Version2.4 2021-05-26T01:24:25Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 05-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CN([C@@H]1CCS(=O)(=O)C1)C(=O)CSc2nc3ccccc3c(=O)n2CCCCCC(=O)[O-] C13234686 RHF 6-31G(d) (6D,7F) CN([C@@H]1CCS(=O)(=O)C1)C(=O)CSc2nc3ccccc3c(=O)n2CCCCCC(=O)[O-] C01[X(C21H26N3O6S2)] 168 C1 540 [O-]C(=O)CCCCCn1c(SCC(=O)N([C@@H]2CCS(=O)(=O)C2)C)nc2c(c1=O)cccc2 [O-]C(=O)CCCCCn1c(SCC(=O)N([C@@H]2CCS(=O)(=O)C2)C)nc2c(c1=O)cccc2 CN([C@@H]1CC[S](=O)(=O)C1)C(=O)CSC2=Nc3ccccc3C(=O)N2CCCCCC([O-])=O InChIKey=VETSHCLDZZBWOY-OAHLLOKOSA-M InChI=1S/C21H27N3O6S2/c1-23(15-10-12-32(29,30)14-15)18(25)13-31-21-22-17-8-5-4-7-16(17)20(28)24(21)11-6-2-3-9-19(26)27/h4-5,7-8,15H,2-3,6,9-14H2,1H3,(H,26,27)/p-1/t15-/m1/s1 InChI=1/C21H27N3O6S2/c1-23(15-10-12-32(29,30)14-15)18(25)13-31-21-22-17-8-5-4-7-16(17)20(28)24(21)11-6-2-3-9-19(26)27/h4-5,7-8,15H,2-3,6,9-14H2,1H3,(H,26,27)/p-1/t15-/m1/s1/fC21H26N3O6S2/q-1 CN([C@@H]1CCS(=O)(=O)C1)C(=O)CSc2nc3ccccc3c(=O)n2CCCCCC(=O)[O-] C01[X(C21H26N3O6S2)] 168 C01 540 [O-]C(=O)CCCCCn1c(SCC(=O)N([C@@H]2CCS(=O)(=O)C2)C)nc2c(c1=O)cccc2 O=C(N([C@@H]1CC[S@](=O)([O])C1)C)CS[C]1[N][C]2[CH][CH][CH][CH][C]2C(=O)N1CCCCC[C]([O])[O] CN([C@@H]1CC[S]([O])(=O)C1)C(=O)CS[C]2[N][C]3[CH][CH][CH][CH][C]3C(=O)N2CCCCC[C]([O])[O] InChIKey=IGOUJGNMDVWJFH-OAHLLOKOSA-N InChI=1S/C21H26N3O6S2/c1-23(15-10-12-32(29,30)14-15)18(25)13-31-21-22-17-8-5-4-7-16(17)20(28)24(21)11-6-2-3-9-19(26)27/h4-5,7-8,15H,2-3,6,9-14H2,1H3/t15-/m1/s1 InChI=1/C21H26N3O6S2/c1-23(15-10-12-32(29,30)14-15)18(25)13-31-21-22-17-8-5-4-7-16(17)20(28)24(21)11-6-2-3-9-19(26)27/h4-5,7-8,15H,2-3,6,9-14H2,1H3/t15-/m1/s1 3440.5378789989 -2217.9223796 1-A 28158.5951 127 413 540 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76.9762 96.8536 113.9560 125.3884 128.4787 136.7439 144.2886 157.5532 173.6186 183.0200 187.6921 203.3837 245.1504 278.1659 289.9893 298.0215 311.5444 323.2243 332.1411 358.9203 377.2474 387.1279 409.6875 421.2938 427.6668 441.9621 460.2091 488.7214 499.1629 556.0017 567.2032 569.4356 589.4638 598.0755 615.8781 634.2247 635.1046 636.9596 657.8365 690.6051 705.4199 746.3477 748.4228 775.0299 781.1733 783.7015 787.5313 820.3216 820.8445 842.1052 868.3129 893.2607 900.8575 913.6162 926.9446 933.9634 974.4700 977.8074 988.5538 991.7347 1009.7921 1027.0134 1047.7062 1050.2052 1082.8894 1096.6205 1103.0568 1104.2861 1114.1145 1124.3505 1128.6939 1129.2559 1132.0357 1164.6447 1183.6564 1204.5428 1208.0855 1211.7091 1224.3045 1231.2961 1251.3540 1254.0701 1255.6278 1269.0928 1294.6805 1309.7073 1330.8901 1337.6688 1345.4131 1363.2647 1371.8807 1391.0241 1401.7580 1411.0610 1413.9188 1425.6657 1428.3226 1432.5350 1437.0803 1445.4107 1454.5008 1462.7956 1475.1694 1484.4968 1505.3134 