Version2.4 2021-05-21T22:04:57Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 26-Jul-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CS(=O)(=O)[N-]c1cccc(c1)C(=O)N2CCC[C@@H]2c3cccc4c3cccc4 C56362870 RHF 6-31G(d) (6D,7F) CS(=O)(=O)[N-]c1cccc(c1)C(=O)N2CCC[C@@H]2c3cccc4c3cccc4 C01[X(C22H21N2O3S1)] 141 C1 466 O=C(N1CCC[C@@H]1c1cccc2c1cccc2)c1cccc(c1)[N-]S(=O)(=O)C O=C(N1CCC[C@@H]1c1cccc2c1cccc2)c1cccc(c1)[N-]S(=O)(=O)C C[S](=O)(=O)[N-]c1cccc(c1)C(=O)N2CCC[C@@H]2c3cccc4ccccc34 InChIKey=MCFSUWZATFGVIT-OAQYLSRUSA-N InChI=1S/C22H21N2O3S/c1-28(26,27)23-18-10-4-9-17(15-18)22(25)24-14-6-13-21(24)20-12-5-8-16-7-2-3-11-19(16)20/h2-5,7-12,15,21H,6,13-14H2,1H3/q-1/t21-/m1/s1 InChI=1/C22H21N2O3S/c1-28(26,27)23-18-10-4-9-17(15-18)22(25)24-14-6-13-21(24)20-12-5-8-16-7-2-3-11-19(16)20/h2-5,7-12,15,21H,6,13-14H2,1H3/q-1/t21-/m1/s1 CS(=O)(=O)[N-]c1cccc(c1)C(=O)N2CCC[C@@H]2c3cccc4c3cccc4 C01[X(C22H21N2O3S1)] 141 C01 466 O=C(N1CCC[C@@H]1c1cccc2c1cccc2)c1cccc(c1)[N-]S(=O)(=O)C O=C(N1CCC[C@@H]1[C]1=[CH][CH]=[CH][C]2[C]1[CH]=[CH][CH]=[CH]2)[C]1[CH][CH][CH][C]([CH]1)[N][S]([O])([O])C C[S]([O])([O])[N][C]1[CH][CH][CH][C]([CH]1)C(=O)N2CCC[C@@H]2C3=CC=C[C]4C=CC=C[C]34 InChIKey=VAPCKSKUKVPJIU-OAQYLSRUSA-N InChI=1S/C22H21N2O3S/c1-28(26,27)23-18-10-4-9-17(15-18)22(25)24-14-6-13-21(24)20-12-5-8-16-7-2-3-11-19(16)20/h2-5,7-12,15,21H,6,13-14H2,1H3/t21-/m1/s1 InChI=1/C22H21N2O3S/c1-28(26,27)23-18-10-4-9-17(15-18)22(25)24-14-6-13-21(24)20-12-5-8-16-7-2-3-11-19(16)20/h2-5,7-12,15,21H,6,13-14H2,1H3/t21-/m1/s1 2650.8254517970 -1576.3175064 1-A 16164.4997 104 362 466 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -92.02142 -20.42304 -20.36674 -20.36653 -15.48802 -15.36448 -11.24400 -11.18818 -11.17475 -11.17287 -11.17182 -11.17012 -11.16866 -11.16811 -11.16674 -11.16529 -11.16059 -11.15879 -11.15487 -11.15247 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519.6658 522.4384 536.5409 542.0148 568.8705 580.6921 598.4725 625.9669 630.8729 671.1967 685.4693 687.1400 715.1954 735.8121 766.8560 793.9661 816.0296 825.1984 848.0124 853.0866 857.7600 870.9252 896.0904 897.3404 900.1509 934.7604 959.8165 972.6655 980.1450 985.6226 1000.0129 1006.3346 1014.5371 1045.2817 1061.9492 1070.9200 1080.8899 1083.9481 1086.0367 1088.4211 1092.9325 1102.4998 1109.7448 1115.3217 1123.6639 1132.0916 1164.0838 1192.9623 1214.7921 1216.2186 1224.1465 1240.4134 1260.0767 1273.1682 1291.0810 1294.9407 1306.9713 1321.0823 1331.4041 1344.9348 1358.9807 1365.7047 1388.5236 1391.7426 1427.0305 1438.0607 1454.8109 1465.4114 1473.7203 1482.6339 1490.2104 1511.8729 1515.5642 1528.0774 1539.3107 1554.5342 1587.9034 1604.2703 1606.2511 1612.3761 1628.1248 