053050|0.065640|0.101116|0.212866|0.130600|0.095243|0.157374|0.131274|0.154738|0.111301|0.176941|0.123952|0.142469|0.197789|0.092672|0.105504|0.066201|0.070843|0.054259|0.059413|0.051303|0.057505|0.078021|0.072445|0.500000| |2.735949|5.295140|3.738949|4.564124|6.715649|7.038076|4.749387|3.788124|5.726461|3.258234|5.047205|2.941682|2.444221|2.333486|2.019951|1.962573|2.170787|2.570388|2.691201|5.704557|1.701422|1.621415|1.437145|1.895036|0.039625|1.441000|1.626989|1.254516|1.200684|0.033550|1.096668|1.046613|1.076550|1.154364|1.233596|2.819053|16.455273|17.568624|0.076335|0.078918|0.066064|0.113232|0.224226|0.088031|0.130544|0.062013|0.051394|0.057420|0.077939|0.045491|0.046773|0.038426|0.038596|0.038555|0.038700|0.046781|0.045780|0.034211|0.033954|0.030085|0.029814|0.027549|0.028857|0.028717|0.032448|0.036550|0.034360|0.045227|0.500000| 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