Version2.4 2021-05-20T05:16:07Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 13-Jul-2020 #N HF/3-21G OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC[C@@H](C)c1ccc(cc1)OCC(=O)NNC(=S)NC(=O)c2ccccc2I C13983513 RHF 3-21G (6D,7F) CC[C@@H](C)c1ccc(cc1)OCC(=O)NNC(=S)NC(=O)c2ccccc2I C01[X(C20H22I1N3O3S1)] 144 C1 324 CC[C@H](c1ccc(cc1)OCC(=O)NNC(=S)NC(=O)c1ccccc1I)C CC[C@H](c1ccc(cc1)OCC(=O)NNC(=S)NC(=O)c1ccccc1I)C CC[C@@H](C)c1ccc(OCC(=O)NNC(=S)NC(=O)c2ccccc2I)cc1 InChIKey=MFYCLSZIENATQH-CYBMUJFWSA-N InChI=1S/C20H22IN3O3S/c1-3-13(2)14-8-10-15(11-9-14)27-12-18(25)23-24-20(28)22-19(26)16-6-4-5-7-17(16)21/h4-11,13H,3,12H2,1-2H3,(H,23,25)(H2,22,24,26,28)/t13-/m1/s1 InChI=1/C20H22IN3O3S/c1-3-13(2)14-8-10-15(11-9-14)27-12-18(25)23-24-20(28)22-19(26)16-6-4-5-7-17(16)21/h4-11,13H,3,12H2,1-2H3,(H,23,25)(H2,22,24,26,28)/t13-/m1/s1/f/h22-24H CC[C@@H](C)c1ccc(cc1)OCC(=O)NNC(=S)NC(=O)c2ccccc2I C01[X(C20H22I1N3O3S1)] 144 C01 324 CC[C@H](c1ccc(cc1)OCC(=O)NNC(=S)NC(=O)c1ccccc1I)C CC[C@H]([C]1[CH][CH][C]([CH][CH]1)OCC(=O)NN[C](S)NC(=O)[C]1[CH][CH][CH][CH][C]1I)C CC[C@@H](C)[C]1[CH][CH][C]([CH][CH]1)OCC(=O)NN[C](S)NC(=O)[C]2[CH][CH][CH][CH][C]2I InChIKey=AVBWTXHLEGOPNU-CYBMUJFWSA-N InChI=1S/C20H23IN3O3S/c1-3-13(2)14-8-10-15(11-9-14)27-12-18(25)23-24-20(28)22-19(26)16-6-4-5-7-17(16)21/h4-11,13H,3,12H2,1-2H3,(H,23,25)(H3,22,24,26,28)/t13-/m1/s1 InChI=1/C20H23IN3O3S/c1-3-13(2)14-8-10-15(11-9-14)27-12-18(25)23-24-20(28)22-19(26)16-6-4-5-7-17(16)21/h4-11,13H,3,12H2,1-2H3,(H,23,25)(H3,22,24,26,28)/t13-/m1/s1/f/h22-24,28H 3417.6879933146 -8435.0511707 1-A 23581.6875 128 196 324 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| ********** -180.10043 -168.34020 -168.33898 -168.33889 -91.24238 -37.85227 -32.74690 -32.74268 -32.74263 -24.19624 -24.19430 -24.19421 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334.9313 353.9657 364.7723 446.7215 456.9845 466.9695 484.3887 485.9789 529.1319 535.7984 563.5625 586.3081 613.9877 631.3092 638.5217 668.0199 688.6471 727.7147 729.1692 734.3042 771.6454 788.6959 812.4878 823.2740 834.8476 858.4724 864.4540 883.6595 907.7829 914.0457 920.1779 967.6337 976.7114 992.2532 995.9973 1028.9309 1037.0666 1060.4024 1073.6962 1092.2760 1116.1815 1131.9218 1132.5254 1144.6817 1151.2811 1158.5820 1161.1967 1171.7774 1182.1184 1198.6001 1208.4046 1217.4740 1230.6015 1234.3750 1236.6686 1250.5393 1252.5869 1257.7545 1311.5287 1332.4043 1336.5094 1340.6329 1354.8472 1373.0055 1391.8833 1398.3242 1428.6973 1432.5687 1450.4233 1459.7523 1489.4190 1496.3471 1521.5899 1553.9665 1570.0305 1578.4753 1586.4490 1609.4415 1631.7531 1643.4135 1652.2132 1656.7288 1666.3633 1668.7259 1669.2958 