Version2.4 2021-06-07T03:22:40Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 24-Dec-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE c1cc(ccc1[C@@H]2C(=C(C(=O)N2CCN3CCOCC3)[O-])C(=O)c4ccc5c(c4)OCCO5)[N+](=O)[O-] C35005055 RHF 6-31G(d) (6D,7F) c1cc(ccc1[C@@H]2C(=C(C(=O)N2CCN3CCOCC3)[O-])C(=O)c4ccc5c(c4)OCCO5)[N+](=O)[O-] C01[X(C25H24N3O8)] 174 C1 588 O=C1C(=C([C@H](N1CCN1CCOCC1)c1ccc(cc1)[N+](=O)[O-])C(=O)c1ccc2c(c1)OCCO2)[O-] O=C1C(=C([C@H](N1CCN1CCOCC1)c1ccc(cc1)[N+](=O)[O-])C(=O)c1ccc2c(c1)OCCO2)[O-] [O-]C1=C([C@H](N(CCN2CCOCC2)C1=O)c3ccc(cc3)[N+]([O-])=O)C(=O)c4ccc5OCCOc5c4 InChIKey=DMUUAQUIAXOBBJ-JOCHJYFZSA-M InChI=1S/C25H25N3O8/c29-23(17-3-6-19-20(15-17)36-14-13-35-19)21-22(16-1-4-18(5-2-16)28(32)33)27(25(31)24(21)30)8-7-26-9-11-34-12-10-26/h1-6,15,22,30H,7-14H2/p-1/t22-/m1/s1 InChI=1/C25H25N3O8/c29-23(17-3-6-19-20(15-17)36-14-13-35-19)21-22(16-1-4-18(5-2-16)28(32)33)27(25(31)24(21)30)8-7-26-9-11-34-12-10-26/h1-6,15,22,30H,7-14H2/p-1/t22-/m1/s1/fC25H24N3O8/h30h/q-1 c1cc(ccc1[C@@H]2C(=C(C(=O)N2CCN3CCOCC3)[O-])C(=O)c4ccc5c(c4)OCCO5)[N+](=O)[O-] C01[X(C25H24N3O8)] 174 C01 588 O=C1C(=C([C@H](N1CCN1CCOCC1)c1ccc(cc1)[N+](=O)[O-])C(=O)c1ccc2c(c1)OCCO2)[O-] O=C1[C](=O)[C]([C](=O)[C]2[CH][CH][C]3[C]([CH]2)OCCO3)[C@H](N1CCN1CCOCC1)[C]1[CH][CH][C]([CH][CH]1)[N]([O])[O] [O]N([O])[C]1[CH][CH][C]([CH][CH]1)[C@@H]2[C](C(=O)[C]3[CH][CH][C]4OCCO[C]4[CH]3)C(=O)C(=O)N2CCN5CCOCC5 InChIKey=SPXBSXRMGXTCSQ-JOCHJYFZSA-N InChI=1S/C25H24N3O8/c29-23(17-3-6-19-20(15-17)36-14-13-35-19)21-22(16-1-4-18(5-2-16)28(32)33)27(25(31)24(21)30)8-7-26-9-11-34-12-10-26/h1-6,15,22H,7-14H2/t22-/m1/s1 InChI=1/C25H24N3O8/c29-23(17-3-6-19-20(15-17)36-14-13-35-19)21-22(16-1-4-18(5-2-16)28(32)33)27(25(31)24(21)30)8-7-26-9-11-34-12-10-26/h1-6,15,22H,7-14H2/t22-/m1/s1 3855.6843595306 -1722.820044 1-A 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0.2874 0.2911 0.2011 0.4179 0.3417 0.1940 0.2840 0.4667 0.4561 0.3144 0.5597 0.6354 0.3713 0.2892 1.1997 0.8635 1.1273 0.5589 0.4595 0.8424 0.7635 0.8858 1.5004 1.9475 1.4973 1.0165 1.9292 0.8183 0.8810 1.2094 1.8650 1.4057 1.7664 1.3261 1.1429 0.7545 1.8278 2.0061 2.5693 2.4484 1.4484 3.3957 2.4002 0.7414 0.8202 0.7691 2.0016 4.7249 1.6153 1.2204 1.6037 1.3444 0.9629 1.5641 0.9041 2.1440 1.0810 2.0579 2.0119 1.0091 1.7176 2.0913 2.2707 2.5385 1.8812 1.6348 1.4317 2.5011 2.0904 2.5721 1.7975 2.0402 2.1317 2.7731 3.0846 3.0816 3.3779 3.5319 1.3490 3.7370 2.8791 3.5852 1.3911 2.0602 2.1970 1.6569 1.9507 1.6512 1.6177 1.5904 1.6685 2.5146 1.7434 1.6193 1.9024 1.8522 2.0305 1.7265 3.9167 1.9978 1.9496 2.2440 2.0378 3.5851 2.6877 3.5081 2.4683 4.9769 19.4880 1.7767 1.7462 1.7617 1.7604 1.8257 1.8457 1.8142 1.8119 3.7643 4.8655 13.2939 14.7369 10.3057 21.1687 13.8318 22.6484 28.6225 27.5114 6.1544 6.2179 6.3513 6.3748 6.4731 6.4217 6.5098 6.4786 6.7499 6.7189 6.7031 6.9123 6.9504 6.9120 7.0147 7.0257 7.1228 7.2819 7.3397 7.4092 7.4337 7.4638 7.5962 7.6036 0.7780 0.6915 0.0183 0.1506 0.3007 0.3214 1.1988 5.0908 1.6584 0.7856 1.8200 2.2532 8.6003 0.3891 1.7806 0.6098 3.5264 0.3705 4.1358 3.4920 0.5385 6.7517 0.7016 0.6051 3.4536 1.4855 3.8035 2.6742 1.7034 