1635.9369 1649.6657 1657.1547 1676.5526 1685.2364 1758.5500 1779.6863 1788.1606 1806.8434 1836.6293 1909.6074 3210.0193 3216.3474 3223.5606 3240.8407 3258.8312 3264.0552 3278.8861 3328.4268 3335.1377 3337.9642 3343.2435 3343.6600 3349.1109 3357.7480 3372.7203 3375.2611 3381.4697 3390.1822 3406.2191 3406.8942 3409.4888 7.7007 5.7084 5.2848 5.2248 5.9905 4.8894 5.1956 3.1595 4.4505 6.2963 4.2435 4.4924 4.3966 4.9478 4.1171 1.0670 3.4259 3.5552 3.9387 2.8071 4.4521 4.0196 5.8624 4.7957 4.1153 5.0502 3.3684 3.9353 6.8345 3.4419 7.2778 5.5112 6.7956 8.4461 3.5417 2.4827 3.2927 5.9630 5.7244 5.5877 3.8970 4.4930 2.4117 3.4941 4.2278 1.3963 2.4844 4.8739 5.0206 2.3592 1.8761 3.4351 2.1846 3.9290 1.8703 1.7928 1.5385 2.1717 2.1759 1.5830 2.1732 1.3668 2.4475 4.9587 4.0430 1.3605 1.3670 1.3160 1.5439 2.9435 1.3402 1.3423 2.0641 2.6057 2.8029 2.1171 5.0105 2.0005 1.9795 1.8935 2.3666 1.6294 1.1642 1.7188 1.3788 1.5902 1.4980 13.9294 2.2693 2.1042 1.8734 1.4790 1.8600 1.4997 2.2133 1.9210 5.7136 1.5103 1.6368 1.9422 1.3012 1.9029 1.6730 1.5470 3.3709 1.9886 1.0522 1.0496 2.1950 1.0972 1.1126 2.3695 1.1107 3.0001 4.7991 5.4254 6.8207 4.8046 5.6818 12.4722 1.0689 1.0713 1.0673 1.0328 1.0928 1.0957 1.0985 1.1049 1.0893 1.0953 1.0868 1.1070 1.0878 1.0916 1.0964 1.0969 1.0904 1.0934 1.0934 1.0929 1.0931 0.0014 0.0012 0.0021 0.0038 0.0088 0.0130 0.0184 0.0195 0.0337 0.0573 0.0575 0.0791 0.0945 0.1198 0.1251 0.0370 0.1327 0.1624 0.1900 0.1499 0.2886 0.2778 0.4531 0.4773 0.4839 0.6254 0.4750 0.5830 1.0874 0.5535 1.2344 0.9539 1.2957 1.6780 0.7474 0.5732 0.7721 1.5828 1.5847 1.5544 1.1744 1.4332 0.8356 1.2977 1.6587 0.5602 1.0526 2.0898 2.1764 1.0543 0.8876 1.6297 1.0429 2.0227 1.0152 0.9993 0.8708 1.2430 1.2820 0.9445 1.3179 0.8799 1.6262 3.3507 2.7830 0.9418 0.9499 0.9185 1.0866 2.1080 0.9725 0.9838 1.5355 1.9676 2.2378 1.7752 4.3564 1.7435 1.7478 1.7165 2.2139 1.5562 1.1434 1.6981 1.3876 1.6352 1.5646 14.8452 2.4693 2.3123 2.1281 1.6878 2.2317 1.8273 2.7600 2.4305 7.3112 1.9560 2.1417 2.6156 1.7609 2.6179 2.3356 2.2026 5.0078 3.0155 1.5994 1.6077 3.4281 1.7300 1.7839 3.8338 1.8394 5.0201 8.7441 10.1244 12.8497 9.2417 11.2921 26.7968 6.4895 6.5293 6.5346 6.3912 6.8381 6.8782 6.9581 7.2122 7.1386 7.1904 7.1573 7.2920 7.1885 7.2511 7.3482 7.3628 7.3460 7.4039 7.4741 7.4737 7.4864 1.6061 2.2982 0.0559 1.3541 1.8833 3.8656 0.3731 0.4741 2.1464 11.9063 2.3752 1.5652 1.4162 1.9860 0.9272 0.0203 1.2282 1.3444 6.3855 1.0399 1.2180 1.3954 10.8877 2.0540 8.2138 11.8463 7.9533 16.8567 24.6721 3.1094 19.5009 1.7062 0.9417 104.1803 5.2926 1.5745 1.8472 9.0857 8.6186 3.7076 3.8687 19.7671 3.4180 0.9375 3.4666 5.7963 59.1913 9.1499 8.5916 32.6338 