1675.4238 1683.2267 1692.3948 1722.9445 1731.2415 1746.5782 1760.8955 1788.6905 1959.7824 1982.3484 3189.2634 3196.0250 3201.1185 3204.0442 3210.6163 3226.7510 3235.6974 3251.6990 3263.6102 3264.7773 3274.9329 3358.7516 3363.1404 3368.9122 3382.9560 3389.2311 3395.3067 3401.8425 3402.9860 3766.3464 3785.1445 3792.4599 5.7706 5.4285 5.3556 5.4492 8.4287 4.0309 6.8153 7.4968 8.4210 2.8163 3.8289 6.7332 4.3964 2.9418 4.6346 5.9527 5.6295 4.6875 5.2275 1.2963 3.1942 5.9115 1.9312 6.9076 1.8573 6.3644 3.0644 5.1504 4.5883 7.5165 4.3307 4.4694 4.6776 4.4808 2.8240 3.2404 3.5807 2.6899 2.0391 3.4870 2.3286 4.3744 1.9754 2.2749 2.4705 5.3435 5.4593 3.5656 5.6641 3.8203 2.8636 5.6492 2.6102 1.7253 1.5523 2.5716 1.8692 3.5288 2.1698 1.2956 1.7367 6.4545 5.9522 2.0686 1.5467 2.7312 1.2120 5.7501 4.2342 2.8433 1.8237 1.6875 1.4854 1.4080 3.8902 1.7115 4.2609 1.5420 3.1964 1.9840 2.6090 1.9484 3.1459 3.1111 3.7096 2.0870 1.2128 2.9368 2.2388 1.5625 3.7366 1.0774 4.3184 1.2931 1.6747 1.3510 4.9153 1.2186 1.3257 1.3991 1.4088 1.1909 1.2641 1.8741 1.6916 1.3360 2.1238 1.0685 1.3226 1.1347 1.0593 1.0457 1.0526 1.0561 2.0094 1.7738 3.1944 5.1752 4.4883 4.9046 9.0397 9.9515 1.0551 1.0366 1.0517 1.0491 1.0766 1.1049 1.1003 1.1003 1.1003 1.1014 1.0996 1.0901 1.0884 1.0880 1.0907 1.0929 1.0936 1.0979 1.0939 1.0787 1.0750 1.0793 0.0002 0.0003 0.0005 0.0022 0.0051 0.0031 0.0067 0.0133 0.0173 0.0108 0.0171 0.0433 0.0295 0.0253 0.0613 0.1031 0.1118 0.1147 0.1360 0.0404 0.1101 0.2222 0.0794 0.3240 0.0982 0.3708 0.1854 0.3404 0.3387 0.5893 0.5092 0.5499 0.6010 0.6194 0.3930 0.5345 0.6057 0.5033 0.4130 0.7745 0.5468 1.0508 0.5194 0.6356 0.7708 1.6739 1.7344 1.2509 2.0759 1.4859 1.1435 2.3198 1.1334 0.7596 0.7141 1.2486 0.9201 1.7605 1.1970 0.7282 1.0075 3.7725 3.7128 1.3108 1.0247 1.8551 0.8520 4.2208 3.1963 2.1487 1.4079 1.3178 1.1748 1.1186 3.1471 1.4091 3.6066 1.3266 2.7915 1.7702 2.3421 1.7556 2.8986 2.8759 3.4575 2.1151 1.2686 3.0908 2.3708 1.6899 4.1502 1.2298 4.9750 1.5551 2.0249 1.6745 6.1711 1.5927 1.7489 1.9085 2.0044 1.7296 1.8558 2.7790 2.5817 2.0959 3.3795 1.7185 2.1388 1.8565 1.7379 1.7168 1.7409 1.7630 3.3910 3.1023 5.6410 9.3015 8.1998 9.2454 20.4561 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0.8368 0.8538 0.7974 0.6775 0.7217 0.8571 0.5973 0.4445 0.2819 0.8332 0.2973 0.8477 0.5325 0.6537 0.8567 0.8383 0.8559 0.8466 0.8522 0.8571 0.8071 0.8409 0.7766 0.6688 0.2354 0.7997 0.1662 0.1452 0.8548 0.0721 0.7568 0.8367 0.7015 0.7485 0.6777 0.6623 0.8044 0.6003 0.7317 0.8066 0.7705 0.2891 0.6648 0.1837 0.3436 0.2233 0.3267 0.3254 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 6 6 6 1 6 6 6 6 6 6 6 8 6 