12.9466 2.0265 5.3849 3.3455 2.5742 7.8359 0.2282 1.3500 8.4107 11.2026 0.1777 0.5222 1.0909 7.1751 2.9307 13.1899 2.7320 46.9077 14.0927 7.1758 0.8695 18.4611 8.6340 14.8193 0.2703 2.4573 6.0379 16.1591 29.4909 48.7269 57.7062 26.4146 39.1080 37.2477 2.3689 38.8441 4.7540 8.5968 3.5924 5.6289 21.3017 22.9960 23.7836 20.6366 59.3406 16.9910 14.4785 25.1449 1.1226 11.8618 3.0255 2.0582 33.6282 1.8147 5.3247 5.3860 9.7883 28.4600 30.9498 23.3584 1.5436 33.1297 13.1894 45.2675 20.7755 29.1442 28.7704 26.3988 58.1618 92.5045 42.5617 26.3671 10.2245 33.3289 40.6870 52.4870 24.5342 55.9622 61.0036 19.3549 126.4874 28.7036 32.9620 24.3609 20.7400 363.4315 37.4549 7.3992 70.9774 40.5830 30.1402 0.4389 733.8656 63.6122 16.0952 72.3057 30.2209 27.2419 24.9544 127.1855 16.0144 479.3447 497.7017 21.4046 8.1671 1.4982 7.1257 11.6567 1.3548 5.0576 0.3832 0.6016 89.8847 115.6298 97.0878 48.6367 254.5916 115.1396 344.0625 706.9748 609.1871 39.6684 65.4926 38.3377 22.1744 50.7660 111.3108 41.4400 73.1051 7.8549 57.7077 50.1721 79.3375 81.6887 21.4347 69.9077 73.2081 32.1408 11.2189 11.0065 16.0990 1.5714 0.9528 0.5465 0.1664 0.7832 1.1296 1.1469 0.6676 5.3124 2.9480 2.1405 1.2824 1.2953 1.6110 0.7858 0.1411 0.3288 0.1301 1.0159 0.8863 2.5313 0.5842 1.5529 1.6730 1.5452 4.8316 0.2964 1.3551 1.3343 1.9409 1.2977 1.7940 1.4455 1.3179 1.5695 2.1750 0.3605 1.2309 1.1674 0.1076 1.4497 1.4106 1.0471 1.0187 0.7487 2.8085 3.7013 1.2111 1.2198 1.3695 0.5022 3.0370 2.6641 6.4580 1.4175 1.3558 3.1582 2.5591 0.3716 0.4839 4.3251 11.2772 7.8628 4.2328 3.1600 10.7010 10.3760 19.4155 2.9362 1.2478 5.0600 1.2281 1.0776 2.4462 15.3486 1.4378 3.8620 3.2230 0.8079 2.0393 2.2775 0.4742 3.7647 4.9035 4.0384 5.1282 1.2037 9.3392 3.1387 5.2834 2.7164 1.3628 0.3828 0.9857 5.8243 4.8957 90.1080 2.8936 3.5580 5.6780 7.7670 6.8861 1.3572 9.2273 11.0446 2.4167 7.1444 4.6812 9.1233 8.5870 24.9765 8.0575 7.6143 12.2506 4.0334 3.1788 3.7369 3.3883 35.8611 5.1958 18.9529 14.5029 3.0505 3.0115 2.4239 23.5636 6.5788 0.4557 1.9957 1.8692 9.6696 3.0647 1.3146 3.2826 16.2278 342.4491 13.9707 33.7637 4.8679 1.2020 17.1772 6.6679 2.5501 10.4272 31.0314 1.1235 2.9676 14.4771 178.7739 73.6395 47.3797 0.7272 59.8355 44.1430 36.2107 88.6989 62.0525 12.8445 44.1238 86.5886 167.2786 23.7323 14.7243 37.0411 94.3592 119.2193 77.3981 124.8725 150.1400 151.9810 36.7349 55.3724 35.7622 106.5629 29.6375 50.8649 57.5426 73.5012 0.7059 0.6743 0.7467 0.7169 0.7498 0.7417 0.7302 0.7497 0.7495 0.7116 0.7424 0.7397 0.6950 0.7092 0.7459 0.0604 0.7372 0.6915 0.6549 0.6970 0.1912 0.4171 0.7316 0.5530 0.3689 0.7401 0.6032 0.2859 0.4753 0.7463 0.1204 0.7196 0.2919 0.7442 0.7039 0.3268 0.0602 0.5662 0.5546 0.5518 0.6994 0.7459 0.7398 0.4781 0.2736 0.5069 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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 6 6 6 1 6 6 6 8 7 6 6 7 6 6 8 6 6 8 6 8 6 6 6 6 6 6 8 6 6 8 7 8 8 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 1.00783 12.00000 12.00000 12.00000 15.99491 14.00307 12.00000 12.00000 14.00307 12.00000 12.00000 15.99491 12.00000 12.00000 15.99491 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 15.99491 14.00307 15.99491 15.99491 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783
