Version2.4 2021-06-06T20:33:36Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 10-Sep-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE COc1ccc(cc1OC)C(=O)C2=C(C(=O)N([C@H]2c3cccc(c3)F)c4ccc(cc4)CC(=O)[O-])[O-] C13217577 RHF 6-31G(d) (6D,7F) COc1ccc(cc1OC)C(=O)C2=C(C(=O)N([C@H]2c3cccc(c3)F)c4ccc(cc4)CC(=O)[O-])[O-] C01[X(C27H20F1N1O7)] 162 C1 580 COc1cc(ccc1OC)C(=O)C1=C([O-])C(=O)N([C@H]1c1cccc(c1)F)c1ccc(cc1)CC(=O)[O-] COc1cc(ccc1OC)C(=O)C1=C([O-])C(=O)N([C@H]1c1cccc(c1)F)c1ccc(cc1)CC(=O)[O-] COc1ccc(cc1OC)C(=O)C2=C([O-])C(=O)N([C@H]2c3cccc(F)c3)c4ccc(CC([O-])=O)cc4 InChIKey=CAXOWTXZQSPSTL-DEOSSOPVSA-L InChI=1S/C27H22FNO7/c1-35-20-11-8-17(14-21(20)36-2)25(32)23-24(16-4-3-5-18(28)13-16)29(27(34)26(23)33)19-9-6-15(7-10-19)12-22(30)31/h3-11,13-14,24,33H,12H2,1-2H3,(H,30,31)/p-2/t24-/m0/s1 InChI=1/C27H22FNO7/c1-35-20-11-8-17(14-21(20)36-2)25(32)23-24(16-4-3-5-18(28)13-16)29(27(34)26(23)33)19-9-6-15(7-10-19)12-22(30)31/h3-11,13-14,24,33H,12H2,1-2H3,(H,30,31)/p-2/t24-/m0/s1/fC27H20FNO7/h33h/q-2 COc1ccc(cc1OC)C(=O)C2=C(C(=O)N([C@H]2c3cccc(c3)F)c4ccc(cc4)CC(=O)[O-])[O-] C01[X(C27H20F1N1O7)] 162 C01 580 COc1cc(ccc1OC)C(=O)C1=C([O-])C(=O)N([C@H]1c1cccc(c1)F)c1ccc(cc1)CC(=O)[O-] CO[C]1[CH][C]([CH][CH][C]1OC)[C]([C]1[C](=O)C(=O)N([C@H]1[C]1[CH][CH][CH][C]([CH]1)F)[C]1[CH][CH][C]([CH][CH]1)C[C]([O])=O)=O CO[C]1[CH][CH][C]([CH][C]1OC)C(=O)[C]2[C@H]([C]3[CH][CH][CH][C](F)[CH]3)N([C]4[CH][CH][C]([CH][CH]4)CC([O])=O)C(=O)C2=O InChIKey=BIOFUKKUTSMKIT-DEOSSOPVSA-N InChI=1S/C27H20FNO7/c1-35-20-11-8-17(14-21(20)36-2)25(32)23-24(16-4-3-5-18(28)13-16)29(27(34)26(23)33)19-9-6-15(7-10-19)12-22(30)31/h3-11,13-14,24H,12H2,1-2H3/t24-/m0/s1 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2.4716 1.4210 2.8993 4.0225 5.3179 1.6855 1.9032 4.6352 3.0537 2.8023 2.5300 2.1129 2.1848 2.2369 1.2724 1.2788 1.2505 2.3845 2.3877 1.6554 1.5683 1.6583 1.8124 3.8766 3.0349 2.9719 3.6123 2.6381 1.6232 1.4271 1.4547 3.5033 1.3739 1.6207 5.6972 3.1416 3.1008 3.0454 4.7652 2.5688 1.1220 1.2071 1.2593 1.0503 1.0498 2.4863 1.0531 1.0609 2.7233 2.9271 6.2343 8.7821 6.3635 8.0597 5.7943 5.9938 6.0015 10.8680 12.7968 12.8542 1.0723 1.0349 1.0326 1.0842 1.1052 1.0913 1.1066 1.1033 1.1016 1.0891 1.0911 1.0880 1.0945 1.0925 1.0888 1.0972 1.0944 1.0927 1.0933 1.0907 0.0007 0.0009 0.0011 0.0021 0.0028 0.0022 0.0040 0.0074 0.0093 0.0083 0.0153 0.0205 0.0227 0.0575 0.0763 0.0690 0.0783 0.0883 0.1088 0.1078 0.0850 0.1256 0.2141 0.2586 0.2306 0.0613 0.1670 0.1056 0.2424 0.2497 0.5262 0.4037 0.7790 0.5963 0.4049 0.4595 0.6943 0.6006 0.4339 0.7537 0.5560 0.5477 1.0981 0.7462 1.4590 1.1456 1.8789 0.8065 1.0581 1.2799 1.6345 1.7221 1.6795 1.8031 1.6951 1.0664 1.6381 1.6947 1.7453 1.7958 2.3936 1.5879 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0.8975 17.7657 3.6799 10.6478 0.4725 19.2694 28.4267 