6 8 7 7 6 16 7 6 8 6 6 6 6 6 6 53 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 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 15.99491 14.00307 14.00307 12.00000 31.97207 14.00307 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 126.90040 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 10276.7479 36562.8977 40613.4435 0.99967 0.02112 0.01456 -0.01996 0.99694 -0.07557 -0.01611 0.07525 0.99703 1 0.00843 0.00237 0.00213 0.17561 0.04936 0.04444 10.66 13.29 17.27 37.51 46.01 51.87 58.75 78.89 84.93 116.03 125.10 150.27 153.50 173.96 215.56 246.69 264.17 293.26 302.30 330.88 347.92 363.44 380.08 405.96 431.07 452.46 461.07 481.89 509.28 524.83 642.73 657.50 671.87 696.93 699.22 761.30 770.89 810.84 843.57 883.39 908.31 918.69 961.13 990.81 1047.02 1049.11 1056.50 1110.23 1134.76 1168.99 1184.51 1201.16 1235.15 1243.76 1271.39 1306.10 1315.11 1323.93 1392.21 1405.27 1427.63 1433.02 1480.40 1492.11 1525.68 1544.81 1571.54 1605.94 1628.58 1629.45 1646.94 1656.44 1666.94 1670.70 1685.93 1700.80 1724.52 1738.62 1751.67 1770.56 1775.99 1779.29 1799.25 1802.19 1809.63 1887.00 1917.03 1922.94 1928.87 1949.32 1975.45 2002.61 2011.88 2055.58 2061.15 2086.84 2100.26 2142.94 2152.91 2189.23 2235.81 2258.92 2271.07 2282.55 2315.63 2347.73 2364.51 2377.17 2383.66 2397.53 2400.92 2401.74 2410.56 2421.79 2434.98 2478.93 2490.87 2512.94 2533.54 2573.53 2819.69 2852.16 4588.64 4598.37 4605.70 4609.90 4619.36 4642.57 4655.45 4678.47 4695.61 4697.29 4711.90 4832.49 4838.81 4847.11 4867.32 4876.35 4885.09 4894.49 4896.14 5418.93 5445.98 5456.50 0.426605 0.453127 0.454071 0.360949 -8434.624565 -8434.598044 -8434.597099 -8434.690222 3.123361D-04 MUNgauss RevisionA2.1 retrievium 20-May-2021 DUDE CC[C@@H](C)c1ccc(cc1)OCC(=O)NNC(=S)NC(=O)c2ccccc2I C13983513 RHF 3-21G (6D,10F) C1 511.038589 |X|Y|Z| 61.912258 41.361472 134.304486 70.062837 20 6 7 8 16 3 1 |36.858105| |12.356171|36.858105| |7.372014|12.302186|36.858105| |6.934866|8.885701|17.549081|0.500000| |6.062575|7.425015|12.337655|0.246674|36.858105| |4.871772|7.547439|12.502478|0.249534|7.544774|36.858105| |3.938325|5.341815|7.517138|0.206211|5.287552|13.686164|36.858105| |3.124402|4.033112|4.999693|0.134221|4.004505|7.885837|13.829245|36.858105| |2.900873|3.756882|4.411862|0.111325|3.747716|6.817529|7.968635|13.765583|36.858105| |3.211477|4.319949|4.985495|0.116628|4.333771|7.882819|6.916296|7.973225|13.810937|36.858105| |4.124667|6.082746|7.500822|0.155781|6.140711|13.764530|8.019347|6.916880|7.960066|13.737538|36.858105| |2.406112|2.970698|3.344687|0.086933|2.963379|4.565538|5.265705|8.127969|13.796067|7.803019|5.165179|73.516695| |2.181452|2.647347