Version2.1 2020-12-27T22:27:13Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 04-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE COc1cc(cc(c1OC)OC)N2C(=O)C[C@H](C2=O)[NH+]3CCc4cc(c(cc4C3)OC)OC C22609170 RHF 6-31G(d) (6D,7F) COc1cc(cc(c1OC)OC)N2C(=O)C[C@H](C2=O)[NH+]3CCc4cc(c(cc4C3)OC)OC C01[X(C24H29N2O7)] 180 C1 553 COc1cc2CC[NH+](Cc2cc1OC)[C@@H]1CC(=O)N(C1=O)c1cc(OC)c(c(c1)OC)OC COc1cc2CC[NH+](Cc2cc1OC)[C@@H]1CC(=O)N(C1=O)c1cc(OC)c(c(c1)OC)OC COc1cc2CC[NH+](Cc2cc1OC)[C@@H]3CC(=O)N(C3=O)c4cc(OC)c(OC)c(OC)c4 InChIKey=ZWXBPUOMKREOHB-QGZVFWFLSA-O InChI=1S/C24H28N2O7/c1-29-18-8-14-6-7-25(13-15(14)9-19(18)30-2)17-12-22(27)26(24(17)28)16-10-20(31-3)23(33-5)21(11-16)32-4/h8-11,17H,6-7,12-13H2,1-5H3/p+1/t17-/m1/s1 InChI=1/C24H28N2O7/c1-29-18-8-14-6-7-25(13-15(14)9-19(18)30-2)17-12-22(27)26(24(17)28)16-10-20(31-3)23(33-5)21(11-16)32-4/h8-11,17H,6-7,12-13H2,1-5H3/p+1/t17-/m1/s1/fC24H29N2O7/h25H/q+1 COc1cc(cc(c1OC)OC)N2C(=O)C[C@H](C2=O)[NH+]3CCc4cc(c(cc4C3)OC)OC C01[X(C24H29N2O7)] 180 C01 553 COc1cc2CC[NH+](Cc2cc1OC)[C@@H]1CC(=O)N(C1=O)c1cc(OC)c(c(c1)OC)OC CO[C]1[CH][C]2[C]([CH][C]1OC)C[N@@H](CC2)[C@@H]1CC(=O)N(C1=O)[C]1[CH][C]([C]([C]([CH]1)OC)OC)OC CO[C]1[CH][C]2CC[NH](C[C]2[CH][C]1OC)[C@@H]3CC(=O)N([C]4[CH][C](OC)[C](OC)[C]([CH]4)OC)C3=O InChIKey=XEPXYSCTPSRVLP-QGZVFWFLSA-N InChI=1S/C24H29N2O7/c1-29-18-8-14-6-7-25(13-15(14)9-19(18)30-2)17-12-22(27)26(24(17)28)16-10-20(31-3)23(33-5)21(11-16)32-4/h8-11,17,25H,6-7,12-13H2,1-5H3/t17-/m1/s1 InChI=1/C24H29N2O7/c1-29-18-8-14-6-7-25(13-15(14)9-19(18)30-2)17-12-22(27)26(24(17)28)16-10-20(31-3)23(33-5)21(11-16)32-4/h8-11,17,25H,6-7,12-13H2,1-5H3/t17-/m1/s1 3358.2124240169 -1558.4059601 1-A 24230.4107 121 432 553 |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| -20.70176 -20.68302 -20.68258 -20.68207 -20.66577 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22.3495 34.4901 49.1168 52.4816 63.5591 73.5412 81.0373 88.8664 94.7085 109.6439 114.1708 133.4857 146.1238 154.8330 156.6235 177.5485 186.4054 198.2023 209.9332 217.7104 227.4889 238.3442 243.2419 254.5900 261.3902 280.0998 283.8468 300.5885 311.8798 316.7487 327.6492 353.3496 376.9600 392.7202 396.4816 413.7843 449.0774 454.7875 471.0056 482.1286 505.6719 513.7308 550.4228 564.0509 574.5291 584.9693 597.5447 623.8284 667.2725 669.4460 676.0529 690.2754 700.2724 702.3557 717.2154 747.8639 786.3676 793.1052 799.1306 820.8886 826.5447 853.1639 893.3118 913.0993 924.8215 929.8488 932.9138 962.2022 979.1366 988.2218 1026.0303 1036.8328 1050.7810 1077.1829 1100.8339 1114.3330 1130.4801 1135.5863 1143.4953 1177.4541 1185.3801 1190.3864 1196.4915 1211.7119 1248.4462 1249.7287 1265.9010 1267.4618 1288.0291 1292.7870 1292.9981 1293.5385 1293.9533 1297.7700 1307.0366 1312.1285 1323.8759 1332.0619 1333.6223 1333.8550 1343.6871 1353.0433 1363.9984 1371.0792 1391.4518 1399.6091 1408.1021 1410.8020 1421.2405 1443.9814 1448.1512 1479.3716 1483.4986 1508.3152 1520.4227 1526.0097 1546.5908 1559.0995 1577.4169 1594.4715 1595.9307 1616.5565 1620.8793 1624.6010 1631.6333 1635.2327 1639.6940 1640.1060 1645.2002 1647.4328 1649.1070 1651.4009 1651.5832 1651.6076 1652.1476 1652.5015 1654.7882 1655.1600 1657.1982 1657.8738 1665.7106 1702.2324 1710.6799 1782.9398 1799.0586 1801.2588 1805.1298 2006.0198 2092.9477 3202.7868 3209.9747 3211.8458 3213.7634 3215.8814 3225.5139 3239.0697 3252.0349 3260.9864 3274.5714 3277.1030 3280.2220 3282.4581 3282.9189 3287.6206 