4.7186 9.7221 41.0904 14.3495 1.0622 2.8874 1.2222 10.4388 8.5893 32.2871 5.4319 23.2391 53.7797 28.9733 83.3446 45.7716 24.8998 1.6480 22.3569 15.4242 34.7749 7.2792 8.9925 9.2071 75.3443 1.6242 7.8717 17.2639 18.1740 9.1415 13.3792 1.3728 6.6105 0.9039 0.3995 4.9262 5.2046 20.8077 24.3466 4.2675 4.2128 6.3996 10.8730 39.1558 12.6293 19.8504 17.7139 134.7901 2.0611 6.2407 5.7329 52.2820 8.4656 5.6215 48.1384 68.5830 32.1054 39.4349 37.8565 178.5076 82.4780 294.0743 21.3269 32.2912 17.1484 327.3905 1.5088 85.0024 455.8283 775.3451 11.3408 176.0380 645.3420 35.6905 3.1157 19.3351 7.0087 2.0897 3.9018 43.5668 15.8049 18.0724 155.0904 144.1001 1.3526 287.8547 75.3502 130.4793 9.0825 59.4917 49.2425 630.1112 697.8940 646.3541 73.7854 76.5939 49.6587 37.8327 62.5320 43.3903 54.3206 56.4711 96.3474 47.1200 24.3235 10.0076 18.2748 29.0329 13.4551 22.2249 18.8964 0.5313 2.0699 5.1165 2.5677 2.9783 0.6393 2.9836 0.9717 1.9327 2.4388 0.7193 4.1404 1.9271 0.8779 2.4782 1.7269 0.2696 0.4458 0.6119 2.2120 0.9865 2.8914 2.0938 2.3246 1.8708 0.8811 1.7866 3.8996 1.4286 1.4821 0.6856 3.4093 1.7721 2.0968 1.7380 2.0724 6.4573 1.9779 0.7221 0.3166 0.4587 0.5969 1.9189 1.4829 1.0865 1.5849 0.9957 3.5794 3.0417 0.7635 1.6110 0.5250 2.1006 2.3500 1.4669 7.1097 5.1463 5.1349 0.0395 1.0624 1.0415 0.4451 5.7580 5.7810 24.1173 7.9013 5.2420 1.8889 2.9541 4.5826 5.9863 8.6638 1.6106 6.0880 1.0729 9.4185 3.2148 4.1261 1.9452 0.6523 0.1525 1.2125 1.7723 1.0318 9.7004 12.6996 1.4436 0.1623 3.9430 5.5673 6.6119 0.3915 5.9373 0.9788 2.9696 9.1861 3.7363 6.6513 1.8794 6.4551 1.9617 8.8361 15.3236 6.6342 5.9037 10.5569 6.4577 1.6871 6.2012 35.6290 4.4996 1.5362 26.6210 26.0570 0.6298 4.1184 26.3200 2.5678 6.9415 6.9610 21.9513 19.8232 6.7117 19.1479 0.6602 13.6770 7.2572 3.1093 23.9184 23.5828 1.6176 19.5544 7.2730 2.2481 7.2247 2.8056 36.7576 22.4023 33.3922 97.3654 44.9342 82.1464 0.4556 68.7294 51.9472 167.8575 93.8433 121.1791 25.6470 44.0656 46.3083 36.0240 118.5720 175.7731 66.1106 77.8470 53.2979 78.9886 51.7238 27.6813 156.3145 96.0897 40.1823 77.1996 42.8139 0.7492 0.7127 0.6124 0.7455 0.7386 0.7380 0.7475 0.7355 0.7480 0.7499 0.7285 0.7493 0.7499 0.7465 0.5140 0.6428 0.7449 0.5705 0.5300 0.4422 0.7020 0.5040 0.6919 0.2047 0.6021 0.6372 0.7314 0.5925 0.6170 0.3200 0.2830 0.3735 0.2987 0.2238 0.2187 0.3461 0.5075 0.4371 0.3971 0.6862 0.7065 0.7473 0.6301 0.5074 0.3507 0.3581 0.2588 0.6215 0.4103 0.6034 0.6232 0.6417 0.5136 0.6468 0.2173 0.0755 0.7099 0.7015 0.6857 0.2503 0.2961 0.0848 0.0432 0.6501 0.5707 0.5809 0.0419 0.2008 0.1742 0.5201 0.4239 0.7451 0.1352 0.1129 0.1295 0.6860 0.6943 0.7225 0.3992 0.7394 0.7307 0.1008 0.1042 0.7395 0.7258 0.0956 0.2327 0.1313 0.5292 0.7480 0.3791 0.7350 0.4213 0.5253 0.3928 0.4822 0.7497 0.7185 0.2868 0.2344 0.2521 0.1376 0.7134 0.3107 0.5744 