1516.6888 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35.2875 7.3853 15.2042 101.1906 3.1089 19.1576 1.6365 23.4636 34.9887 10.3207 2.7387 7.6448 4.0206 1.3134 13.6523 10.0258 4.9249 29.4019 20.1642 8.5522 0.1613 1.0872 1.0709 1.5972 3.8935 0.4337 0.3451 0.1457 2.6904 0.3700 0.9413 0.6549 1.3726 0.9105 0.4240 0.5184 0.7139 1.0690 0.1508 1.6939 1.1357 0.2355 0.7507 0.5549 1.9321 0.5451 3.2885 0.3028 2.7891 0.6327 1.4073 0.9809 1.4350 0.8612 2.0680 0.6995 1.8174 2.8803 0.5644 2.1070 2.1471 2.1560 0.5559 4.1380 1.8745 1.7966 2.5160 1.9051 1.5223 1.2622 1.1315 5.2704 1.6149 3.0243 4.8753 20.6096 0.2869 2.5693 0.7850 6.1569 8.2837 0.1086 1.1963 17.9721 21.9981 0.3915 5.1701 4.4100 7.0679 3.1040 2.2509 2.3354 0.8488 0.5222 8.3576 0.5102 2.4744 0.2100 2.9451 4.9116 0.5428 3.9708 17.7964 18.8837 3.9647 19.6514 3.6014 11.4737 6.2988 3.3452 7.4668 2.5968 6.2894 3.7172 1.9905 20.4353 9.1244 7.1844 4.2254 2.1368 18.5444 2.8047 1.6175 0.4194 38.8136 2.2220 7.2321 10.3860 27.2589 16.1927 92.0163 23.8575 4.1258 1.2881 1.6564 2.9573 23.8244 3.3843 5.9031 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1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 14.00307 12.00000 1.00783 12.00000 12.00000 31.97207 15.99491 15.99491 12.00000 12.00000 15.99491 12.00000 31.97207 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 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 1.00783 1.00783 16728.9934 36613.5186 50561.9076 1.00000 -0.00228 -0.00091 0.00227 0.99995 -0.00971 0.00094 0.00970 0.99995 1 0.00518 0.00237 0.00171 0.10788 0.04929 0.03569 10.62 23.15 23.46 30.19 39.63 42.49 57.51 75.05 78.50 87.85 103.60 110.75 139.35 163.96 180.41 184.85 196.74 207.60 226.68 249.80 263.32 270.05 292.62 352.72 400.22 417.23 428.79 448.24 465.05 477.88 516.41 542.77 556.99 589.45 606.15 615.32 635.88 662.14 703.16 718.18 799.96 816.08 819.29 848.11 860.50 886.11 912.51 913.77 916.44 946.48 993.63 1014.94 1073.83 1076.81 1115.10 1123.93 1127.57 1133.08 1180.26 1181.01 1211.60 1249.31 1285.20 1296.13 1314.49 1333.67 1343.77 1402.05 1406.85 1422.31 1426.89 1452.87 1477.64 1507.42 1511.01 1558.04 1577.79 1587.05 1588.82 1602.96 1617.69 1623.94 1624.75 1628.75 1675.66 1703.02 1733.07 1738.17 1743.38 1761.50 1771.56 1800.42 1804.33 1806.57 1825.94 1862.76 1884.38 1914.85 1924.61 1935.75 1961.43 1973.83 2001.37 2016.82 2030.20 2034.31 2051.21 2055.04 2061.10 2067.64 2079.62 2092.70 2104.64 2122.44 2135.86 2165.81 2182.18 2199.45 2212.82 2220.24 2242.12 2274.55 2295.67 2308.15 2322.27 2323.87 2341.00 2341.78 2351.79 2357.40 2367.36 2373.04 2375.95 2390.63 2394.24 2411.61 2529.13 2575.31 2612.78 2731.24 2785.44 2802.60 4548.83 4561.99 4586.60 4591.81 4618.10 4628.32 4638.76 4672.62 4686.00 4689.91 4691.76 