13969.0231 29931.0091 31921.5363 0.99999 0.00414 -0.00258 -0.00407 0.99962 0.02725 0.00269 -0.02724 0.99963 1 0.00620 0.00289 0.00271 0.12920 0.06030 0.05654 17.76 21.13 26.25 28.81 41.93 55.28 62.79 84.86 92.89 99.72 108.04 132.78 139.67 162.16 188.34 211.08 229.98 256.15 268.36 323.78 341.23 360.66 385.23 406.34 429.66 459.17 487.13 493.53 516.99 533.28 543.72 546.36 591.19 608.51 635.59 661.39 671.19 714.31 718.12 734.90 746.50 768.59 778.30 819.02 820.92 830.83 854.18 906.77 927.55 990.10 1000.31 1009.65 1038.06 1074.75 1085.99 1142.14 1150.65 1171.66 1202.79 1210.34 1234.59 1263.57 1275.70 1286.24 1310.59 1319.59 1359.24 1359.92 1363.21 1388.69 1391.01 1402.23 1407.90 1424.76 1437.37 1467.28 1516.81 1557.42 1572.86 1587.23 1599.64 1603.16 1606.19 1634.31 1644.11 1652.86 1703.21 1729.94 1734.11 1737.88 1744.97 1756.11 1779.52 1794.41 1799.75 1827.85 1835.91 1841.45 1846.70 1862.47 1871.26 1878.61 1898.91 1915.98 1937.64 1940.80 1961.15 1971.71 2006.79 2021.67 2030.21 2034.89 2059.33 2071.40 2084.51 2097.85 2111.23 2136.08 2144.16 2157.15 2168.94 2204.98 2211.66 2223.08 2250.33 2252.82 2272.63 2275.93 2285.26 2293.07 2302.31 2341.51 2354.18 2359.52 2371.52 2372.54 2379.77 2385.58 2390.63 2397.49 2403.87 2425.52 2539.06 2561.85 2583.97 2611.01 2622.26 2660.33 2802.61 2830.09 4488.04 4509.78 4569.29 4578.10 4580.32 4592.51 4618.69 4627.68 4656.72 4672.79 4678.67 4706.04 4714.51 4719.28 4731.63 4735.96 4767.14 4847.22 4861.34 4874.64 4892.10 4899.52 4939.08 4940.43 0.508665 0.537610 0.538554 0.442596 -1722.311379 -1722.282435 -1722.281490 -1722.377448 3.218447D-04
MUNgauss RevisionA2.1 retrievium 07-Jun-2021 DUDE c1cc(ccc1[C@@H]2C(=C(C(=O)N2CCN3CCOCC3)[O-])C(=O)c4ccc5c(c4)OCCO5)[N+](=O)[O-] C35005055 RHF 6-31G(d) (6D,10F) C1 494.156340 |X|Y|Z| 65.546396 58.140352 114.421373
75.830609 30 6 7 8 25 2 3
|36.858105| |13.841944|36.858105| |7.999138|13.709781|36.858105| |6.861788|7.882436|13.807930|36.858105| |7.956741|6.875270|8.011984|13.753479|36.858105| |13.643568|7.893094|6.884430|7.881911|13.725360|36.858105| |7.490548|4.992619|4.431409|4.983421|7.498298|12.436264|36.858105| |5.606485|4.205885|4.030765|4.832241|7.445940|9.002014|17.523084|0.500000| |6.117784|4.308044|3.714709|3.930559|5.178082|7.416575|12.530688|0.240984|36.858105| |5.092401|3.743994|3.163932|3.218890|3.975460|5.409415|7.913946|0.166982|13.454167|36.858105| |5.117846|3.770972|3.203299|3.273795|4.060270|5.507648|8.085848|0.172396|8.083143|12.365407|36.858105| |4.103319|3.232591|2.781711|2.802255|3.326024|4.215628|5.437968|0.127961|5.408115|7.718755|15.869076|73.516695| |6.271256|4.413170|3.823727|4.069778|5.414124|7.777900|13.087884|0.254706|8.178844|8.154611|14.045513|14.946989|53.358707| |5.113716|4.001378|3.642522|3.924069|4.975217|6.093997|7.451875|0.189757|5.107511|5.111215|7.786484|12.040592|17.984406|36.858105| |3.744739|3.105401|2.962691|3.281065|4.074607|4.510455|5.664362|0.169252|4.271243|4.265769|5.867638|9.843672|10.503283|12.448581|36.858105| |3.155281|2.761894|2.699694|2.964210|