67.6069 89.2843 17.6593 69.7348 4.7688 4.4477 6.3232 61.0566 0.9597 8.3616 11.2075 0.2018 36.8982 31.3968 20.9956 1.3950 0.4026 0.5879 47.7125 135.8491 1.4788 1.3536 33.0190 8.0058 5.4179 75.2369 499.9014 22.7282 6.9103 43.3400 21.2767 0.7510 2.2874 44.3215 0.5534 60.5116 3.2131 319.0152 11.2804 64.5985 4.1827 38.4027 230.4965 117.3193 3.1167 346.7599 1.9937 5.2932 220.6947 305.0752 50.1759 186.4302 12.2446 3.3201 61.8791 1.8752 1.3471 1.9944 0.1103 1.6218 3.8386 166.1859 0.8352 9.7781 132.1340 184.6952 3.7860 12.1676 0.9933 317.2702 41.7681 34.5469 26.9811 14.8424 38.2807 26.5314 59.9596 21.1507 49.7114 18.1249 0.9766 14.1374 2.5078 26.1314 49.8495 65.9824 18.4616 15.3205 7.9841 8.8611 18.4596 0.2565 1.3216 7.1750 5.0775 3.4730 4.8887 2.3869 2.7941 2.2239 0.5341 2.7500 1.9141 0.4244 0.9165 1.5740 0.0519 1.5664 2.3264 1.6257 1.4383 3.3435 0.7164 3.4032 1.2840 3.8298 0.4979 1.8204 1.2641 5.1859 0.4984 3.5413 6.6461 7.9061 3.5745 2.4190 0.4486 2.3823 3.6663 3.2224 1.5433 3.5401 1.9527 2.0248 19.0816 9.9448 3.9895 9.6662 11.5962 2.8665 3.7796 0.3764 2.3120 0.6869 2.4845 3.2106 2.3978 0.8989 4.7831 9.6031 1.1919 6.4956 1.9933 4.6311 59.1317 10.1028 1.1494 6.2764 2.2510 4.4448 10.0111 0.1217 2.9650 8.2572 4.4332 6.1717 15.2273 8.7609 5.5240 4.7382 3.9805 13.0982 6.9026 13.2670 2.1096 2.0333 3.5508 8.4878 2.8792 0.7506 1.1407 9.0423 8.7830 34.9606 28.8661 2.5771 18.4725 266.6397 26.0401 18.3585 22.0519 3.3899 2.6585 18.1023 3.2546 6.5506 31.9225 21.8247 13.8004 9.2371 20.0825 7.3040 1.5037 4.1701 7.3059 38.8501 79.8566 108.4029 1.5693 2.9788 37.7297 96.4178 21.7107 63.8138 131.1394 75.2676 93.9282 53.7818 104.0469 119.4913 87.4313 32.8219 53.1501 48.6351 151.9049 89.0305 315.9814 48.5652 88.8753 101.0926 128.6724 121.5578 0.7412 0.7479 0.7489 0.7498 0.7213 0.7405 0.7453 0.7481 0.7121 0.4677 0.4941 0.6124 0.7225 0.7422 0.7297 0.7496 0.5005 0.7099 0.3604 0.6876 0.2386 0.7340 0.5790 0.7067 0.6520 0.2426 0.5845 0.3982 0.5685 0.3523 0.2748 0.3153 0.7119 0.4762 0.0779 0.7486 0.3038 0.0909 0.3758 0.5297 0.1140 0.7494 0.4560 0.0667 0.2734 0.6838 0.2188 0.0683 0.4251 0.6832 0.7056 0.1148 0.6091 0.3569 0.6288 0.2322 0.7497 0.3176 0.1017 0.6473 0.1591 0.7374 0.5172 0.1395 0.1821 0.7111 0.7500 0.5381 0.5498 0.7348 0.3616 0.7225 0.7497 0.2715 0.2686 0.4141 0.6632 0.2312 0.6732 0.5795 0.2924 0.7488 0.4686 0.4996 0.4978 0.7423 0.6775 0.7289 0.3955 0.3516 0.2650 0.6871 0.1364 0.3251 0.6633 0.1428 0.1578 0.1882 0.3241 0.2993 0.2047 0.3211 0.3050 0.7376 0.6229 0.4133 0.7498 0.6912 0.3585 0.7423 0.7230 0.6236 0.7481 0.1896 0.2578 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MUNgauss RevisionA2.1 retrievium 21-May-2021 DUDE CS(=O)(=O)[N-]c1cccc(c1)C(=O)N2CCC[C@@H]2c3cccc4c3cccc4 C56362870 RHF 6-31G(d) (6D,10F) C1 393.127290 |X|Y|Z| 115.404211 33.409908 41.591847