4721.64 4723.71 4727.68 4732.17 4749.78 4789.71 4800.21 4800.88 4809.30 4825.07 4831.43 4837.19 4861.55 4882.20 4907.90 0.497289 0.527104 0.528048 0.428180 -2217.425091 -2217.395276 -2217.394332 -2217.494200 3.349589D-04 MUNgauss RevisionA2.1 retrievium 26-May-2021 DUDE CN([C@@H]1CCS(=O)(=O)C1)C(=O)CSc2nc3ccccc3c(=O)n2CCCCCC(=O)[O-] C13234686 RHF 6-31G(d) (6D,10F) C1 480.126304 |X|Y|Z| 137.398277 91.353112 30.561391 72.659530 19 6 7 16 14 3 2 |36.858105| |13.074533|53.358707| |7.589475|17.861273|36.858105| |5.658371|12.780652|17.722087|0.500000| |6.019523|10.375025|12.287479|0.247070|36.858105| |4.424708|6.907767|7.672702|0.181313|12.465691|36.858105| |4.734435|6.816219|7.092070|0.157765|7.351846|10.695647|388.023441| |5.107909|6.429079|5.712899|0.124289|6.230215|7.303592|93.905501|73.516695| |3.562750|5.144473|4.978944|0.124827|4.977312|7.121434|94.393644|13.610679|73.516695| |6.242102|10.318816|12.250080|0.247310|7.525246|7.250998|75.746824|12.924718|12.647708|36.858105| |7.688411|18.995847|7.892789|0.220759|5.536931|3.993106|26.967651|6.293277|5.493090|5.309534|36.858105| |5.316730|11.518214|7.044088|0.242578|5.177088|3.895215|25.253815|5.658382|5.327790|4.847332|15.873885|73.516695| |6.759893|10.610795|5.030801|0.135442|4.050229|3.121257|21.719262|5.335235|4.553042|3.959185|12.546950|14.239613|36.858105| |4.134093|6.498539|3.722934|0.108005|3.139788|2.558203|17.553535|4.229256|3.842440|3.081721|7.015069|11.972998|10.526518|388.023441| |3.566695|5.021906|2.940849|0.082047|2.588358|2.166521|15.143312|3.760041|3.347825|2.554697|4.645899|7.519532|7.000672|76.205382|36.858105| |3.902803|5.130913|2.944168|0.079557|2.621719|2.188378|15.480458|3.933157|3.390526|2.582991|4.471870|6.835675|6.940998|51.383968|14.951020|53.358707| |3.194013|4.102577|2.455495|0.066165|2.240372|1.916518|13.643529|3.503133|3.028390|2.214148|3.392774|5.346790|4.649314|34.480232|8.352149|18.786780|36.858105| |3.165461|3.884966|2.345379|0.062036|2.174583|1.876049|13.495828|3.536004|2.990687|2.148975|3.058546|4.759973|4.000922|26.930019|5.361344|10.806174|13.594614|36.858105| |2.604471|3.228567|2.010160|0.053449|1.888784|1.660778|11.964154|3.137988|2.686279|1.870591|2.506586|3.997020|3.109002|21.565456|4.070534|7.099290|7.938893|13.881661|36.858105| |2.266032|2.889760|1.827682|0.049275|1.717316|1.522269|10.905283|2.825583|2.473894|1.703340|2.274906|3.712369|2.776537|20.349604|3.875248|6.218092|6.828233|7.893450|13.601096|36.858105| |2.274826|2.972387|1.876263|0.051198|1.747585|1.542467|10.975974|2.807737|2.493580|1.733695|2.398463|3.963236|2.961772|22.999503|4.632060|7.022405|7.869187|6.844363|7.952670|13.883733|36.858105| |2.628832|3.472996|2.146291|0.058776|1.971517|1.713931|12.146511|3.087519|2.736181|1.953140|2