|2.886246|0.074036|2.650401|3.735643|3.951121|5.202354|7.825745|6.587034|4.453755|23.951321|36.858105| |1.879869|2.214391|2.389330|0.062807|2.215788|2.952135|3.190915|4.076651|5.180207|4.356430|3.314472|14.393242|12.537641|36.858105| |1.806689|2.106349|2.285978|0.061216|2.107362|2.795163|3.122901|4.025382|4.716860|3.799915|3.010944|12.714584|7.840739|15.902827|73.516695| |1.720846|1.999218|2.118762|0.055456|1.999525|2.541571|2.655615|3.209813|3.962879|3.641094|2.879709|9.429872|7.946734|13.674757|14.868014|53.358707| |1.534219|1.751465|1.849464|0.048991|1.757903|2.166904|2.276365|2.692975|3.148855|2.894302|2.390889|7.125697|5.138434|7.926148|12.383217|18.581211|53.358707| |1.442780|1.632713|1.699343|0.045227|1.606920|1.963054|2.058193|2.395696|2.734766|2.535691|2.142366|5.980352|4.080281|5.657138|9.572834|10.750953|19.164893|36.858105| |1.282831|1.430726|1.488878|0.039965|1.420003|1.689147|1.772062|2.024053|2.240003|2.087605|1.812511|4.729929|3.050750|3.932379|7.106424|6.539437|9.827885|11.099232|388.023441| |1.504260|1.709258|1.754765|0.046517|1.641568|2.029801|2.115616|2.455401|2.822142|2.641601|2.228358|6.110685|4.181621|5.441732|8.861676|9.806164|11.468606|14.086356|48.921871|53.358707| |1.423822|1.601771|1.622440|0.043191|1.513958|1.847865|1.917765|2.183251|2.451014|2.320122|2.006246|5.109692|3.326263|3.994404|6.770996|6.468283|7.173421|7.677616|40.869318|18.608070|36.858105| |1.312751|1.462133|1.481954|0.039704|1.389296|1.669521|1.737094|1.958758|2.157517|2.039661|1.791034|4.435951|2.809769|3.348437|5.879244|5.263769|6.092695|6.466584|43.377143|11.249335|15.864113|73.516695| |1.504113|1.696669|1.691424|0.044825|1.564137|1.921917|1.975454|2.227300|2.504941|2.408855|2.096267|5.098153|3.279466|3.670246|6.090954|5.651683|5.619564|5.106858|28.254591|10.759806|12.663355|14.281575|36.858105| |1.478522|1.655907|1.639260|0.043804|1.503607|1.846275|1.912313|2.138420|2.344958|2.234606|1.978235|4.692170|2.883363|3.171872|5.475438|4.596075|4.579262|4.024735|24.045489|7.451272|7.824980|11.801913|13.706960|36.858105| |1.526426|1.703841|1.660078|0.044320|1.513101|1.852737|1.902491|2.094118|2.276157|2.199677|1.978739|4.425872|2.666110|2.802289|4.807847|3.958078|3.823888|3.189066|19.402595|5.556920|5.104951|8.029788|7.901946|13.821567|36.858105| |1.609415|1.803419|1.736069|0.045892|1.584091|1.933717|1.950327|2.125959|2.341077|2.320341|2.094750|4.472977|2.728050|2.765150|4.610925|3.936210|3.692348|2.989117|17.915703|5.164169|4.456099|6.807360|6.860452|7.990848|13.784715|36.858105| |1.637769|1.850056|1.791797|0.046902|1.649808|2.012529|2.008411|2.202178|2.486460|2.504156|2.226337|4.791829|3.037083|3.058661|4.933