3295.5320 3333.1142 3337.7231 3345.1168 3346.1662 3353.4160 3354.0435 3359.7026 3375.8324 3395.8799 3398.6217 3423.9487 3424.3756 3669.7081 4.4918 4.6870 5.4811 8.3828 4.8894 2.9912 3.9564 2.6466 3.2654 3.5915 3.6206 4.3447 6.3540 4.3941 3.7971 4.2807 1.0828 3.7094 3.6537 3.0699 2.4888 3.1940 1.5055 2.1304 2.2106 2.9989 2.5555 1.3631 2.1134 2.5838 2.1834 1.8756 4.0175 5.8455 4.2615 4.5028 4.2784 3.3757 3.9708 3.9309 5.0292 5.7197 5.0483 3.1787 5.2355 3.8645 7.2616 5.9877 3.7504 3.3886 4.5608 4.0230 4.3810 4.5552 4.8461 6.0425 4.5342 4.3154 3.5105 4.6464 5.3618 4.6968 6.3250 4.4046 4.4134 2.2075 1.7398 1.8124 2.0922 1.4411 1.4556 3.0140 2.5438 5.7633 2.9891 1.6109 4.9002 3.6629 3.6445 3.7177 7.2909 4.2740 3.4981 5.5249 2.1372 2.6871 4.9693 3.4491 2.7761 2.0723 1.2530 1.2663 1.2661 1.2642 1.2653 1.1859 2.9752 1.4102 1.4640 1.3919 1.4166 1.4526 2.0575 1.8806 2.2866 2.1297 2.2308 1.9048 3.7999 1.5578 1.8166 1.3939 1.5814 1.5330 4.0799 1.4431 3.1865 1.5686 1.2724 1.6333 5.0810 1.9968 2.1772 1.2469 1.2398 1.2004 1.2390 1.0983 1.3318 1.2872 1.2327 1.1216 1.2640 1.0473 1.0560 1.0474 1.0517 1.0513 1.0642 1.0586 1.0552 1.0624 1.0889 4.1171 3.2596 5.3523 5.8135 8.2099 6.6340 12.7419 12.6420 1.0706 1.0352 1.0349 1.0349 1.0348 1.0314 1.0699 1.0713 1.0944 1.1077 1.1080 1.1081 1.0847 1.1082 1.0678 1.1082 1.0999 1.1047 1.1013 1.1015 1.1017 1.1019 1.1062 1.0985 1.0914 1.0918 1.0928 1.0925 1.0781 0.0001 0.0009 0.0016 0.0059 0.0069 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15.6943 12.7362 30.2102 32.6274 6.4706 6.2846 6.2903 6.2975 6.3053 6.3224 6.6138 6.6756 6.8571 6.9979 7.0106 7.0250 6.8861 7.0370 6.8001 7.0914 7.1996 7.2513 7.2608 7.2667 7.2992 7.3035 7.3565 7.3756 7.4156 7.4301 7.5484 7.5483 8.5542 0.1165 0.2754 0.3148 0.1941 0.8632 3.8132 6.3062 4.9979 13.7116 0.6040 1.1394 1.5310 9.0416 4.4350 0.1701 0.4069 0.2276 0.5719 0.9598 1.4928 1.1125 6.2555 0.0643 2.4894 0.6965 2.9665 0.4512 1.3831 3.3977 7.6479 1.2510 0.0334 9.9898 4.6659 17.3573 1.4720 3.2951 6.4388 11.7080 10.2286 15.4004 5.3321 14.4219 0.1813 16.5688 5.8647 4.8339 1.2958 10.1036 4.0764 10.4420 0.1684 2.5386 9.5851 0.4341 20.5206 13.6489 10.4005 1.6893 0.0404 7.3014 3.5686 44.7478 20.1236 55.5486 4.5641 43.7483 6.0437 6.7523 4.0102 40.9284 47.1942 7.0897 1.3196 1.9669 11.2793 2.8243 18.5263 31.5037 25.9155 81.0049 4.7737 32.7386 0.9909 14.6363 33.1192 145.7216 109.5016 50.7619 32.9942 1.7061 0.1538 6.5240 3.9276 1.8870 2.0959 264.8813 40.8498 16.3721 1.4212 0.3702 1.7507 77.3702 82.3032 104.4731 124.3336 179.7895 301.6941 212.5683 76.5214 117.7485 18.2054 31.7436 45.3384 281.6496 93.0493 178.0063 57.6000 66.0159 16.2918 335.5843 28.5815 232.3633 103.1443 37.0469 7.6716 30.5015 2.9849 2.7377 21.3039 29.4687 10.7018 8.8284 0.0829 2.7312 15.2453 1.1538 9.7921 26.1973 43.3919 31.3122 11.0708 9.3584 288.3312 357.6939 36.2337 69.1743 256.2481 29.9759 765.3409 123.9296 20.7628 46.2980 42.5290 53.6067 26.2031 52.0944 1.1500 10.1854 4.6610 46.4293 48.5310 40.8185 2.1968 49.7587 8.4767 39.2965 0.4056 38.4987 28.2051 29.4510 15.7467 30.8236 8.3320 7.6086 6.5055 4.5845 2.3641 2.8664 41.5243 3.7934 1.8551 2.1750 0.8990 0.8990 0.0442 0.5619 0.2104 0.0960 0.5154 0.9107 0.8202 0.7241 1.1233 0.1421 1.2262 0.1313 1.2162 1.7761 0.5537 0.6421 1.2768 1.6551 0.6980 0.4807 0.6321 0.2421 0.3931 1.3556 0.2617 0.2178 0.3944 0.8668 0.1148 2.2123 4.1991 4.0886 0.8912 1.8436 0.4816 3.4553 1.7003 0.9149 1.4157 