54.329417 22 6 7 21 1
|36.858105| |10.740957|388.023441| |7.359099|93.093438|73.516695| |7.359564|93.089013|13.888563|73.516695| |7.430598|86.096929|13.303022|13.275177|53.358707| |4.888059|52.749565|10.498780|10.627788|18.974718|36.858105| |4.042922|44.321508|9.959029|10.410306|10.421884|13.531830|36.858105| |3.136714|30.518118|7.226139|7.440158|6.961994|7.838903|13.770062|36.858105| |2.828507|25.676061|6.016917|6.094886|6.166619|6.700824|7.872301|13.768926|36.858105| |3.071759|27.038554|6.134479|6.132377|7.104810|7.790208|6.878580|8.010311|13.691183|36.858105| |3.912032|35.340817|7.560575|7.512996|10.994669|13.530485|7.973109|6.946306|7.908519|13.773587|36.858105| |2.594876|21.373252|4.924034|4.902285|5.325340|4.985061|4.464617|5.091523|7.691112|12.719025|7.577585|36.858105| |2.283316|18.590007|4.298080|4.400856|4.426924|4.015274|3.817015|4.501629|6.608033|8.056682|5.399503|15.810060|73.516695| 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|2.100550|15.786650|3.645008|3.657254|3.699916|2.984282|2.645959|2.767300|3.367864|4.192481|3.818870|5.955165|10.631474|10.352673|5.306246|5.096853|7.469773|12.496189|0.248123|36.858105| |2.320338|17.177077|3.869183|3.979054|4.093269|3.231913|2.777913|2.819411|3.352301|4.276302|4.156656|5.591603|9.464826|9.097961|4.947731|4.336913|5.546105|7.588834|0.160874|13.997921|36.858105| |2.151623|15.570260|3.491212|3.674431|3.598469|2.763157|2.415783|2.428378|2.789494|3.373480|3.352863|4.066535|7.213597|6.090042|3.642033|3.324923|4.095028|4.979525|0.117607|7.858013|13.465407|36.858105| |1.866141|13.506538|3.075902|3.217968|3.042139|2.340484|2.102950|2.142573|2.447869|2.851813|2.768412|3.433400|6.343710|5.071011|3.098501|2.981039|3.735325|4.388662|0.109790|6.761934|7.923026|14.063596|36.858105| |1.735702|12.725616|2.944391|3.023967|2.851659|2.227537|2.033364|2.109958|2.443370|2.811242|2.644214|3.496518|6.645029|5.235357|3.165505|3.188861|4.184925|4.938526|0.128852|7.749423|6.844125|7.926889|13.421845|36.858105| |1.819605|13.551233|3.158992|3.185658|3.077607|2.450554|2.234421|2.350571|2.794057|3.270394|2.986103|4.326092|8.271721|6.789771|3.907989|4.039877|5.757850|7.417629|0.193525|13.267896|7.911906|6.810923|7.781177|13.482936|36.858105| |1.653706|12.392259|2.936856|2.920155|2.768336|2.214658|2.064835|2.202581|2.610232|2.948755|2.646447|3.834378|7.473134|5.892388|3.555964|3.922679|5.498790|6.379577|0.194896|7.577109|5.105696|4.514898|5.104926|7.850204|13.379257|36.858105| |1.486345|11.054854|2.629291|2.628146|2.426251|1.919739|1.810