3.473115|3.629304|4.091382|0.120766|3.249637|3.250762|4.197099|7.480091|6.909460|7.693257|13.082453|53.358707| |2.664352|2.383649|2.386633|2.659927|3.070421|3.080154|3.444015|0.105793|2.834535|2.784216|3.367719|5.937304|5.338476|5.096687|7.853499|17.873565|36.858105| |2.328749|2.148371|2.174003|2.386399|2.642426|2.606537|2.782556|0.083198|2.348175|2.317709|2.742139|4.914108|4.232520|3.925765|5.075134|10.672146|12.532514|36.858105| |2.190809|2.026101|2.015667|2.157967|2.362293|2.386477|2.547915|0.074038|2.198907|2.227037|2.661176|4.930066|3.972708|3.661057|4.524486|9.189405|7.899048|13.607369|73.516695| |2.426009|2.230392|2.181844|2.299377|2.518847|2.601919|2.766045|0.078346|2.367509|2.435897|3.003338|5.685281|4.481499|4.308965|5.074017|10.663083|6.806006|8.196095|24.155153|36.858105| |2.816022|2.499510|2.396922|2.538201|2.876912|3.071863|3.411612|0.096121|2.869103|3.001258|3.904912|7.522749|5.878548|6.058829|7.848162|17.834668|8.020367|6.809959|14.045194|12.539708|36.858105| |4.069215|3.193578|2.721392|2.719807|3.211770|4.102624|5.287957|0.122322|7.885592|15.785968|7.975256|11.717604|7.492165|3.983283|3.492498|3.797386|2.440756|2.074173|3.594927|2.200600|2.659507|73.516695| |5.100926|3.945034|3.524326|3.732864|4.673995|5.871763|7.279213|0.176087|13.318666|7.549748|5.077389|6.940129|6.973828|3.756481|3.325623|3.640082|2.423675|2.054960|3.412057|2.030253|2.382279|10.967919|36.858105| |4.231351|3.459271|3.072370|3.140828|3.690659|4.446564|5.104035|0.126091|8.086489|6.419911|4.307123|6.231964|5.554448|3.133412|2.813346|3.165886|2.126182|1.834181|3.083922|1.832822|2.123794|11.050136|15.716553|73.516695| |4.608426|3.814398|3.679530|4.144547|5.225958|5.686608|6.250524|0.176095|7.513527|4.927051|3.936595|5.625285|5.853371|3.417694|3.130479|3.511190|2.401993|2.048096|3.339423|1.954104|2.250932|7.415255|12.503857|14.573726|36.858105| |3.900782|3.302545|3.317248|3.917539|5.041695|5.040087|5.844907|0.193437|6.058383|4.291296|3.692727|5.375941|5.654619|3.452572|3.345150|3.746115|2.634825|2.214291|3.544455|2.038396|2.346592|6.465012|7.453982|9.807282|13.695664|36.858105| |3.309392|2.966977|3.117618|3.753329|4.515899|4.119723|4.341120|0.141729|4.253950|3.281362|2.955306|4.465399|4.523420|2.935678|2.900203|3.390675|2.449302|2.103806|3.340437|1.893869|2.128345|5.117566|4.981965|7.339239|7.898733|13.769368|36.858105| |3.192225|2.984457|3.204263|3.797709|4.239790|3.783408|3.696541|0.113029|3.677332|2.902364|2.606912|3.989696|3.939793|2.583330|2.491927|2.981949|2.140011|1.883259|3.020423|1.720259|1.904857|4.618540|4.419625|6.874751|6.832212|7.947425|13.774758|36.858105| |3.548325|3.348473|3.531568|4.010665|4.354658|4.038200|3.793987|0.109295|3.939941|3.076026|2.687601|4.086712|4.004670|2.568386|2.399027|2.859095|2.009492|1.777805|2.890249|1.668463|1.852273|4.927579|5.028190|8.041305|7.913810|6.897329|7.954429|13.719874|36.858105| |4.282852|3.831045|3.804366|4.182815|4.784991|4.860129|4.659992|0.127972|5.228858|3.855482|3.200538|4.743267|4.713785|2.885700|2.628314|3.057187|2.105217|1.840357|3.015367|1.762048|1.987702|6.092888|7.605803|11.731660|13.743801|7.975163|6.893676|7.936605|13.782