630|4.515897|4.159233|3.349607|19.429804|5.940326|4.978379|7.200436|7.939725|6.924598|7.958599|13.785430|36.858105| |1.579562|1.789882|1.766639|0.046317|1.638362|2.005530|2.021447|2.255792|2.579282|2.557996|2.227023|5.140723|3.374472|3.563488|5.670324|5.549245|5.196303|4.365527|24.106807|8.461753|7.374853|9.539561|13.729915|7.961644|6.863588|7.931627|13.756357|36.858105| |1.554559|1.762293|1.756541|0.045565|1.667177|1.991891|1.969191|2.184029|2.551744|2.614113|2.262955|5.056404|3.490162|3.609573|5.478644|6.106888|5.630187|4.434782|24.421975|7.601660|5.398662|7.575581|6.067492|4.305911|3.875222|4.381461|6.298141|8.870451|6874.357145| |17.566520|8.773495|5.418840|0.142085|4.607053|4.068863|3.401494|2.808735|2.654980|2.931812|3.631830|3.992023|2.063319|1.792238|3.058281|2.252648|2.015550|1.403549|8.887015|2.004205|1.404885|2.304982|1.495393|1.477069|1.538415|1.630954|1.651246|1.576490|120.320094|0.500000| |17.590928|8.713493|6.589824|0.167916|6.624155|4.411391|3.547450|2.866540|2.704513|3.026254|3.870543|4.024176|2.077966|1.795463|3.058341|2.253915|2.015684|1.388762|8.818455|1.959659|1.360173|2.234607|1.429225|1.397390|1.435996|1.514809|1.551307|1.503470|117.023688|0.302085|0.500000| |17.555101|8.758918|6.785384|0.209210|5.468795|4.574646|3.943637|3.096903|2.788413|2.979848|3.717903|4.145006|2.088630|1.821648|3.149323|2.257255|2.026028|1.402231|8.914189|1.982562|1.380682|2.273082|1.451717|1.435140|1.478268|1.544093|1.560224|1.510338|115.101300|0.301473|0.301000|0.500000| |8.809904|17.552949|8.808499|0.174213|6.867466|6.789772|4.706738|3.786587|3.747476|4.567697|6.552037|5.302624|2.732238|2.258110|3.758459|2.808255|2.443548|1.671299|10.361241|2.391016|1.644168|2.656009|1.750333|1.694312|1.746519|1.870704|1.940343|1.870163|145.579375|0.210391|0.211506|0.172752|0.500000| |8.842758|17.564463|8.854351|0.211886|5.467926|7.168736|5.604666|4.289487|3.927500|4.360416|5.778161|5.536013|2.739290|2.298441|3.907645|2.804193|2.453547|1.690970|10.492775|2.430016|1.680609|2.720785|1.794487|1.766199|1.830317|1.935496|1.965752|1.887710|142.131985|0.215431|0.172774|0.209509|0.303029|0.500000| |6.711552|6.711681|8.730344|0.214454|17.588975|5.490755|4.263648|3.337479|3.110002|3.492841|4.612374|4.527445|2.305444|1.969766|3.355189|2.444507|2.175560|1.473354|9.346650|2.048072|1.399111|2.296358|1.446336|1.398156|1.412298|1.476808|1.529246|1.512038|119.683434|0.137593|0.230503|0.171431|0.168123|0.137936|0.500000| |5.440917|6.799357|8.749460|0.173459|17.568184|6.752931|4.657952|3.756532|3.731913|4.572252|6.590857|5.283393|2.732851|2.257987|3.757950|2.806981|2.451810|1.642930|10.277150|2.290160|1.548861|2.517263|1.605006|1.531