0.6281 0.3135 0.7497 0.4895 0.0959 0.2854 0.7462 0.1273 0.1661 0.5780 0.7482 0.5026 0.7074 0.1259 0.3272 0.2654 0.4696 0.7319 0.7441 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0.7716 0.4774 0.8570 0.6573 0.1750 0.4441 0.8546 0.2258 0.2849 0.7326 0.8559 0.6690 0.8286 0.2237 0.4931 0.4194 0.6391 0.8452 0.8533 0.6667 0.8542 0.8344 0.5449 0.8482 0.4517 0.5994 0.5731 0.8134 0.7796 0.6486 0.6645 0.6761 0.2909 0.8530 0.8172 0.4229 0.4218 0.3943 0.0866 0.0506 0.2855 0.8383 0.6798 0.8501 0.7111 0.6313 0.6055 0.5192 0.8330 0.3431 0.8043 0.8497 0.2427 0.2173 0.3906 0.3525 0.3521 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 6 8 6 6 6 6 6 6 8 6 6 8 6 6 6 8 7 6 1 6 6 6 6 6 6 9 6 6 6 6 6 6 6 6 8 8 8 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 15.99491 14.00307 12.00000 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 18.99840 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 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 12488.8016 28136.5438 31703.9993 0.99991 -0.01362 -0.00042 0.01361 0.99964 -0.02316 0.00073 0.02315 0.99973 1 0.00694 0.00308 0.00273 0.14451 0.06414 0.05692 20.34 23.42 23.90 33.08 35.37 40.02 48.62 70.62 72.03 83.62 97.74 104.83 128.55 138.46 182.19 204.46 213.24 235.11 268.59 285.45 302.58 324.45 362.66 384.48 393.80 402.80 436.87 439.91 457.82 466.27 514.09 536.57 554.31 575.43 598.85 613.29 664.32 672.08 675.39 679.02 736.80 748.33 760.87 809.47 814.10 818.32 846.38 896.36 916.33 930.14 951.41 982.62 985.88 1020.64 1035.79 1093.36 1125.01 1142.67 1150.67 1174.02 1190.06 1204.47 1208.15 1238.47 1275.78 1287.87 1315.20 1319.50 1334.53 1350.65 1361.35 1371.70 1418.89 1441.60 1449.49 1452.40 1462.43 1494.63 1515.93 1534.06 1554.64 1568.38 1575.50 1590.72 1611.24 1652.77 1686.17 1701.31 1715.29 1735.72 1751.98 1762.22 1781.97 1793.15 1810.35 1845.77 1863.29 1863.72 1866.62 1871.55 1880.78 1882.08 1900.90 1907.39 1927.73 1933.45 1956.48 1988.12 1998.52 2013.88 2039.22 2053.34 2060.69 2092.12 2100.58 2149.56 2190.07 2203.34 2250.29 2259.84 2285.75 2330.68 2334.39 2346.83 2354.76 2374.31 2374.69 2387.46 2395.78 2396.11 2432.32 2447.02 2535.95 2554.08 2580.78 2581.98 2609.95 2611.81 2612.06 2728.02 2788.96 2841.24 4542.37 4593.84 4605.58 4635.35 4676.53 4676.61 4693.32 4741.73 4744.31 4804.56 4816.39 4830.44 4859.88 4862.30 4863.24 4875.17 4889.85 4899.34 4925.48 4927.14 0.450146 0.480218 0.481162 0.381944 -1711.549829 -1711.519757 -1711.518813 -1711.618031 3.327788D-04 MUNgauss RevisionA2.1 retrievium 06-Jun-2021 DUDE COc1ccc(cc1OC)C(=O)C2=C(C(=O)N([C@H]2c3cccc(c3)F)c4ccc(cc4)CC(=O)[O-])[O-] C13217577 RHF 6-31G(d) (6D,10F) C1 489.122380 |X|Y|Z| 113.128548 66.556822 50.112405 72.260896 24 6 7 23 1 |36.858105| |13.693636|73.516695| |8.050966|24.933175|36.858105| |6.764454|13.980967|13.845368|36.858105| |4.524752|9.196964|7.908993|13.642015|36.858105| |3.791863|8.149275|6.804079|7.909343|13.855866|36.858105| |3.997439|9.383244|7.928785|6.917319|7.993989|13.614167|36.858105| |5.254075|14.437258|13.554366|7.944065|6.872844|7.872426|13.860717|36.858105| |4.784126|13.047754|8.136818|5.286364|4.615584|5.163979|7.876995|14.032288|73.516695| |3.548568|8.496093|5.255913|4.001260|3.815751|4.530650|6.786728|8.053941|24.301725|36.858105| |2.915992|5.966714|4.407857|4.970508|7.453314|12.492606|7.603623|5.028131|6.879007|3.722929|36.858105| |2.647239|5.444636|3.878389|4.127021|5.507363|8.216758|6.699053|4.573792|6.619232|3.746679|15.643958|73.516695| |2.629239|5.168556|3.656048|4.236169|6.059380|7.505445|5.195171|3.916967|5.606292|3.041302|13.373546|14.354073|36.858105| |2.209793|4.263046|2.888292|3.261507|4.272530|4.922314|3.849717|3.068576|4.609979|2.557954|7.569755|11.416973|13.451811|36.858105| |2.072528|3.907263|2.585287|2.931591|3.674250|3.923279|3.179616|2.667179|4.074346|2.242947|5.075868|7.647986|8.054134|12.350829|36.858105| |1.841908|3.437408|2.226500|2.489542|3.005849|3.157927|2.658225|2.285527|3.565691|1.976170|3.913388|6.251640|5.408688|7.768264|15.899934|73.516695| |2.293314|4.300230|2.865176|3.304797|4.155974|4.283539|3.420076|2.903835|4.376195|2.367045|5.116613|7.233285|8.147269|8.148133|14.017664|14.838410|53.358707| |2.733934|5.248312|3.655863|4.322047|5.872680|6.229189|4.587105|3.735738|5.386215|2.860571|7.284699|9.058493|12.537002|7.926549|8.064333|9.631026|17.705300|36.858105| |3.038052|5.704279|4.000609|5.049395|6.977039|6.304501|4.524368|3.854664|5.458502|2.803617|6.344936|8.064804|8.690947|6.013067|6.183757|8.133313|12.514698|17.573769|0.500000| |2.788995|5.445887|3.739361|4.125073|5.086906|5.642756|4.731035|3.945202|5.823915|3.138959|5.830274|7.840541|7.375443|5.410726|5.517857|7.507493|10.546988|12.418490|0.250485|36.858105| |3.049449|5.827612|3.888702|4.252045|4.783701|4.814780|4.281469|3.901909|5.852662|3.062071|4.429884|6.260825|5.039506|3.961344|4.149348|6.057509|7.661804|7.509802|0.206400|13.719584|36.858105| |2.885665|5.537150|3.525231|3.599499|3.793555|3.910034|3.797287|3.617136|5.748259|3.076328|3.588916|5.369938|3.860627|3.211078|3.327134|5.082713|5.668160|4.986976|0.134131|7.888239|13.737287|36.858105| |2.549967|4.995098|3.156627|3.118177|3.321356|3.620287|3.665005|3.413421|5.625953|3.172959|3.466357|5.364073|3.668425|3.142111|3.194958|4.945996|5.168658|4.392481|0.111299|6.795648|7.921583|13.774889|36.858105| |2.398825|4.763359|3.087366|3.080612|3.435645|3.957560|3.954316|3.456124|5.616686|3.266073|4.047762|6.283229|4.358989|3.751239|3.726472|5.666697|5.875085|5.010795|0.117799|7.984279|6.980309|8.056692|13.809852|36.858105| |2.482419|4.928957|3.309564|3.443232|4.093847|4.874830|4.492958|3.689598|5.702740|3.246529|5.365948|7.846898|6.283730|5