0.4739 1.6175 3.8384 1.4141 2.1168 4.3489 2.0574 0.1814 0.2260 1.4716 1.3820 11.1788 4.1426 0.6762 10.1094 0.4540 5.0310 16.5240 0.5129 7.0623 6.1509 13.8199 2.6387 1.2841 0.6999 3.4172 2.2682 1.7383 2.7146 1.3327 0.6456 1.4569 2.3783 2.1194 5.0385 8.1087 18.7546 11.3346 3.6981 14.8433 9.7467 17.0286 11.0208 4.4333 14.3851 15.2238 4.9329 7.9654 0.1828 3.1313 5.3980 5.6365 3.9091 8.9319 3.5569 2.3517 3.7970 4.6340 0.8096 0.4892 9.1826 1.5654 3.2788 0.3204 3.2337 6.1079 0.7933 11.7065 2.9150 3.5288 7.3616 11.0132 57.5306 7.5954 15.7159 8.8538 14.6094 19.5537 12.1599 4.5314 9.5972 6.2447 8.0823 19.2935 1.3864 9.4303 8.9866 12.1905 15.1826 21.4797 11.1156 24.0597 37.3689 13.8976 14.6775 7.8949 10.7710 16.2444 8.1114 12.2225 32.9984 119.0729 78.8994 0.6635 34.2060 6.3229 30.0009 104.2172 81.1035 94.8517 56.6459 138.7719 93.2386 51.7329 82.6729 82.1428 38.6441 38.9611 42.0709 22.2068 38.6806 104.8892 34.1737 75.6047 138.4731 128.4629 138.1316 102.5848 174.6461 67.0449 39.0592 24.2570 101.3206 40.6858 54.6975 15.6136 0.7495 0.7439 0.7463 0.7483 0.7449 0.7479 0.7493 0.7499 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12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 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 7128.3665 39408.5404 41569.4553 1.00000 0.00163 -0.00181 -0.00161 0.99997 0.00784 0.00182 -0.00784 0.99997 1 0.01215 0.00220 0.00208 0.25318 0.04580 0.04342 9.60 26.32 32.16 49.62 70.67 75.51 91.45 105.81 116.59 127.86 136.26 157.75 164.27 192.06 210.24 222.77 225.35 255.45 268.20 285.17 302.05 313.24 327.31 342.92 349.97 366.30 376.08 403.00 408.39 432.48 448.73 455.73 471.41 508.39 542.36 565.04 570.45 595.34 646.12 654.34 677.67 693.68 727.55 739.14 791.94 811.54 826.62 841.64 859.73 897.55 960.06 963.18 972.69 993.15 1007.54 1010.53 1031.91 1076.01 1131.41 1141.10 1149.77 1181.08 1189.21 1227.51 1285.28 1313.75 1330.61 1337.84 1342.25 1384.39 1408.76 1421.83 1476.23 1491.77 1511.84 1549.83 1583.85 1603.28 1626.51 1633.86 1645.23 1694.09 1705.50 1712.70 1721.48 1743.38 1796.24 1798.08 1821.35 1823.59 1853.19 1860.03 1860.34 1861.11 1861.71 1867.20 1880.53 1887.86 1904.76 1916.54 1918.78 1919.12 1933.27 1946.73 1962.49 1972.68 2001.99 2013.73 2025.94 2029.83 2044.85 2077.57 2083.57 2128.49 2134.42 2170.13 2187.55 2195.59 2225.20 2243.20 2269.55 2294.09 2296.19 2325.86 2332.08 2337.44 2347.56 2352.74 2359.15 2359.75 2367.08 2370.29 2372.70 2376.00 2376.26 2376.29 2377.07 2377.58 2380.87 2381.41 2384.34 2385.31 2396.59 2449.13 2461.29 2565.25 2588.44 2591.61 2597.18 2886.22 3011.28 4608.10 4618.44 4621.13 4623.89 4626.94 4640.80 4660.30 4678.95 4691.83 4711.38 4715.02 4719.51 4722.73 4723.39 4730.15 4741.54 4795.61 4802.24 4812.88 4814.39 4824.82 4825.72 4833.86 4857.07 4885.91 4889.86 4926.30 4926.91 5279.89 0.552914 0.583190 0.584134 0.487887 -1557.853046 -1557.822770 -1557.821826 -1557.918073 3.228140D-04 MUNgauss RevisionA2.0 retrievium 27-Dec-2020 DUDE COc1cc(cc(c1OC)OC)N2C(=O)C[C@H](C2=O)[NH+]3CCc4cc(c(cc4C3)OC)OC C22609170 RHF 6-31G(d) (6D,10F) C1 457.197477 |X|Y|Z| 51.950298 39.779326 141.241302 66.333930 21 6 7 19 2 |36.858105| |13.582447|73.516695| |8.014833|25.332642|36.858105| |6.737583|14.048461|13.692647|36.858105| |4.532175|9.318192|8.003431|13.816977|36.858105| |3.785485|8.212537|6.828970|7.868784|13.817596|36.858105| |3.978425|9.412124|7.891618|6.830694|8.004606|13.690666|36.858105| |5.262058|14.644624|13.669972|7.895233|6.933802|7.894066|13.674018|36.858105| |4.706194|12.789570|8.029302|5.233596|4.654490|5.232869|8.030738|14.147823|73.516695| |4.182978|10.434441|5.957300|4.283170|3.873617|4.285389|5.953279|8.133546|23.982594|36.858105| |3.216991|7.324581|5.293262|4.619459|5.241144|7.901030|14.241948|8.236966|12.791511|5.859666|73.516695| |2.661650|5.720509|3.978828|3.785899|4.531785|6.735396|8.014986|5.264237|8.374097|4.165643|24.160398|36.858105| |3.733128|7.011053|5.158763|7.868426|13.217696|7.843281|5.151858|4.548017|6.119919|3.010377|6.999678|3.724288|53.358707| |3.418091|6.167410|4.249044|5.963755|7.626105|5.521933|4.077321|3.739696|5.273039|2.721684|5.853211|3.159696|18.593047|36.858105| |3.575857|6.394782|4.306693|5.793438|6.573817|4.998003|3.943211|3.743670|5.338354|2.842655|5.700655|3.017331|11.297220|16.185709|73.516695| |2.765411|4.913024|3.239161|4.192788|5.087414|4.170538|3.227727|2.949659|4.340689|2.253862|4.888293|2.740834|11.015028|12.513307|14.034906|36.858105| |2.758254|4.907637|3.241020|4.195740|5.111553|4.196272|3.242416|2.957746|4.357759|2.203965|4.910424|2.762838|11.113987|8.002464|9.646594|12.470014|36.858105| |2.852188|4.926728|3.172152|4.098690|4.617619|3.709349|2.982907|2.820308|4.201284|2.122509|4.513685|2.490976|9.154452|6.659290|8.745189|8.841336|17.600459|0.500000| |3.162432|5.851901|4.084738|5.533112|7.701304|6.024594|4.274162|3.755664|5.308914|2.597586|6.195366|3.444917|18.997497|8.287713|9.888882|7.961211|12.415807|0.247731|36.858105| |2.973014|5.609969|3.889080|4.905784|6.538411|5.857158|4.320831|3.727573|5.355888|2.568268|6.433322|3.645672|11.295221|5.541387|7.487877|5.431383|7.880009|0.181899|16.053808|73.516695| |2.295361|4.118845|2.667100|3.247926|3.875278|3.482800|2.793629|2.522531|3.823906|1.946992|4.410715|2.560870|7.202735|5.120197|6.995809|7.361517|12.736737|0.254270|7.620004|11.915883|53.358707| |2.226882|4.074404|2.668212|3.202810|3.942675|3.711566|2.942185|2.587174|3.919514|1.994290|4.707642|2.802590|7.135993|4.900498|6.769453|6.533194|9.306575|0.183255|7.483703|12.639737|25.651856|0.500000| |2.028548|3.597393|2.276804|2.706486|3.110178|2.835543|2.352285|2.156809|3.333233|1.731936|3.782528|2.199480|5.489007|4.287009|6.262373|6.359230|7.560276|0.182867|4.956262|7.815581|17.209905|0.257127|36.858105| |1.774919|3.177005|1.994874|2.302022|2.627767|2.492583|2.115265|1.929483|3.031646|1.582101|3.487178|2.064307|4.380055|3.303835|5.021307|4.364561|4.972605|0.123798|3.871907|6.587352|10.458802|0.206183|12.519750|36.858105| |1.732200|3.107546|1.943056|2.217512|2.508856|2.401756|2.064176|1.888679|2.988284|1.544580|3.424704|2.028926|4.070748|2.924003|4.455793|3.627707|4.415383|0.114420|3.690960|6.692382|9.146553|0.183781|7.539299|12.595232|36.858105| |1.543327|2.774327|1.716880|1.920596|2.143469|2.087471|1.833569|1.685070|2.705087|1.407129|3.092305|1.841886|3.363618|2.417653|3.780816|2.881249|3.336181|0.087923|2.937985|5.400591|6.140515|0.127640|4.983191|7.564145|13.565173|36.858105| |1.485842|2.674351|1.644816|1.818692|2.008298|1.968767|1.754157|1.620929|2.624241|1.359830|2.978175|1.770579|3.082500|2.174520|3.425681|2.508106|2.924445|0.078530|2.680302|5.059130|5.116418|0.106290|3.857094|5.025949|7.875609|13.891003|36.858105| |1.584769|2.852595|1.755714|1.942789|2.138028|2.087050|1.861297|1.725567|2.789099|1.429812|3.143508|1.856110|3.263733|2.247828|3.513923|2.552995|3.079656|0.083975|2.890906|5.621370|5.319273|0