372|1.541883|1.628096|1.711768|1.698232|136.776251|0.122027|0.168796|0.128833|0.205848|0.140875|0.301361|0.500000| |4.617006|5.438530|8.769505|0.211573|17.581439|6.995659|5.413151|4.170839|3.847909|4.301855|5.723140|5.441056|2.712400|2.278621|3.876321|2.779871|2.450310|1.632454|10.290462|2.246774|1.512264|2.472551|1.546234|1.481823|1.478203|1.536217|1.602877|1.608409|128.340369|0.102644|0.136654|0.122996|0.140790|0.123082|0.301503|0.301194|0.500000| |3.968515|5.037931|6.995980|0.229779|4.966812|8.924014|17.762855|8.996919|5.674855|4.978104|5.684770|7.592398|3.312661|2.806918|5.000148|3.220661|2.822783|1.895839|11.790117|2.641692|1.778190|2.893168|1.826247|1.787912|1.783621|1.813717|1.846076|1.852121|139.606789|0.094451|0.098445|0.116211|0.117749|0.147901|0.117219|0.116339|0.142685|0.500000| |2.760417|3.400050|4.073832|0.114511|3.372858|5.615655|8.889783|17.810753|9.016865|5.690580|4.982350|13.475708|4.851538|4.123289|7.685209|4.339705|3.720975|2.443473|14.805172|3.378316|2.208808|3.549431|2.226270|2.158083|2.095002|2.089068|2.140168|2.209520|164.347628|0.069794|0.070578|0.077457|0.088140|0.101130|0.080814|0.087420|0.098485|0.214972|0.500000| |2.884140|3.737275|4.085405|0.096608|3.756861|5.645217|4.981132|5.656611|8.906922|17.799062|8.969988|12.444018|7.302808|4.620122|6.802989|5.487705|4.244481|2.707715|15.619914|3.861577|2.466147|3.813929|2.567514|2.332298|2.285088|2.443651|2.704031|2.785229|230.400384|0.074633|0.076665|0.073697|0.113612|0.103842|0.086495|0.114083|0.103038|0.108062|0.124808|0.500000| |4.318254|6.290085|6.941398|0.140235|6.425608|8.932796|5.677832|4.979309|5.678588|8.986910|17.772367|7.435211|3.878495|2.965293|4.752336|3.634273|3.045544|2.019712|12.231880|2.866048|1.911301|3.040955|2.007968|1.888927|1.901642|2.037058|2.179748|2.161779|174.497133|0.106649|0.116110|0.103623|0.214463|0.155078|0.135320|0.219921|0.156095|0.124536|0.108103|0.218744|0.500000| |2.160229|2.609357|2.881814|0.073175|2.734813|3.689107|3.764795|4.721649|6.905031|6.587777|4.516122|16.308129|17.547999|8.921623|10.939039|9.724026|6.571203|3.754842|20.592491|5.060470|2.989529|4.567545|2.918327|2.557233|2.377860|2.455245|2.754344|3.047728|260.873130|0.056442|0.057957|0.057140|0.075601|0.073307|0.065753|0.079501|0.078649|0.087758|0.119567|0.218496|0.112047|0.500000| |2.229564|2.719480|2.869247|0.072784|2.608954|3.668223|3.742721|4.691985|6.858504|6.549497|4.491050|16.288923|17.562321|8.917335|10.839793|9.909298|6.509790|4.027110|21.136499|5.994433|3.561922|5.224003|3.674023|3.181244|2.979393|3.128852|3.568622|3.935792|315.468513|0.059262|0.058694|0.058703|0.079223|0.078945|0.063325|0.075620|0.072538|0.087298|0.118927|