039|1.923399|2.230209|2.454617|2.235129|3.039636|5.919111|4.503680|2.841806|3.114450|4.047008|4.384080|0.131788|5.073563|3.938539|3.787771|4.523729|6.823524|7.841591|14.011374|36.858105| |1.440093|10.595887|2.502350|2.535767|2.311505|1.807054|1.698279|1.784701|2.039019|2.241524|2.080729|2.704988|5.225637|3.949316|2.514877|2.671053|3.370300|3.652835|0.104653|4.476031|3.783077|3.949999|5.130115|7.872252|6.753889|7.915819|13.483174|36.858105| |1.537488|11.235857|2.623553|2.690573|2.468444|1.917917|1.780512|1.852903|2.113915|2.360554|2.220593|2.845876|5.451346|4.162662|2.616337|2.696484|3.413018|3.798361|0.104123|5.070517|4.532207|5.146261|7.715987|13.416566|7.782847|6.868893|7.953411|14.031494|36.858105| |17.631930|57.365038|12.004311|9.667912|9.399948|4.659722|3.766775|2.991279|2.762801|3.059548|3.911615|2.626269|4.063850|3.622014|2.924328|2.443961|2.221487|2.259684|0.057364|2.165248|2.384699|2.193678|1.899591|1.772425|1.867437|1.697976|1.521357|1.469252|1.566533|0.500000| |17.632420|57.384956|9.669047|12.026382|9.375344|4.681842|3.819629|3.024576|2.778806|3.056804|3.892569|2.616735|4.123617|3.505924|2.686744|2.240954|2.101522|2.202693|0.056178|2.169347|2.441102|2.295183|1.974229|1.810733|1.878707|1.689490|1.519983|1.483877|1.598077|0.298349|0.500000| |17.598522|57.951709|12.080962|12.064089|7.402901|3.993778|3.533457|2.812210|2.517261|2.664600|3.255406|2.281869|3.626744|3.057050|2.388753|2.041354|1.882841|1.940523|0.050212|1.877020|2.051111|1.922436|1.691263|1.580953|1.649344|1.512414|1.370952|1.331403|1.414950|0.298127|0.298089|0.500000| |4.229382|49.404881|11.608271|12.702162|9.346923|8.856122|17.758664|8.964442|5.636539|4.958500|5.649897|3.568049|5.609286|4.226852|3.145278|2.560195|2.294831|2.517763|0.067668|2.308203|2.423263|2.154383|1.897284|1.831463|1.987403|1.849830|1.642861|1.551647|1.622973|0.106080|0.108339|0.105987|0.500000| |2.807891|26.736647|6.554193|6.791752|5.634193|5.611414|8.978217|17.678471|8.940500|5.672242|4.986953|4.136498|6.873608|4.542126|3.199276|2.675396|2.416858|2.737107|0.076968|2.449678|2.468632|2.167399|1.946678|1.929862|2.132773|2.028942|1.796414|1.669963|1.720154|0.073988|0.074969|0.071745|0.218328|0.500000| |2.439947|21.397641|5.105326|5.171316|4.913146|4.864161|5.607480|8.853602|17.743297|8.886040|5.634436|7.147362|12.722178|6.649459|4.190953|3.470996|3.194145|3.903991|0.115248|3.327045|3.200351|2.685925|2.411769|2.456752|2.830887|2.706851|2.320554|2.100113|2.148803|0.066451|0.066856|0.061298|0.123953|0.213561|0.500000| |4.017585|33.152646|7.015137|6.900366|10.311671|8.979703|5.679337|4.991504|5.625620|8.892654|17.734530|6.955556|8.889457|9.417245|6.894156|4.459183|4.046752|4