.120112|4.988795|7.104575|8.120203|7.478514|0.156427|13.681719|7.964110|6.877162|7.877490|13.869220|36.858105| |2.126147|4.226943|2.683309|2.626783|2.888330|3.351722|3.460186|3.050031|5.154649|3.126923|3.513367|5.774267|3.670761|3.337393|3.261515|5.139483|4.822130|3.899305|0.093058|5.281620|4.679956|5.314595|8.159926|14.201006|8.146866|97.533100| |2.171138|3.977101|2.574514|2.947149|3.491261|3.434359|2.868294|2.548091|3.919765|2.108056|3.778178|5.583511|5.135607|5.118287|7.741986|11.761326|18.204653|7.542639|0.193846|6.152033|5.386667|4.131522|3.648534|3.885696|4.836076|7.224324|36.858105| |1.948180|3.572353|2.267372|2.511466|2.876380|2.894899|2.527153|2.274018|3.586905|1.960170|3.160739|4.848102|4.056960|4.167149|5.927704|10.207516|10.608532|5.365929|0.134558|5.210019|4.762004|4.017184|3.703387|3.925752|4.585844|7.488206|13.782589|36.858105| |1.825849|3.295547|2.049033|2.253679|2.500473|2.465417|2.195975|2.026977|3.241812|1.764426|2.608124|4.075242|3.178328|3.223647|4.227975|7.586369|6.983936|4.014915|0.107395|4.005744|3.991191|3.563797|3.252105|3.274733|3.581900|6.404282|7.932462|13.725219|36.858105| |1.868054|3.312118|2.041970|2.273916|2.485958|2.377563|2.108549|1.977279|3.154262|1.693199|2.456699|3.832669|2.936869|2.922593|3.703429|6.569814|6.108524|3.692330|0.104818|3.573342|3.714088|3.286503|2.900052|2.843044|3.093218|5.554329|6.753945|7.838771|13.700232|36.858105| |2.068147|3.638230|2.265842|2.593159|2.865458|2.662066|2.303226|2.156888|3.383228|1.790502|2.727007|4.181090|3.295201|3.215045|4.068860|6.966669|6.977336|4.251922|0.127768|3.863679|4.016994|3.365354|2.884810|2.838769|3.181939|5.460284|7.884849|6.889475|8.010009|13.648166|36.858105| |2.249409|4.017837|2.569967|3.007665|3.474649|3.226304|2.692062|2.459746|3.777546|1.994138|3.377875|5.027273|4.308687|4.151408|5.523288|8.853894|10.614107|5.974753|0.183265|4.901803|4.797598|3.732707|3.181055|3.227709|3.819590|6.079661|13.699883|7.996475|6.944593|7.878623|13.774021|36.858105| |1.696185|2.978171|1.802125|1.978623|2.112237|2.017624|1.825646|1.739377|2.817205|1.515276|2.059488|3.274011|2.382040|2.374769|2.877194|5.185273|4.501851|2.864537|0.081652|2.828297|2.986203|2.770346|2.486781|2.400860|2.529070|4.809400|4.394100|4.994830|7.547922|12.567898|7.469632|4.987358|36.858105| |1.747857|3.023373|1.803430|1.973438|2.057620|1.936323|1.769673|1.716860|2.794994|1.490081|1.928234|3.068272|2.177972|2.121202|2.476297|4.359798|3.886834|2.604984|0.076019|2.613175|2.861822|2.706452|2.386456|2.243200|2.321785|4.485666|3.604442|3.841003|5.051163|7.218291|5.948311|4.201878|12.180213|36.858105| |1.877148|3.206470|1.909954|2.116837|2.192255|2.023160|1.834991|1.791203|2.895990|1.527354|1.991027|3.150935|2.238038|2.154428|2.489083|4.326354|3.934104|2.683696|0.080436|2.641801|2.918302|2.703746|2.341229|2.197892|2.300407