.109166|3.725625|4.420921|6.810650|7.899163|13.390844|36.858105| |1.786260|3.210223|1.994505|2.244871|2.492742|2.395687|2.099762|1.941862|3.096581|1.571959|3.489457|2.045915|3.884094|2.629157|4.024995|3.020175|3.849525|0.105531|3.584103|7.097359|6.910179|0.138192|4.490676|5.006233|7.919631|6.898668|7.911605|13.907405|36.858105| |1.887671|3.384928|2.125419|2.444083|2.765115|2.617425|2.237911|2.053090|3.228485|1.645240|3.673137|2.155889|4.498581|3.101707|4.646324|3.761138|4.984577|0.132630|4.280363|8.120186|10.430371|0.199548|6.705674|7.579300|13.915396|7.962481|6.841761|7.889360|13.547769|36.858105| |2.208846|3.938175|2.506269|2.981067|3.413562|3.101094|2.578356|2.370682|3.650714|1.840274|4.111699|2.370275|5.853360|3.934392|5.650740|4.891357|7.644668|0.207529|6.081101|11.231957|17.127905|0.259280|7.775208|6.435354|7.562305|5.015925|4.439588|5.056501|7.639762|12.634758|36.858105| |1.489944|2.684085|1.636968|1.784502|1.937931|1.906251|1.730730|1.616766|2.643861|1.356198|2.949642|1.736872|2.890001|1.982249|3.140765|2.195042|2.594957|0.071474|2.503777|4.895508|4.249123|0.087400|2.964317|3.379700|4.617470|5.312644|8.181247|14.305578|7.933127|5.193701|3.891983|73.516695| |1.544411|2.781558|1.688772|1.829052|1.965870|1.930952|1.769658|1.666110|2.735763|1.392627|3.011909|1.757520|2.888680|1.951336|3.097106|2.117525|2.521523|0.070394|2.497171|4.964679|3.985164|0.081346|2.693228|2.917878|3.781610|3.984734|5.231992|8.030534|6.720082|4.492988|3.698989|24.116559|36.858105| |1.349506|2.430466|1.483132|1.619347|1.771073|1.750416|1.582528|1.469344|2.403765|1.253217|2.714187|1.615324|2.670835|1.893511|3.029228|2.144250|2.431333|0.065605|2.266331|4.260388|4.064950|0.084764|3.084999|3.872921|5.192810|7.936209|14.322109|8.190293|5.320580|4.633227|3.391845|13.219091|4.806908|73.516695| |1.263906|2.275454|1.384950|1.507400|1.646272|1.631739|1.479933|1.374578|2.255874|1.186242|2.549356|1.520875|2.478474|1.784559|2.883543|2.023993|2.231933|0.059905|2.066353|3.817798|3.680825|0.076999|2.889276|3.678035|4.494632|6.720082|8.028985|5.233033|3.987578|3.791714|2.923757|8.545003|3.553600|24.106442|36.858105| |17.566046|16.427822|7.026201|6.738592|4.593597|3.735269|3.784012|4.756016|7.371736|3.877114|5.442307|2.577201|5.315930|3.749834|7.268554|2.972080|2.870354|0.082482|3.215846|5.213129|3.204027|0.063082|2.103090|1.821759|1.753963|1.556659|1.485913|1.572162|1.771159|1.894383|2.223696|2.611068|1.509075|2.395893|1.268422|0.500000| |17.563531|16.437086|7.032517|6.730207|4.584032|3.729502|3.784808|4.768094|7.440817|3.593986|5.443029|2.582432|5.301230|3.483157|6.244433|2.869614|2.952971|0.086668|3.395063|5.718075|3.327269|0.065187|2.137375|1.860222|1.831560|1.623926|1.568980|1.688639|1.919789|2.021394|2.393142|2.821734|1.656498|2.521958|1.319966|0.298275|0.500000| |17.665452|17.013902|5.896571|4.913591|3.632876|3.183431|3.413012|4.430661|7.651825|3.989374|5.126254|2.408143|4.195642|2.873883|5.356145|2.397625|2.391288|0.068729|2.687321|4.556251|2.771373|0.054995|1.824210|1.615530|1.582892|1.424214|1.378173|1.467197|1.638119|1.716008|1.977046|2.470704|1.443601|2.241066|1.183771|0.299977|0.300184|0.500000| |7.458396|12.510426|8.847842|17.790907|8.952610|5.633013|4.935999|5.616195|7.492669|3.619060|6.519604|3.134001|9.892268|6.115747|10.722599|4.359846|4.347591|0.124088|5.332720|8.116976|4.471532|0.087322|2.773428|2.320866|2.226529|1.920109|1.813833|1.937574|2.246191|2.457320|3.032817