.881363|4.724407|3.724539|30.153960|7.015537|10.730595|13.733349|7.924609|6.907130|7.946840|13.627372|36.858105| |2.502732|3.433572|2.145818|0.059939|1.956338|1.703132|11.966037|2.991293|2.712338|1.940061|2.931709|4.965641|3.726397|33.866572|7.934503|9.187770|7.752632|5.091252|4.510260|5.093451|7.666824|12.996640|36.858105| |2.169922|2.996039|1.915704|0.053858|1.760933|1.553623|10.900411|2.714536|2.496503|1.748848|2.525150|4.365318|3.065067|27.440146|5.449309|6.450178|5.337750|4.009636|3.813573|4.520961|6.696584|8.098034|15.893047|73.516695| |2.843781|4.023951|2.473793|0.069955|2.214779|1.899720|13.255157|3.274733|2.983979|2.194005|3.597983|6.151605|4.739937|50.565324|13.897142|11.030582|6.986687|4.615183|3.834040|3.961229|5.142104|7.896420|13.669960|14.977507|53.358707| |2.546005|3.724515|2.364892|0.068525|2.114544|1.835690|12.713230|3.088734|2.897529|2.104065|3.353149|6.067672|4.064635|45.439273|7.596586|7.004406|4.527840|3.396960|2.967486|3.101469|3.867116|5.057372|7.794367|12.579837|17.493081|36.858105| |2.413432|3.532346|2.277721|0.066330|2.003929|1.768846|12.472339|3.010425|2.877621|2.080416|3.120418|5.680396|3.642853|37.508126|5.688694|5.805574|3.841190|3.021154|2.688914|2.808773|3.413139|4.219270|5.833778|10.097504|10.338850|12.478196|36.858105| |2.131646|3.165043|2.107480|0.062310|1.870939|1.676043|11.734625|2.801108|2.742905|1.937694|2.756796|5.195438|3.030147|29.536072|4.054567|4.401693|2.954675|2.438793|2.219155|2.317433|2.734487|3.199131|4.131953|7.585589|6.712182|7.514975|12.441869|36.858105| |1.978850|2.918415|1.974412|0.058292|1.744946|1.589030|11.289432|2.686758|2.672636|1.860460|2.477037|4.642515|2.657268|24.075056|3.287310|3.758736|2.564199|2.183395|2.013002|2.094135|2.414344|2.738055|3.335187|6.119735|5.123746|4.873862|7.460983|12.435424|36.858105| |1.763691|2.610976|1.805736|0.053633|1.616019|1.490416|10.524625|2.490702|2.518197|1.710419|2.183663|4.147993|2.275995|19.936815|2.668592|3.125137|2.147830|1.869259|1.742381|1.809555|2.052314|2.276907|2.700635|5.000616|4.060393|3.741296|4.857445|7.450290|12.490437|36.858105| |1.630705|2.394168|1.674815|0.049511|1.500536|1.402554|10.014003|2.369079|2.422409|1.616492|1.961227|3.692695|2.020018|16.963443|2.282628|2.748165|1.907440|1.693437|1.592261|1.646999|1.836998|2.003126|2.301852|4.235064|3.385052|2.944737|3.696762|4.801308|7.326744|12.227549|36.858105| |1.674503|2.440549|1.700388|0.049962|1.512059|1.415429|10.226941|2.426055|2.476740|1.658801|1.986253|3.695469|2.055617|17.017393|2.311134|2.808846|1.954807|1.743044|1.639188|1.690424|1.876755|2.043012|2.320243|4.229849|3.393422|2.877117|3.682573|4.447938|6.901351|8.020176|15.438074|73.516695| |1.498198|2.198844|1.554616|0.045994|1.407033|1.324866|9.416331|2.224622|2.291