|4.360723|3.604305|3.606301|4.427532|6.350682|6.364533|4.456720|8.009576|15.423989|73.516695| |1.637053|2.835251|1.674921|1.805436|1.864243|1.770911|1.642542|1.603472|2.640652|1.415563|1.758484|2.824231|1.960304|1.910313|2.195179|3.874800|3.393086|2.307591|0.066516|2.363180|2.594949|2.534207|2.272546|2.117579|2.146745|4.291829|3.044194|3.310778|4.244068|5.302949|4.376912|3.376214|8.067406|15.467666|15.192920|73.516695| |2.015439|3.888547|2.591442|2.862476|3.617287|4.172661|3.439538|2.777584|4.268598|2.406825|6.190724|11.091472|7.888002|15.754421|7.966330|11.820397|7.482787|5.290991|0.122276|4.101864|3.192322|2.707210|2.703819|3.202641|4.102570|6.714086|3.978829|3.437052|2.771778|2.531280|2.735582|3.370807|2.115072|1.896983|3.413627|3.067253|73.516695| |17.530318|16.443449|6.991914|6.740705|4.561587|3.710749|3.767815|4.704942|7.427320|3.202760|2.892757|4.700136|2.605309|2.207669|2.062311|3.269149|3.075193|2.669184|0.083058|2.635612|2.818637|2.613241|2.322566|2.223028|2.338002|4.457210|2.132798|1.898128|1.779292|1.831585|2.045799|2.231143|1.664167|1.710383|3.284920|2.833802|3.602608|0.500000| |17.544666|16.460138|7.138290|6.802840|4.631091|3.783514|3.846817|4.817377|7.583039|3.278344|2.930271|4.629323|2.715579|2.271933|2.168814|3.417674|3.328883|2.921508|0.091863|3.010638|3.409954|3.212566|2.750163|2.536086|2.620024|4.975154|2.349812|2.101386|1.979812|2.042856|2.276480|2.464912|1.850646|1.925170|3.703455|3.193475|3.636231|0.299472|0.500000| |17.611338|17.030449|5.883802|4.917979|3.620328|3.178586|3.412774|4.400690|7.733209|3.331765|2.535150|4.166438|2.305180|1.973855|1.862843|2.975255|2.782673|2.389505|0.072525|2.464204|2.694249|2.620026|2.353549|2.201056|2.238429|4.455679|1.953497|1.779216|1.683011|1.720675|1.881796|2.017650|1.581416|1.638473|3.113940|2.753788|3.232614|0.300075|0.299725|0.500000| |7.534160|12.541048|8.938721|17.748092|8.929406|5.653930|4.977683|5.638344|7.576439|3.333982|4.064998|6.139402|3.677265|2.947196|2.732478|4.193443|4.203160|3.865126|0.128744|3.638818|3.862663|3.299899|2.822252|2.742140|3.026028|5.297943|2.844260|2.422938|2.214719|2.281116|2.633240|3.003859|2.003388|2.025864|3.920471|3.282805|4.631846|0.229512|0.224276|0.146885|0.500000| |3.929249|7.439059|5.649907|8.917797|17.740935|8.954467|5.662882|4.954052|6.512388|3.149671|6.856270|9.022069|6.417453|4.627303|4.073395|5.878936|6.324956|6.418953|0.233854|4.960850|4.609893|3.563037|3.091579|3.206737|3.881689|6.080386|3.888059|3.086656|2.673983|2.696523|3.200555|3.992048|2.263907|2.190759|4.192008|3.481598|6.834395|0.113304|0.114237|0.089272|0.217027|0.500000| |3.331100|7.563947|5.630633|4.981038|5.704220|8.990882|17.783165|8.926687|12.523844|7.542327|7.224823|12.953998|4.959129|3.840503|3.117928|4.678341|4.436017|4.213765|0.110030|4.441595|3.892090|3.571663|3.637975|4.091534|4.585