688|36.858105| |3.144010|3.116972|3.331764|3.625294|3.657819|3.383539|3.093378|0.087116|3.197480|2.617942|2.321936|3.602984|3.413201|2.234994|2.081676|2.532766|1.783242|1.606058|2.631072|1.519427|1.664356|4.289274|3.914376|6.638657|5.232733|4.616847|5.218014|7.945610|13.961143|8.057639|73.516695| |2.743159|2.778440|3.071404|3.400976|3.325700|2.965683|2.705143|0.077633|2.700443|2.261324|2.064652|3.248507|3.057747|2.058763|1.945979|2.410834|1.720087|1.566816|2.554252|1.462633|1.582192|3.710019|3.139911|5.276898|4.040162|3.894548|4.686748|7.080154|8.195336|5.312565|24.191825|36.858105| |2.460186|2.429197|2.652850|2.996772|3.045549|2.725212|2.588410|0.076324|2.580505|2.173454|1.993854|3.151416|2.946815|1.997888|1.935399|2.401950|1.742787|1.583206|2.564833|1.452244|1.569126|3.574604|2.979709|4.982606|3.871467|4.042963|5.305092|8.186200|7.060536|4.679048|14.203393|12.577685|36.858105| |2.686117|2.589347|2.834992|3.330754|3.530874|3.097158|2.992003|0.091137|2.924717|2.410892|2.220964|3.473927|3.336897|2.258064|2.211147|2.715951|1.981854|1.775431|2.842532|1.602966|1.745636|3.897543|3.356568|5.406036|4.586848|5.241901|8.051384|13.954011|7.925542|5.207314|12.057089|7.979278|13.587578|73.516695| |5.137488|7.768759|13.122215|7.802249|5.140618|4.515452|3.312716|0.086036|2.912915|2.571148|2.598102|4.140515|4.058857|2.916036|2.463951|3.154876|2.089073|1.953287|3.246565|1.963061|2.101060|4.061432|2.834481|4.560800|2.970474|2.723364|2.645419|2.786343|3.056440|3.160770|5.396805|2.899309|2.476918|4.560281|53.358707| |4.675695|7.055592|8.374522|5.425588|4.095622|3.889761|2.975973|0.076154|2.700910|2.450422|2.469365|3.994411|3.749384|2.682445|2.263384|2.911055|1.920930|1.809331|3.053042|1.858098|1.980716|3.938766|2.628886|4.330345|2.675412|2.425935|2.334468|2.452542|2.713607|2.846329|4.857262|2.587435|2.219051|4.026243|21.677839|73.516695| |4.091112|5.406854|8.369260|7.075852|4.674302|3.888889|2.975055|0.079852|2.614186|2.304208|2.330705|3.740906|3.640925|2.659260|2.318404|3.013630|2.036123|1.923532|3.169302|1.889670|1.995021|3.660361|2.574681|4.149389|2.772621|2.614065|2.618712|2.792674|2.992907|2.970595|5.363247|3.000044|2.568040|4.703605|21.651461|16.041800|73.516695| |17.747320|8.967609|5.673964|4.948683|5.660566|8.916834|6.990935|0.140926|6.563181|6.040794|5.946662|8.416316|8.905913|5.031429|3.662288|4.160847|2.561462|2.237874|3.808766|2.394091|2.809463|8.606349|5.227916|8.014376|4.312360|3.605168|3.013599|2.884999|3.211415|3.940022|5.096829|2.487338|2.254307|4.335294|5.669337|7.152530|6.041952|0.500000| |8.914262|17.784455|8.915864|5.634793|4.958541|5.620219|4.071173|0.096436|3.728052|3.405278|3.413024|5.369381|5.156377|3.478731|2.750367|3.387985|2.158175|1.973793|3.358372|2.087259|2.312460|5.351758|3.470898|5.646022|3.285554|2.846619|2.582533|2.622114|2.954479|3.352417|5.028189|2.534065|2.211951|4.111411|9.759642|14.091551|8.807400|0.214820|0.500000| |4.951536|5.630001|8.944533|17.785010|8.879364|5.617745|4.066096|0.114654|3.316208|2.768868|2.815188|4.373846|4.656039|3.392554|2.975026|3.763799|2.552964|2.330357|3.713663|2.190414|2.368324|4.242464|3.225416|4.923278|3.675775|3.614