|3.157530|1.820082|2.866421|1.501165|0.224557|0.223250|0.145878|0.500000| |3.133661|6.519811|4.935166|5.631912|8.948685|17.792706|8.849969|5.616717|7.493599|3.620167|12.515437|7.456480|9.838587|5.340073|8.320341|4.312105|4.349031|0.102691|6.185014|11.010984|5.111417|0.115913|3.033286|2.702780|2.591605|2.247440|2.104387|2.214429|2.536685|2.797727|3.269299|3.567220|2.010404|3.313877|1.740287|0.086738|0.086594|0.075104|0.124465|0.500000| |3.578394|8.422561|5.174103|4.019470|3.856692|4.473886|6.250138|7.189872|16.425869|17.586277|11.966677|4.777269|4.121196|2.763800|5.152697|2.291659|2.214012|0.058434|2.604959|4.564926|2.678386|0.056525|1.756180|1.611065|1.563683|1.426233|1.372643|1.434428|1.572036|1.653200|1.839141|2.411604|1.383888|2.250486|1.202836|0.095506|0.087344|0.093484|0.093930|0.107643|0.500000| |4.818037|12.003718|6.259687|4.471661|3.858505|4.024510|5.173393|7.193717|16.424919|17.587984|8.413213|3.563239|4.124288|2.802436|5.327954|2.295337|2.214425|0.059731|2.572869|4.433901|2.632984|0.054511|1.732884|1.570376|1.523333|1.383977|1.332401|1.397503|1.538518|1.618770|1.819964|2.350479|1.354700|2.181059|1.163674|0.126613|0.109249|0.129056|0.107623|0.094006|0.298331|0.500000| |3.681843|8.656389|4.678506|3.533859|3.226541|3.534224|4.675681|5.914960|16.896880|17.650780|8.643760|3.671227|3.536668|2.365682|4.357749|2.005892|1.978514|0.053253|2.300446|4.089348|2.413342|0.050402|1.588125|1.463944|1.438262|1.320562|1.283837|1.350673|1.474995|1.530280|1.694601|2.293769|1.329331|2.115528|1.127232|0.093702|0.089511|0.101592|0.085665|0.085667|0.299658|0.299661|0.500000| |2.408212|5.127657|3.413463|3.183812|3.632636|4.912334|5.896364|4.432397|7.659561|3.968452|17.016596|17.664359|4.187483|2.685653|4.616845|2.377922|2.395279|0.060747|2.892423|5.444091|3.071636|0.068200|1.972893|1.877046|1.855175|1.708066|1.654144|1.728501|1.880040|1.958191|2.116355|2.904961|1.655905|2.711146|1.441846|0.064536|0.064693|0.061669|0.075112|0.145850|0.127669|0.092982|0.101198|0.500000| |2.591147|5.470656|3.806350|3.751653|4.606110|6.746344|7.072253|4.797858|7.481779|3.594443|16.442728|17.565607|5.304644|3.208713|5.278053|2.845517|2.964278|0.073742|3.779348|7.451893|3.800443|0.086070|2.351073|2.220148|2.213607|2.003160|1.935354|2.048060|2.272484|2.380707|2.615270|3.401611|1.942930|3.120157|1.637574|0.069273|0.071382|0.064875|0.087040|0.222477|0.108832|0.087355|0.089556|0.300023|0.500000| |2.568335|5.416682|3.762789|3.713491|4.569940|6.716345|6.985582|4.729296|7.342205|3.845111|16.427994|17.558859|5.283216|3.392973|5.814506|2.934557|2.871149|0.070823|3.521710|6.407696|3.615454|0.081417|2.303794|2.156925|2.082056|1.883447|1.788091|1.851455|2.037242|2.180540|2.395412|3.053031|1.717054|2.895368|1.545166|0.070594|0.068845|0.064347|0.086306|0.225100|0.125076|0.094648|0.093137|0.300155|0.298264|0.500000| |2.649149|4.589774|2.933030|3.706404|4.184264|3.464685|2.807917|2.641017|3.963349|2.085550|4.307286|2.394582|8.061528|8.834239|12.628984|17.645554|8.610115|0.218924|5.735671|7.622991|8.220635|0.143713|6.061406|4.147406|3.402227|2.742931|2.384464|2.404224|2.803232|3.456675|4.355711|3.695342|2.000543|3.654945|1.957733|0.080173|0.076313|0.064466|0.110903|0.097400|0.058573|0.059630|0.051946|0.058688|0.068344|0.070805|0.500000| |2.484730|4.498633|2.964698|3.685086|4.558088|4.036491|3.136431|2.796157|4.160699|2.184728|4.874779|2.810962|8.974994|9.030551|11.945512|17.547139|8.713173|0.173836