0.218224|0.111560|0.300528|0.500000| |1.740073|2.023773|2.135368|0.055312|2.038377|2.549841|2.598446|3.076019|3.854191|3.732045|2.952805|8.674989|7.515654|9.094241|10.729623|25.923594|12.745898|6.372352|30.089750|8.317847|4.317828|6.290566|3.925176|3.160571|2.781259|2.844631|3.346934|4.082608|389.491835|0.046535|0.046771|0.046228|0.058705|0.057453|0.050780|0.059130|0.057646|0.063922|0.082778|0.119618|0.077432|0.212601|0.205466|0.500000| |1.480920|1.681147|1.791071|0.047669|1.717724|2.086742|2.200814|2.591201|2.979798|2.728703|2.280473|6.651943|4.595379|6.749476|11.488663|12.525423|25.947857|9.399054|49.951595|8.170694|4.263821|6.833604|3.422918|2.895980|2.464110|2.377344|2.634215|3.186737|270.771788|0.039556|0.039878|0.040054|0.047672|0.047775|0.043477|0.048734|0.049261|0.056076|0.073617|0.080730|0.059287|0.125111|0.114542|0.202181|0.500000| |1.629440|1.872666|1.921573|0.050579|1.786176|2.252469|2.340491|2.746885|3.240626|3.037527|2.508759|7.145220|5.119638|6.604720|9.916422|12.148359|11.128272|9.579031|37.392964|25.927696|9.331867|10.773772|7.745225|5.361167|4.198771|4.057845|4.816417|6.873460|482.077342|0.044248|0.043192|0.043634|0.053701|0.054492|0.045170|0.051039|0.049743|0.058907|0.076265|0.091832|0.065551|0.122070|0.156728|0.208431|0.159196|0.500000| |1.409511|1.570124|1.564783|0.042120|1.437279|1.757118|1.838442|2.059239|2.226443|2.093589|1.861235|4.476465|2.706445|3.043563|5.423070|4.354392|4.484763|4.014716|25.121602|7.077921|7.454760|13.004260|8.994355|17.793059|8.931234|5.669211|4.985179|5.680288|283.001717|0.039012|0.037032|0.038238|0.044304|0.046469|0.037220|0.040432|0.039532|0.048134|0.058480|0.060049|0.049135|0.066847|0.080758|0.081741|0.079998|0.134364|0.500000| |1.486861|1.646181|1.598620|0.042980|1.453001|1.768476|1.824628|1.992044|2.126016|2.044500|1.863275|4.088120|2.406568|2.519141|4.403021|3.490225|3.398188|2.803076|17.574810|4.683915|4.176934|6.936638|5.639535|8.957585|17.791710|8.922120|5.657768|4.952963|248.341874|0.041758|0.038760|0.040209|0.046552|0.049302|0.037864|0.040903|0.039396|0.047986|0.055724|0.058250|0.049684|0.059885|0.073509|0.067885|0.061874|0.097126|0.215153|0.500000| |1.632887|1.817541|1.726287|0.045654|1.571239|1.900491|1.902620|2.042481|2.223691|2.226685|2.046675|4.156439|2.490004|2.471936|4.141690|3.464012|3.236857|2.568696|15.697270|4.275100|3.563406|5.621986|4.950601|5.670766|8.922032|17.781900|8.964137|5.656585|289.099349|0.046358|0.042582|0.043447|0.052431|0.054388|0.040893|0.044855|0.042052|0.049385|0.055486|0.064700|0.055676|0.062830|0.078901|0.070055|0.058771|0.093144|0.124394|0.214341|0.500000| 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