491|3.657667|3.786977|3.865803|3.791085|6.377002|3.538972|3.131405|6.172564|9.795689|8.832957|14.147401|0.107543|0.124258|0.500000| |5.651908|4.954028|5.686885|8.958974|17.727052|8.926172|6.974159|0.230358|4.866355|3.737851|3.821996|5.622702|6.894315|4.795325|4.261649|4.937407|3.319442|2.810102|4.360553|2.558545|2.917478|5.411597|4.478632|6.259368|5.318437|5.748274|5.332719|4.727473|4.488035|4.698720|6.501372|3.406517|3.247338|6.999733|5.679545|6.052036|7.164362|0.124334|0.107633|0.214863|0.500000| |5.636231|4.548103|4.285707|4.741953|6.042879|6.927821|7.048400|0.185220|4.645817|4.346156|5.788448|8.936008|12.509371|17.584212|8.879642|9.568651|4.910662|3.947564|6.358990|4.154806|5.337127|6.146825|3.588824|5.305905|3.410594|3.450450|3.008699|2.685057|2.666414|2.949656|4.145803|2.167747|2.085982|4.197617|4.565196|5.360279|5.436908|0.142380|0.106528|0.112396|0.158065|0.500000| |4.673594|3.783874|3.363204|3.456247|4.110278|4.990355|5.655658|0.139750|4.388037|4.718690|7.386600|13.421232|12.684627|17.634587|8.816931|9.471487|4.585169|3.749754|6.580147|4.613382|6.606411|6.855891|3.320182|5.103271|2.970514|2.938364|2.537561|2.280463|2.294950|2.572370|3.617915|1.878926|1.814110|3.586189|3.767404|4.639347|4.454152|0.134291|0.094908|0.083764|0.107506|0.302662|0.500000| |3.387547|2.806362|2.635799|2.859734|3.490566|3.948299|5.139941|0.149422|4.251221|4.516376|6.341844|11.408084|9.654780|8.849673|17.473216|12.236816|6.592591|4.486029|7.525623|4.694353|7.331709|6.719305|3.301676|5.052178|3.021261|3.209314|2.751830|2.359679|2.281290|2.519093|3.524999|1.843130|1.842344|3.719157|3.023881|3.678927|3.709752|0.095210|0.070300|0.072291|0.100524|0.173956|0.210055|0.500000| |3.718558|3.093092|3.029447|3.484039|4.470318|4.731158|6.081852|0.206592|4.454104|4.162742|5.221505|8.243048|9.550730|8.915704|17.562540|12.540845|7.664671|4.852267|7.228402|4.242209|5.734435|6.018051|3.543628|5.222121|3.465709|3.876280|3.359212|2.803077|2.635567|2.859027|3.998514|2.109240|2.122767|4.397062|3.408005|4.026916|4.240549|0.098250|0.074985|0.088712|0.137970|0.215517|0.174146|0.302485|0.500000| |2.460660|2.189685|2.170244|2.396239|2.767489|2.822521|3.240526|0.099401|2.764183|2.761970|3.305485|5.924887|5.018855|4.512911|6.952979|12.240661|17.402289|8.881116|12.469825|5.882740|7.095592|4.366943|2.376428|3.739528|2.334803|2.572623|2.379684|2.065930|1.936388|2.034097|3.051362|1.650416|1.684486|3.400396|2.597333|3.143710|3.300270|0.066714|0.055504|0.063792|0.082954|0.115354|0.114847|0.189585|0.189783|0.500000| |2.752070|2.466905|2.517583|2.883254|3.370905|3.271412|3.635780|0.116326|2.939523|2.793100|3.283835|5.585380|5.347045|4.919141|7.217940|12.479803|17.555326|8.911620|10.162110|5.057541|5.742556|4.312738|2.544071|3.923051|2.586571|2.906478|2.737495|2.361926|2.180637|2.259805|3.412030|1.862012|1.901008|3.897020|2.982227|3.533483|3.833424|0.072152|0.061289|0.077747|0.104886|0.137806|0.117020|0.162018|0.235393|0.300651|0.500000| |2.099043|1.950019|1.986326|2.185177|2.401618|2.346535|2.504312|0.075461|2.154280|2.116983|2.444060|4.362093|3.713597|3.293516|4.169932|7.687330|8.833439|17.589428|16.910841|5.885854|5.064