.666793|0.110758|4.227771|4.834436|3.811601|3.045514|2.853916|3.211524|2.774498|2.326665|2.179848|2.357264|0.115253|0.113576|0.091322|0.124464|0.108128|0.123803|0.500000| |3.012685|22.916838|5.420100|4.825704|5.791070|4.557727|3.636982|3.505842|4.059478|5.538330|6.145051|6.014974|7.951585|12.281649|17.547526|8.816832|6.797135|6.358548|0.136959|4.995625|5.079733|3.798508|3.149779|3.110503|3.699632|3.268270|2.662630|2.416457|2.559943|0.091427|0.082633|0.072013|0.086110|0.082141|0.100065|0.216121|0.500000| |2.896300|23.670652|5.827691|5.015762|5.893573|5.152322|4.376116|4.452588|5.385713|7.240873|6.968346|7.204673|9.033290|12.300219|17.677504|8.696225|5.718856|5.805478|0.142036|4.221904|4.025722|3.116911|2.690944|2.734313|3.283504|3.062498|2.517299|2.242986|2.314405|0.085779|0.077418|0.070265|0.100345|0.102376|0.130902|0.194060|0.303032|0.500000| |2.267156|17.045940|4.249336|3.708157|3.903409|3.057158|2.707949|2.733677|3.121871|3.721330|3.665529|4.224981|6.337540|7.861177|8.710990|17.562241|8.682807|5.631519|0.134574|4.185536|3.738014|2.995738|2.709400|2.858647|3.475714|3.390346|2.796437|2.443976|2.466156|0.068394|0.061336|0.056559|0.066784|0.067629|0.082714|0.110698|0.218502|0.195420|0.500000| |2.134365|16.642606|4.152173|3.697224|3.810822|3.145880|2.900120|3.087959|3.702661|4.308912|3.846806|5.208322|7.925348|9.385113|8.844873|17.531598|8.813736|6.789637|0.183375|4.448904|3.730931|2.944689|2.702920|2.937685|3.711618|3.791511|3.054222|2.577396|2.544824|0.062792|0.057821|0.053534|0.070424|0.076701|0.102007|0.109093|0.174355|0.218713|0.301067|0.500000| |2.142967|15.769980|3.760549|3.524650|3.654995|2.844769|2.486821|2.521873|2.942079|3.613745|3.523896|4.524468|7.119661|9.031357|6.897989|8.847023|17.552277|8.788874|0.174953|7.308778|5.978797|4.488273|4.028855|4.364821|5.676128|5.041630|3.857061|3.358333|3.508005|0.063514|0.060031|0.053248|0.061129|0.062267|0.078872|0.111335|0.191621|0.138925|0.217220|0.173946|0.500000| |1.877614|14.099563|3.420871|3.202283|3.193542|2.546665|2.322696|2.436816|2.881122|3.368400|3.091866|4.314161|7.237501|7.906848|5.687764|8.666729|17.579323|8.673311|0.220434|6.246416|4.591431|3.638621|3.508079|4.115913|5.670182|6.173641|4.567421|3.628513|3.511487|0.054939|0.052148|0.047320|0.057348|0.061317|0.080404|0.091801|0.137508|0.125889|0.196076|0.215458|0.302472|0.500000| |2.666427|19.841465|4.396221|4.522549|4.912004|3.879835|3.197410|3.173664|3.770585|5.091020|5.228528|6.399152|9.804665|10.535308|5.771960|4.572223|5.345356|7.065591|0.147996|9.042712|17.758342|8.865861|5.666701|4.940553|5.626556|4.129401|3.283001|3.128872|3.610881|0.076363|0.078238|0.064351|0.076314|0.075479|0.096375|0.181