|6.582244|8.762438|9.456163|0.191874|6.468407|4.674621|3.721835|2.979806|2.552461|2.543542|2.953467|3.694948|4.514522|3.874360|2.074128|3.892557|2.091477|0.073649|0.070577|0.060626|0.102461|0.121697|0.062640|0.061285|0.054154|0.067854|0.080910|0.085472|0.300665|0.500000| |2.026696|3.536198|2.206395|2.619900|2.919314|2.614760|2.203849|2.060892|3.203199|1.665608|3.529801|2.022022|5.073258|3.985810|5.944530|5.688207|6.795637|0.191681|4.478809|7.076470|12.440559|0.181950|17.619434|8.767330|6.563158|4.594135|3.684780|3.620118|4.364941|6.226033|7.397621|5.184512|2.676862|5.294343|2.777308|0.058477|0.059800|0.050787|0.076148|0.075864|0.046537|0.046572|0.042574|0.050680|0.059692|0.058283|0.164305|0.147907|0.500000| |2.046396|3.633524|2.305114|2.747597|3.173838|2.891374|2.387643|2.183641|3.365454|1.766766|3.834720|2.230058|5.650740|4.724651|6.980126|7.528855|7.175570|0.166727|4.780235|7.237219|12.258238|0.214048|17.680186|8.836283|5.525487|4.096127|3.254250|3.112029|3.611322|4.922800|5.632953|4.550387|2.349068|4.808249|2.598470|0.059634|0.059187|0.051052|0.078135|0.086172|0.050076|0.049341|0.044801|0.055459|0.065318|0.065865|0.206500|0.234643|0.301333|0.500000| |1.655878|2.942412|1.825801|2.087612|2.337928|2.214017|1.908639|1.761029|2.791764|1.469196|3.161211|1.860414|3.827553|2.946841|4.600749|3.820448|4.123339|0.107061|3.258123|5.503438|7.646585|0.146911|9.007810|17.567842|8.856661|6.931844|4.673882|3.964041|4.247086|5.781353|4.988189|5.554008|2.686617|6.707334|3.744816|0.047386|0.048063|0.042147|0.058910|0.065906|0.041516|0.040683|0.037916|0.047401|0.054989|0.054004|0.105695|0.112705|0.219707|0.208920|0.500000| |1.739819|3.149026|1.989626|2.280092|2.640091|2.561314|2.168105|1.950764|3.066779|1.607384|3.611290|2.172149|4.356278|3.287705|5.032549|4.256565|4.603090|0.110228|3.778346|6.463870|9.068772|0.205935|8.887408|17.514439|8.875688|6.616305|4.586006|3.988781|4.364592|6.045238|5.304845|5.579213|2.719901|6.537308|3.589191|0.049612|0.050199|0.044014|0.062940|0.078668|0.045845|0.044129|0.041267|0.054872|0.064904|0.063760|0.109435|0.134373|0.173750|0.221950|0.304635|0.500000| |1.455746|2.616439|1.613539|1.795782|1.998055|1.954667|1.726167|1.587776|2.559885|1.342826|2.927480|1.748207|3.118433|2.281217|3.614344|2.716048|3.021661|0.079303|2.657755|4.801502|5.370906|0.112355|4.576655|7.083330|8.906861|17.753939|8.977992|5.619907|4.968257|5.676108|4.092664|7.613620|3.326811|12.627774|7.491233|0.040964|0.042269|0.037442|0.049859|0.058518|0.037945|0.036751|0.035048|0.045257|0.052344|0.050010|0.072698|0.079295|0.116845|0.109811|0.203971|0.185390|0.500000| |1.881245|3.379354|2.095499|2.351910|2.586237|2.474378|2.183015|2.033467|3.244595|1.631008|3.610782|2.095869|3.969136|2.625532|4.020318|2.933522|3.787983|0.106231|3.678267|7.519078|6.360873|0.125911|3.945034|4.091296|5.655492|4.968109|5.624747|8.984124|17.751166|8.882515|7.164658|12.623467|7.490555|7.620835|3.328343|0.051338|0.056698|0.047896|0.065392|0.071853|0.045000|0.044256|0.042579|0.053452|0.065003|0.057247|0.075364|0.078201|0.108477|0.090473|0.098168|0.101378|0.107832|0.500000| |2.366549|4.267086|2.745830|3.269362|3.780344|3.449274|2.852979|2.607921|3.988008|1.976949|4.518186|2.595270|6.338251|3.968853|5.675851|4.575857|7.150860|0.192325|6.954142|14.872162|12.354742|0.225931|5.653979|4.901898|5.705797|4.232381|3.982541|4.742733|7.127493|8.848118|17.706935|6.814133|3.828448|5.579451|2.688110|0.065249|0.