377|3.403019|1.917848|3.063479|1.929819|2.104412|2.026677|1.815597|1.699922|1.742928|2.738749|1.513263|1.543074|3.075016|2.453061|2.970409|3.182192|0.056049|0.049951|0.059952|0.071592|0.091795|0.086954|0.106352|0.115656|0.216994|0.210843|0.500000| |2.412878|2.259573|2.320233|2.558438|2.788226|2.693929|2.785799|0.082941|2.319603|2.259739|2.657256|4.699486|4.176507|3.905200|4.717739|9.567654|8.887722|17.493372|16.551146|7.267000|5.907029|3.578298|2.039527|3.228447|2.051217|2.206112|2.114494|1.912136|1.808765|1.861932|2.919015|1.610480|1.617569|3.218744|2.852736|3.430727|3.694040|0.063558|0.057499|0.070033|0.082111|0.114673|0.103345|0.111517|0.126945|0.173993|0.217921|0.300072|0.500000| |2.224666|2.057976|1.996366|2.072606|2.246260|2.340638|2.483767|0.069448|2.180275|2.277720|2.781132|5.382611|4.012137|3.696148|4.169915|7.683932|5.064672|5.888782|16.907153|17.596472|8.840422|3.721455|1.883688|3.060210|1.799200|1.860240|1.729192|1.581762|1.543446|1.632216|2.515060|1.360620|1.349100|2.626716|2.470712|3.089712|3.099241|0.061766|0.054208|0.054843|0.062818|0.097700|0.112932|0.112703|0.098092|0.132051|0.110713|0.132283|0.147344|0.500000| |2.526350|2.359857|2.329181|2.445583|2.635675|2.686965|2.766674|0.077853|2.338049|2.373908|2.905365|5.400102|4.425816|4.300771|4.712280|9.547773|5.899884|7.263808|16.544562|17.496353|8.878229|3.792763|2.013234|3.224721|1.951357|2.023064|1.891397|1.733800|1.687895|1.776280|2.746224|1.492197|1.471815|2.879999|2.868931|3.541087|3.613302|0.068458|0.061354|0.064924|0.073686|0.121569|0.128229|0.115748|0.111770|0.134577|0.132111|0.147306|0.216183|0.300095|0.500000| |3.062031|2.701506|2.534204|2.626081|2.960326|3.248750|3.566113|0.096657|3.006177|3.212954|4.327934|8.639334|6.412710|6.766921|7.201642|12.423483|5.738056|5.054776|10.163665|8.915314|17.598253|5.053925|2.461384|3.913583|2.284523|2.331035|2.094553|1.891900|1.866375|2.024327|2.991876|1.588769|1.559310|3.063487|3.010231|3.741506|3.680412|0.086266|0.069959|0.067064|0.081176|0.161006|0.239159|0.188690|0.143767|0.143759|0.127747|0.110663|0.131990|0.211313|0.217081|0.500000| |2.587105|2.284740|2.178963|2.301636|2.616253|2.816874|3.213537|0.090873|2.799264|2.989014|3.849458|7.642857|5.494124|5.193389|6.964816|12.272870|7.127074|5.903349|12.498484|8.884522|17.417117|4.793133|2.335746|3.736029|2.188329|2.289356|2.068199|1.841597|1.787329|1.922030|2.851667|1.521145|1.518248|2.999873|2.610992|3.231714|3.241922|0.072696|0.059086|0.059789|0.074144|0.122823|0.154612|0.214913|0.147393|0.210220|0.144131|0.132368|0.134973|0.216860|0.173902|0.301672|0.500000| |3.720438|3.091723|3.056846|3.575368|4.665818|4.844836|6.286855|0.225758|6.412403|4.669209|4.092663|5.924974|6.258554|3.794928|3.824709|4.157964|2.940609|2.409415|3.839616|2.199395|2.574291|6.926289|6.895776|9.124387|8.914684|17.729372|8.942975|5.656850|4.965761|5.663551|6.512190|3.208240|3.362789|7.535862|3.427198|4.022310|4.287266|0.097609|0.074541|0.091475|0.149623|0.102180|0.088293|0.103621|0.126545|0.080886|0.090378|0.063553|0.065725|0.055520|0.059893|0.070323|0.070510|0.500000| |2.913515|2.640038|2.793427|3.363168|3.978912|3.592447|3.837514|0