386|0.173392|0.129704|0.109662|0.107270|0.159260|0.118402|0.500000| |2.275415|16.186420|3.576105|3.839525|3.729558|2.799212|2.422769|2.388025|2.681853|3.223444|3.323235|3.677979|6.400237|5.357056|3.334579|2.981425|3.491430|4.085736|0.097998|5.633672|8.849162|17.711355|9.009861|5.626333|4.919635|3.597828|3.132312|3.293655|4.159429|0.064114|0.068543|0.056309|0.060481|0.059192|0.070712|0.106008|0.099056|0.081072|0.076096|0.073588|0.106550|0.086234|0.215633|0.500000| |1.762186|12.624120|2.874422|3.034358|2.797943|2.126911|1.925980|1.950766|2.189772|2.501620|2.456172|2.910700|5.374973|4.209737|2.653897|2.561666|3.104422|3.516755|0.090028|4.892766|5.621746|8.988876|17.700029|8.829566|5.575210|4.157187|3.948237|4.719212|7.099422|0.049629|0.052017|0.044680|0.048809|0.049680|0.059957|0.074433|0.075429|0.065286|0.065830|0.065215|0.092816|0.082255|0.124270|0.215685|0.500000| |1.674578|12.677441|3.033174|2.971023|2.835968|2.293616|2.153208|2.322431|2.783991|3.128449|2.753562|4.135144|8.024502|6.445101|3.914023|4.522224|6.389547|7.246812|0.250842|6.922494|4.647410|3.911870|4.136186|5.598735|8.798004|17.767587|9.080154|5.648845|4.954179|0.047884|0.047122|0.042541|0.053361|0.059450|0.081082|0.079231|0.096380|0.093736|0.105653|0.126000|0.148339|0.214935|0.110023|0.089263|0.095675|0.500000| |1.399087|10.433163|2.502745|2.483761|2.269031|1.796511|1.711921|1.827418|2.105836|2.277919|2.068231|2.773978|5.387984|4.065740|2.628450|2.928381|3.670532|3.839082|0.118252|4.119246|3.286012|3.132322|3.603243|4.925527|5.598198|9.016319|17.707382|8.826884|5.662125|0.039779|0.039531|0.036023|0.043383|0.047826|0.061365|0.059194|0.067921|0.065702|0.073783|0.081723|0.095527|0.118122|0.078788|0.074102|0.089950|0.219392|0.500000| |1.333178|9.778999|2.318409|2.350864|2.110318|1.641594|1.554038|1.630577|1.841662|1.996967|1.863899|2.357759|4.534203|3.400344|2.209252|2.346428|2.868457|3.042063|0.087459|3.572852|3.130051|3.296169|4.155364|5.605128|4.889107|5.645089|8.817884|17.706513|8.996938|0.037722|0.038116|0.034432|0.039735|0.042715|0.052778|0.053928|0.059195|0.055488|0.060462|0.063465|0.079485|0.085954|0.074054|0.079084|0.111969|0.124522|0.213305|0.500000| |1.480760|10.732414|2.499294|2.585133|2.337326|1.798451|1.671909|1.726999|1.943599|2.153912|2.053665|2.530645|4.805664|3.652160|2.335886|2.377230|2.915563|3.195202|0.086885|4.134314|3.956030|4.736116|7.124970|8.852350|5.581880|4.948308|5.638442|9.000673|17.696764|0.041789|0.042947|0.038000|0.042638|0.044721|0.054608|0.060555|0.064299|0.058059|0.061241|0.062326|0.084202|0.082355|0.090192|0.112098|0.217169|0.107517|0.124146|0.216178|0.500000|
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