071839|0.058520|0.090996|0.100565|0.054639|0.053913|0.050504|0.063900|0.080915|0.071717|0.110214|0.116466|0.148181|0.126506|0.109800|0.121621|0.097587|0.214653|0.500000| |2.245012|3.921468|2.456048|2.929938|3.237649|2.867168|2.420715|2.278443|3.525278|1.783831|3.835540|2.172397|5.514654|3.820265|5.574480|4.735380|7.145285|0.232289|5.402581|9.417855|12.446249|0.182568|7.116448|5.568800|6.175681|4.405817|3.973328|4.492906|6.365392|8.793054|17.582225|6.386628|3.479281|5.558284|2.724754|0.063053|0.068236|0.055917|0.085129|0.081782|0.049147|0.049440|0.045724|0.054197|0.065616|0.060836|0.123910|0.116271|0.225527|0.147233|0.130243|0.124782|0.102722|0.174215|0.300906|0.500000| |1.630065|2.961578|1.810801|1.957672|2.119769|2.101217|1.924601|1.799186|2.947941|1.488940|3.283174|1.924382|3.092171|2.053333|3.242163|2.204899|2.649263|0.073163|2.696484|5.504278|4.162878|0.086437|2.724190|2.911922|3.728318|3.790191|4.737632|7.042685|6.706701|4.550175|3.864693|16.432749|17.567691|7.538118|3.241871|0.044015|0.048606|0.042186|0.053625|0.061000|0.041110|0.040009|0.039443|0.050259|0.059786|0.051844|0.057114|0.060029|0.074040|0.066266|0.073066|0.076536|0.088075|0.224724|0.116117|0.098184|0.500000| |1.598748|2.852767|1.723490|1.876009|1.996749|1.932291|1.768607|1.681142|2.754293|1.399872|2.980526|1.719243|2.947621|1.994821|3.163271|2.168179|2.605036|0.074282|2.552043|5.030073|4.071856|0.081042|2.751895|2.908883|3.731132|3.789919|4.738624|7.049634|6.709608|4.554173|3.877810|16.433968|17.566702|7.537002|3.241306|0.043389|0.047977|0.041499|0.052370|0.055314|0.038448|0.038007|0.037082|0.044829|0.052513|0.046652|0.057331|0.058208|0.077688|0.066269|0.074869|0.073854|0.088042|0.224181|0.110979|0.105194|0.298231|0.500000| |1.436953|2.588906|1.560505|1.672335|1.783640|1.762327|1.634337|1.546014|2.562497|1.310701|2.804031|1.635653|2.589753|1.759755|2.822774|1.891608|2.207337|0.061614|2.196900|4.326517|3.423000|0.070112|2.348668|2.542005|3.181529|3.419807|4.414281|5.906450|4.908106|3.608219|3.059176|17.007681|17.673337|7.818122|3.361400|0.038946|0.042644|0.037552|0.046175|0.050815|0.036171|0.035389|0.034940|0.043174|0.049955|0.044309|0.049927|0.051655|0.064938|0.057855|0.066086|0.066640|0.082206|0.146298|0.087601|0.080961|0.299944|0.299935|0.500000| |1.258587|2.252694|1.367332|1.493930|1.624798|1.596168|1.444776|1.348321|2.209475|1.165047|2.475176|1.467436|2.462067|1.793270|2.904561|2.053203|2.248314|0.060804|2.044310|3.724774|3.703550|0.076110|3.000566|3.845020|4.558679|6.710058|7.047637|4.739274|3.792412|3.740736|2.917610|7.535698|3.241139|16.432842|17.570840|0.035230|0.036521|0.032748|0.041590|0.047068|0.032777|0.031886|0.030715|0.038558|0.043638|0.041547|0.055825|0.058786|0.081437|0.074979|0.113790|0.101670|0.224360|0.088071|0.073170|0.076978|0.081771|0.085013|0.084671|0.500000| |1.273695|2.305127|1.409707|1.534165|1.688981|1.687430|1.526118|1.406962|2.305754|1.214892|2.640432|1.588852|2.544296|1.835259|2.965026|2.084044|2.276337|0.060181|2.116204|3.905378|3.771084|0.080511|2.964045|3.850447|4.551807|6.706084|7.041000|4.737056|3.791814|3.737992|2.911767|7.536518|3.241686|16.432214|17.569937|0.035562|0.036797|0.033083|0.042209|0.050422|0.034379|0.033040|0.032018|0.041851|0.047549|0.045086|0.055618|0.060654|0.077249|0.074956|0.107688|0.108980|0.224557|0.088108|0.074584|0.074095|0.085043|0.081768|0.084688|0.298252|0.500000| 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