239|8.408731|2.719608|2.445932|2.117982|2.005489|2.155363|2.501682|1.743488|1.677283|3.060574|2.784660|6.271976|0.087517|0.089075|0.081894|0.108052|0.125036|0.500000| |3.208848|7.443924|4.722645|3.783644|3.745635|4.579897|6.774443|7.016858|16.440447|17.546675|3.911509|7.374836|3.104850|2.641629|2.267621|3.558858|3.192366|2.813218|0.075905|2.992638|2.832819|2.782283|2.878178|3.051835|3.117617|6.670650|2.063699|1.912247|1.713051|1.640584|1.737673|1.944961|1.466488|1.432465|2.609204|2.413708|4.500747|0.083229|0.081994|0.083271|0.087804|0.086772|0.230060|0.500000| |3.332464|7.727811|4.402939|3.415176|3.194651|3.622856|4.929277|5.885834|17.026526|17.607590|3.073160|5.515533|2.597114|2.236686|1.995898|3.168495|2.859320|2.480348|0.067891|2.719786|2.702532|2.772909|2.873189|2.898475|2.817305|6.361908|1.902537|1.788692|1.629759|1.569358|1.648459|1.811761|1.419499|1.403984|2.553824|2.386879|3.772955|0.083161|0.085000|0.090140|0.081960|0.075263|0.146992|0.299816|0.500000| |3.273955|7.558043|4.806601|3.842137|3.799829|4.640546|6.827454|7.130814|16.455245|17.553332|3.917050|6.881948|3.254075|2.720291|2.395155|3.731000|3.465807|3.096780|0.082622|3.537528|3.425278|3.518027|3.758610|3.919589|3.790603|8.498799|2.258917|2.117052|1.891495|1.794843|1.884027|2.104336|1.597376|1.562726|2.829388|2.641882|4.501615|0.081762|0.087052|0.084898|0.088999|0.087795|0.224857|0.299630|0.299587|0.500000| |3.277650|6.044042|4.000123|4.602795|5.055171|4.633267|4.000311|3.773283|5.598314|2.846274|4.131639|5.844478|4.680638|3.718768|3.954432|5.842069|7.365082|7.000181|0.228842|8.927617|17.726317|8.934161|5.647451|5.008285|5.657294|8.330671|5.492590|4.612460|4.023810|3.974667|4.536475|5.427827|3.180711|3.119587|5.828100|4.932516|5.362343|0.084746|0.104852|0.079405|0.121072|0.140926|0.098123|0.073412|0.070400|0.085811|0.500000| |2.946917|5.510237|3.376323|3.414588|3.437334|3.412703|3.360847|3.350015|5.443380|2.868537|3.076361|4.690828|3.251153|2.762054|2.874906|4.491645|4.802199|4.077664|0.114818|5.627988|8.919391|17.709181|8.936282|5.695182|4.953584|9.609275|3.630665|3.564611|3.331030|3.178692|3.240223|3.448318|2.761426|2.790148|4.979220|4.703321|4.218368|0.073289|0.092929|0.075260|0.089463|0.090195|0.087021|0.071469|0.073361|0.089276|0.215951|0.500000| |2.385564|4.646494|2.848328|2.756196|2.859577|3.086362|3.206091|3.075756|5.265639|3.017229|2.947433|4.695932|3.056687|2.690570|2.730343|4.332743|4.283659|3.520482|0.091033|4.912979|5.616498|8.829734|17.727785|8.941279|5.634053|16.727128|3.080777|3.190461|2.904179|2.614017|2.560723|2.746668|2.307430|2.241254|3.880580|3.864749|4.221160|0.060111|0.071033|0.062274|0.070151|0.074001|0.089497|0.075490|0.077911|0.099094|0.123702|0.212500|0.500000| |2.293769|4.562312|3.059104|3.182624|3.848102|4.738277|4.338812|3.460691|5.391222|3.139216|5.805963|8.864