103|1.503094|1.786137|3.374789|1.820513|15.070895|2.022057|2.458120|1.713478|1.535799|1.452193|1.501368|1.662041|1.795310|2.042020|3.767583|2.977815|2.560703|3.064584|3.883794|5.163801|8.105994|15.449245|15.166302|73.516695| |17.570415|12.257974|5.949690|0.133615|4.628638|3.713730|29.794080|8.011967|5.898949|5.609167|6.641985|8.470947|6.600809|29.449787|3.700601|5.609262|3.386936|3.380009|2.761553|2.385547|2.386468|2.761349|2.603351|3.993540|4.002544|2.604789|2.517147|2.194865|2.058425|1.815470|1.687374|3.111612|2.738031|0.500000| |17.595624|12.277881|5.839047|0.130486|5.306144|3.907855|27.977440|7.686885|5.438669|4.712579|6.864654|8.662214|6.999446|30.090200|3.807078|5.890217|3.529282|3.554702|2.871382|2.455336|2.445526|2.837072|2.650928|4.046366|4.069546|2.616117|2.418662|2.117312|1.939312|1.725679|1.584752|2.879033|2.592080|0.300847|0.500000| |17.649851|12.471714|7.509551|0.148309|6.640601|5.097754|41.380329|12.389384|7.323359|6.961960|5.696424|7.828549|4.909750|23.941945|2.969602|4.384975|2.745248|2.772794|2.346846|2.053207|2.041016|2.308721|2.197219|3.440576|3.334821|2.226941|2.128841|1.912134|1.795000|1.620327|1.512811|2.761028|2.488472|0.302678|0.303293|0.500000| |6.847262|9.894538|8.729103|0.175864|17.599037|8.893524|46.754936|12.010382|7.929431|6.296719|5.165331|8.061017|4.062865|21.772443|2.608312|3.687074|2.330168|2.301657|1.993123|1.790238|1.802323|2.025666|1.977451|3.148680|3.014964|2.076657|1.952555|1.803251|1.677219|1.545710|1.435479|2.577856|2.390513|0.138916|0.176444|0.227091|0.500000| |5.013433|8.839695|8.766566|0.226979|17.599994|8.758295|37.870722|8.245237|7.225377|5.564863|5.450064|9.713427|4.003462|22.948724|2.621605|3.557240|2.228656|2.138097|1.860827|1.705762|1.748837|1.978200|1.983499|3.183701|3.074224|2.177960|2.037571|1.916427|1.768811|1.646279|1.516709|2.694697|2.536116|0.110442|0.131297|0.142501|0.302409|0.500000| |3.861093|5.662050|5.527029|0.134290|8.635577|17.617667|57.291983|12.190291|10.902929|5.311801|3.385560|5.840333|2.769704|16.375988|1.995580|2.763604|1.802629|1.781777|1.590986|1.458187|1.468642|1.617757|1.598653|2.603458|2.400687|1.699515|1.630526|1.547453|1.466915|1.381479|1.302715|2.333348|2.196697|0.091054|0.098670|0.124710|0.217289|0.197399|0.500000| |3.769178|6.098798|6.694183|0.183078|8.702384|17.585726|57.599796|9.682157|12.253331|6.437103|3.753906|6.850298|2.923018|17.655412|2.080862|2.816209|1.814846|1.759284|1.565338|1.448895|1.478135|1.641650|1.649772|2.693163|2.512402|1.810735|1.755844|1.684930|1.604119|1.517441|1.430852|2.557754|2.412255|0.090817|0.093232|0.114691|0.173150|0.212508|0.299104|0.500000| |4.805846|8.073044|8.673365|0.232479|5.846250|6.074973|57.505136|9.772327|12.555135|17.624917|4.748144|8.272833|3.593247|21.013721