.128018|3.664112|2.949500|2.737437|4.212634|4.186516|2.805586|2.869704|3.407623|2.527400|2.171930|3.412205|1.906038|2.126021|4.643365|4.051441|6.129077|5.613866|8.860540|17.718897|8.995345|5.668955|4.963373|7.507068|4.068283|4.853520|13.197381|3.285110|3.798415|4.305075|0.074206|0.064426|0.093243|0.133635|0.079756|0.067434|0.075676|0.093676|0.068586|0.079597|0.058808|0.060405|0.048210|0.052656|0.057328|0.057610|0.213760|0.500000| |4.369602|3.994623|3.831322|3.957184|4.318369|4.566302|4.250749|0.111149|4.929143|3.798896|3.111460|4.654929|4.467158|2.730548|2.445148|2.867628|1.956801|1.727634|2.862700|1.685508|1.894743|6.162202|7.081180|12.399508|8.910610|5.657332|4.965584|5.659665|8.980482|17.747703|13.165515|4.846683|4.063621|7.491223|4.400366|5.303101|5.291647|0.114515|0.099744|0.098445|0.112291|0.077295|0.068989|0.065487|0.072271|0.052537|0.057605|0.045341|0.048612|0.043675|0.047318|0.054145|0.050896|0.124250|0.107755|0.500000| |2.476052|2.541619|2.780489|2.978432|2.866564|2.607973|2.386430|0.067637|2.405916|2.058547|1.883037|2.993724|2.754227|1.864265|1.761625|2.200227|1.569929|1.442603|2.368711|1.357322|1.459502|3.423129|2.774496|4.780295|3.404186|3.236844|3.737632|5.127929|5.929185|4.367184|16.906530|17.609033|8.830457|10.168601|3.676180|4.375547|4.976711|0.063180|0.065729|0.085921|0.080284|0.054315|0.047796|0.046596|0.052494|0.041954|0.046844|0.038779|0.041174|0.035268|0.038484|0.040809|0.039058|0.076211|0.092670|0.117457|0.500000| |2.904250|3.006496|3.456125|3.913133|3.679816|3.153009|2.789194|0.080236|2.697983|2.255121|2.095426|3.295808|3.152846|2.149614|2.020155|2.519384|1.794162|1.640674|2.662161|1.526009|1.644180|3.659244|3.047266|5.013926|3.877989|3.782167|4.516341|6.440761|7.020846|4.909714|16.551783|17.529039|8.891740|12.821621|4.491348|5.105047|6.239294|0.071712|0.075359|0.117325|0.104559|0.063834|0.054347|0.052539|0.060885|0.047370|0.054188|0.043894|0.047241|0.039275|0.043542|0.045871|0.043564|0.087535|0.110598|0.124498|0.299834|0.500000| |2.297808|2.246420|2.396466|2.651424|2.730011|2.518935|2.445041|0.071597|2.501289|2.129163|1.930241|3.063149|2.807239|1.889688|1.837951|2.274741|1.651553|1.499283|2.444188|1.383699|1.497705|3.548962|2.933189|5.029387|3.745245|3.862857|4.891666|6.991140|6.408953|4.500978|12.846330|8.895936|17.530334|16.549009|3.045004|3.622346|4.065649|0.059460|0.057420|0.075468|0.080112|0.054144|0.047928|0.049142|0.055719|0.044724|0.049702|0.040680|0.042262|0.035875|0.038752|0.041370|0.040536|0.090242|0.124781|0.110602|0.213116|0.174049|0.500000| |2.232595|2.229836|2.458175|2.770774|2.767018|2.456721|2.327801|0.068774|2.288303|1.959468|1.826095|2.915198|2.700672|1.861546|1.817029|2.286265|1.672746|1.535475|2.484550|1.399112|1.497285|3.232848|2.573426|4.311174|3.223560|3.408318|4.363748|5.929522|5.121109|3.734424|10.174568|8.825116|17.605576|16.896686|3.187125|3.735667|4.391283|0.056874|0.056775|0.082082|0.082210|0.054196|0.047179|0.047949|0.055228|0.044848|0.050733|0.041797|0.043722|0.036135|0.039474|0.041185|0.040199|0.081558|0.117547|0.092563|0.209570|0.212938|0.299692|0.500000|
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