529|6.924606|6.067229|5.528901|7.828897|8.052164|6.900563|0.140653|8.859006|5.645855|4.957109|5.635548|8.971791|17.749240|16.685726|4.532167|4.304381|3.337689|2.869538|2.946531|3.546039|2.364402|2.146956|3.775577|3.533334|8.739066|0.060809|0.066192|0.057695|0.077739|0.102517|0.128471|0.086346|0.075595|0.100741|0.123986|0.107583|0.124526|0.500000| |1.868655|3.469992|2.204314|2.398897|2.753112|2.859669|2.535257|2.256543|3.590318|1.993803|3.191386|4.970450|4.081871|4.310122|6.031319|10.573374|9.750818|5.120504|0.121560|5.234685|4.541084|3.982803|3.896930|4.335292|5.063051|8.461769|8.960826|17.721816|8.885408|5.601851|4.960905|5.673660|4.081532|3.253879|5.397030|5.182394|6.402392|0.050384|0.055464|0.047620|0.063411|0.080440|0.069473|0.054223|0.050516|0.060372|0.115607|0.096098|0.093413|0.136239|0.500000| |1.686986|3.051082|1.878732|2.033131|2.228871|2.223016|2.018220|1.873155|3.036664|1.668131|2.349144|3.733750|2.798713|2.861301|3.626122|6.640888|5.673986|3.400620|0.089978|3.502462|3.502083|3.285599|3.101901|3.113898|3.286335|6.265282|5.655758|8.952807|17.686353|8.927164|5.671690|4.986723|7.029784|4.765428|7.083336|7.607068|4.479070|0.045527|0.050549|0.043570|0.055375|0.065245|0.054633|0.044974|0.043096|0.049781|0.095877|0.086246|0.078846|0.085861|0.215740|0.500000| |2.073046|3.586168|2.205917|2.534186|2.740447|2.495551|2.173361|2.067478|3.254635|1.709014|2.507679|3.879050|2.941559|2.845902|3.442838|5.914353|5.660972|3.663686|0.113173|3.339810|3.542298|3.027715|2.590370|2.517541|2.778122|4.894417|5.622002|4.965228|5.691547|8.964692|17.771580|8.903698|6.964989|6.449593|14.256031|8.110710|4.385749|0.057363|0.063662|0.052529|0.072972|0.085347|0.056149|0.046034|0.043934|0.049502|0.113381|0.082963|0.064770|0.071725|0.107739|0.124755|0.500000| |2.430500|4.308782|2.783135|3.365013|3.948344|3.517754|2.857670|2.613558|3.953086|2.058463|3.630460|5.336605|4.582743|4.287200|5.343993|8.303506|9.778256|6.185987|0.211765|4.710956|4.589542|3.519396|2.984992|3.032491|3.616570|5.733703|8.929705|5.674724|4.986997|5.620802|8.932734|17.690450|4.069857|3.655971|7.173517|5.318558|6.177959|0.067869|0.074019|0.059855|0.094754|0.132434|0.072518|0.055980|0.051722|0.059680|0.149307|0.090859|0.071761|0.094136|0.124643|0.108061|0.214683|0.500000| |1.605606|2.812360|1.699454|1.870774|2.000562|1.907708|1.721912|1.638724|2.656100|1.429633|1.960626|3.141611|2.261316|2.288907|2.769493|5.095727|4.205931|2.657770|0.075870|2.558645|2.645967|2.438657|2.214437|2.168404|2.303512|4.393552|3.995668|4.376523|6.053628|8.971923|6.620603|4.593389|17.459147|8.922993|12.496472|11.539621|3.668330|0.044111|0.048341|0.041633|0.052815|0.059967|0.045746|0.038658|0.037245|0.041626|0.078197|0.067144|0.057227|0.060767|0.101441|0.157759|0.183678|0.107727|0.500000| 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