|2.431125|3.283477|2.079606|1.998543|1.754302|1.616320|1.656610|1.862165|1.873147|3.027050|2.888551|2.072271|2.080387|1.965628|1.909462|1.768781|1.682932|3.073091|2.786401|0.126566|0.106433|0.140126|0.133987|0.132808|0.127528|0.170652|0.500000| |7.067702|9.983527|8.564484|0.180917|5.812735|5.422517|57.537898|12.629856|10.562629|17.641235|5.128301|7.880500|4.078696|22.065135|2.636995|3.693350|2.332595|2.287367|1.983089|1.790117|1.810168|2.037635|2.000637|3.189701|3.060250|2.125934|2.116845|1.945924|1.877893|1.709846|1.622031|2.985116|2.666994|0.193556|0.140675|0.222490|0.151720|0.125404|0.121376|0.132778|0.301279|0.500000| |6.730182|9.338736|4.603601|0.120050|4.021470|3.064668|20.905428|5.280399|4.350653|3.614445|8.874724|11.137761|17.633461|56.473719|6.649141|10.051486|4.988945|4.414139|3.359386|2.935213|3.081596|3.858164|3.715157|5.403109|6.186061|3.773018|3.269602|2.741815|2.395268|2.077503|1.848893|3.327783|2.988464|0.171307|0.227696|0.137884|0.117172|0.111855|0.077188|0.078465|0.089513|0.102927|0.500000| |7.091443|9.602176|4.657935|0.121777|3.697610|2.953503|21.551951|5.388170|4.548241|3.964021|8.823633|10.832856|17.652570|56.526194|6.648931|9.855477|4.931199|4.345130|3.323981|2.916727|3.070097|3.842861|3.722265|5.419909|6.222225|3.833025|3.595870|2.944058|2.647694|2.244737|2.019560|3.708952|3.217074|0.225516|0.193872|0.141189|0.104437|0.097890|0.073079|0.076422|0.099825|0.119468|0.304652|0.500000| |3.656227|4.301325|2.555169|0.066397|2.373071|2.031272|14.711963|3.911442|3.222652|2.340552|3.297402|4.998976|4.319451|26.746141|4.919702|9.958509|8.919956|17.736812|8.902662|5.610589|4.938750|5.653101|4.149361|5.966910|5.486502|3.082439|2.777654|2.281148|2.061857|1.780045|1.623408|2.974651|2.626052|0.109249|0.117084|0.088420|0.070839|0.064098|0.053613|0.052324|0.059616|0.069878|0.136241|0.133151|0.500000| |2.500226|3.053906|1.921453|0.050728|1.823210|1.616358|11.707460|3.102321|2.633459|1.806170|2.320305|3.696923|2.804423|18.945130|3.382946|5.739936|5.645516|8.984051|17.705468|8.879510|5.659125|4.968760|3.594586|5.594337|4.310705|2.548260|2.345778|1.978202|1.818514|1.593098|1.470516|2.694670|2.398232|0.073561|0.076566|0.063608|0.053819|0.049626|0.043292|0.042158|0.046905|0.053356|0.084359|0.083434|0.214719|0.500000| |2.027667|2.589880|1.661911|0.044847|1.572936|1.408489|10.102476|2.620650|2.307298|1.561619|2.017930|3.321262|2.402426|17.544506|3.190588|4.943965|4.929354|5.633115|8.858698|17.724812|8.948572|5.642018|4.131332|6.923803|4.487850|2.702765|2.490962|2.105492|1.927843|1.686955|1.549210|2.825908|2.526131|0.059082|0.060606|0.051704|0.045515|0.043392|0.037660|0.037316|0.041299|0.045504|0.070176|0.069806|0.123647|0.214386|0.500000| |2.041250|2.702303|1.730853|0.047590|1.616956|1.438863|10.212779|2.597165|2.338095|1.605890|2.181793|3.665342|2.630685|20.871044|4.017719|5.705391|5.636557|4.940086|5.633090|8.904608|17.750002|8.939655|7.130834|13.298585|6.411475|3.785662|3.387738|2.766347|2.447681|2.092140|1.870294|3.382020|3.015057|0.059180|0.060327|0.051301|0.046024|0.045124|0.038113|0.038536|0.042941|0.046324|0.075080|0.074965|0.107336|0.123908|0.213494|0.500000| |2.678873|4.033588|2.568419|0.075575|2.294117|1.972313|13.454654|3.237479|3.053941|2.239269|3.740802|7.011038|4.428757|54.024995|7.185343|6.630348|4.073944|3.149109|2.723986|2.776525|3.333054|4.260756|5.810416|9.290703|12.404446|17.637018|8.790162|6.872903|4.531388|3.650822|2.865444|4.907140|4.488714|0.074769|0.076308|0.064858|0.061978|0.066514|0.050476|0.054313|0.061361|0.062019|0.113023|0.110479|0.081593|0.065976|0.067740|0.089531|0.500000| |2.262412|3.273796|2.113507|0.061032|1.926059|1.688187|11.639738|2.838552|2.668323|1.892239|2.872087|5.207094|3.390027|34.445713|5.787556|5.921164|4.101890|3.161252|2.855883|3.074061|3.892314|4.843146|7.631320|14.707256|12.590046|17.689696|8.840837|6.802286|4.507086|3.622976|2.846361|4.865428|4.468689|0.063868|0.064996|0.055751|0.052747|0.055330|0.043790|0.046324|0.051775|0.052943|0.090277|0.089043|0.078829|0.068346|0.075483|0.110280|0.304392|0.500000| |2.252563|3.220188|2.081901|0.059857|1.846735|1.643520|11.691781|2.847890|2.708019|1.929095|2.768559|4.934643|3.245659|30.909095|5.103123|5.551547|3.904268|3.090925|2.815362|3.017188|3.738270|4.504888|6.283049|11.649568|9.462455|8.908955|17.548447|8.835183|6.811571|4.515647|3.595904|6.527947|5.293758|0.065875|0.062954|0.055611|0.050404|0.051798|0.042343|0.045132|0.053417|0.054998|0.082576|0.091381|0.077517|0.067868|0.074618|0.105478|0.173706|0.214542|0.500000| |2.680865|3.956917|2.522140|0.073590|2.168688|1.906301|13.584826|3.264830|3.124242|2.312280|3.539981|6.402194|4.157401|43.124396|6.064523|6.198649|3.921858|3.108108|2.709787|2.753411|3.257512|4.061660|5.183838|8.379624|9.472695|8.859116|17.535484|8.849313|6.872829|4.537776|3.624202|6.637294|5.306284|0.078753|0.073516|0.065020|0.058436|0.060700|0.048387|0.052503|0.064441|0.065811|0.099542|0.116579|0.080869|0.066015|0.067510|0.087371|0.209174|0.173796|0.302853|0.500000| |2.213364|3.358462|2.254303|0.067692|1.996579|1.781998|12.338202|2.916542|2.880865|2.047523|2.971450|5.776571|3.183412|31.708097|3.999304|4.312646|2.819958|2.344070|2.112528|2.172189|2.524540|2.967007|3.735111|6.641114|6.283660|6.938149|8.854966|17.475359|8.838106|6.840904|4.493142|7.223046|6.701452|0.062555|0.060826|0.055102|0.052935|0.057326|0.045495|0.050100|0.057986|0.056457|0.079351|0.083836|0.061747|0.052629|0.054804|0.070036|0.208501|0.169846|0.173536|0.211279|0.500000| |1.952567|2.870642|1.922742|0.056530|1.735763|1.561166|10.867849|2.607503|2.545242|1.767343|2.467883|4.626119|2.711175|25.736816|3.674172|4.069361|2.808912|2.333934|2.159079|2.292025|2.724973|3.120924|4.076344|7.924622|6.257506|6.911758|8.856281|17.482051|8.824734|6.827177|4.470276|7.131849|6.710867|0.055485|0.054384|0.049002|0.046709|0.049606|0.040343|0.043562|0.049580|0.049193|0.069813|0.072812|0.060155|0.053506|0.058343|0.078244|0.172029|0.204878|0.212207|0.173668|0.303510|0.500000| |1.887630|2.735716|1.843701|0.053785|1.638421|1.496839|10.708287|2.570669|2.537437|1.751549|2.290021|4.209000|2.490017|22.008157|3.156307|3.681913|2.578231|2.206252|2.061352|2.172255|2.515544|2.804876|3.401753|6.393250|4.991666|4.534762|6.858836|8.841484|17.534610|8.888024|6.732492|12.407960|8.570618|0.054929|0.051603|0.047707|0.044090|0.045890|0.038568|0.041751|0.049664|0.049507|0.063031|0.069958|0.057360|0.051679|0.055848|0.071731|0.111830|0.119834|0.205056|0.171617|0.173426|0.210707|0.500000| |2.118105|3.144125|2.127176|0.063036|1.850463|1.686425|12.093823|2.862738|2.866579|2.020562|2.671528|5.012067|2.837792|25.375358|3.354052|3.858088|2.586895|2.214882|2.021129|2.070260|2.356542|2.692558|3.197477|5.665041|5.005384|4.542732|6.857008|8.836635|17.552637|8.905397|6.801855|12.881105|8.545272|0.061701|0.056964|0.053233|0.049168|0.051745|0.042957|0.047349|0.058039|0.056864|0.069732|0.079476|0.058728|0.050896|0.052745|0.065295|0.120186|0.111544|0.169718|0.207178|0.210910|0.173279|0.305793|0.500000| |1.805378|2.710381|1.891575|0.056828|1.691946|1.560860|10.933788|2.566364|2.619129|1.780753|2.280295|4.415409|2.333215|20.512811|2.646901|3.086631|2.090867|1.822729|1.687084|1.735831|1.956733|2.185446|2.576527|4.694841|3.952114|3.656866|4.519897|6.837938|8.823927|17.471378|8.850703|11.100818|12.872667|0.051203|0.048912|0.046109|0.044612|0.048167|0.040068|0.044439|0.051442|0.048994|0.058938|0.063092|0.048586|0.042959|0.044857|0.054948|0.103612|0.097325|0.111447|0.120105|0.205953|0.170579|0.173546|0.210680|0.500000| |1.653688|2.431282|1.681271|0.049688|1.522808|1.405025|9.867720|2.347223|2.359080|1.586627|2.024633|3.827332|2.123113|18.546382|2.538487|2.986729|2.081609|1.814609|1.707506|1.791636|2.040777|2.238768|2.671283|5.067551|3.930565|3.633239|4.499080|6.780762|8.809171|17.488181|8.833818|10.905959|13.125500|0.047069|0.045313|0.042320|0.040649|0.043256|0.036387|0.039660|0.045296|0.044009|0.054590|0.057894|0.047721|0.043365|0.046650|0.058500|0.097552|0.102072|0.119492|0.111468|0.169066|0.203393|0.211283|0.173626|0.304919|0.500000| 2215.531240 -12125.749042 4490.286461 -238.529229 -5658.460570 3440.538127 -2217.922443 2.001079 4061800000000035 44E4D473CFD88512 446513AEDC6DCE7D 41A10466B2000001 4026000000000000 432D427BF5FDD909