Version2.1 2021-01-11T22:26:52Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 26-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC(C)(C)CC(=O)N1C[C@@H]2C[C@H](C1)c3ccc(c(=O)n3C2)NC(=O)Nc4ccc(cc4)Cl C04236165 RHF 6-31G(d) (6D,7F) CC(C)(C)CC(=O)N1C[C@@H]2C[C@H](C1)c3ccc(c(=O)n3C2)NC(=O)Nc4ccc(cc4)Cl C01[X(C24H29Cl1N4O3)] 177 C1 542 O=C(Nc1ccc2n(c1=O)C[C@H]1C[C@@H]2CN(C1)C(=O)CC(C)(C)C)Nc1ccc(cc1)Cl O=C(Nc1ccc2n(c1=O)C[C@H]1C[C@@H]2CN(C1)C(=O)CC(C)(C)C)Nc1ccc(cc1)Cl CC(C)(C)CC(=O)N1C[C@@H]2C[C@H](C1)C3=CC=C(NC(=O)Nc4ccc(Cl)cc4)C(=O)N3C2 InChIKey=STGMWRKUTMSITC-JKSUJKDBSA-N InChI=1S/C24H29ClN4O3/c1-24(2,3)11-21(30)28-12-15-10-16(14-28)20-9-8-19(22(31)29(20)13-15)27-23(32)26-18-6-4-17(25)5-7-18/h4-9,15-16H,10-14H2,1-3H3,(H2,26,27,32)/t15-,16+/m0/s1 InChI=1/C24H29ClN4O3/c1-24(2,3)11-21(30)28-12-15-10-16(14-28)20-9-8-19(22(31)29(20)13-15)27-23(32)26-18-6-4-17(25)5-7-18/h4-9,15-16H,10-14H2,1-3H3,(H2,26,27,32)/t15-,16+/m0/s1/f/h26-27H CC(C)(C)CC(=O)N1C[C@@H]2C[C@H](C1)c3ccc(c(=O)n3C2)NC(=O)Nc4ccc(cc4)Cl C01[X(C24H29Cl1N4O3)] 177 C01 542 O=C(Nc1ccc2n(c1=O)C[C@H]1C[C@@H]2CN(C1)C(=O)CC(C)(C)C)Nc1ccc(cc1)Cl O=C(N[C]1=[CH][CH]=C2N([C]1=O)C[C@H]1C[C@@H]2CN(C1)C(=O)CC(C)(C)C)N[C]1[CH][CH][C]([CH][CH]1)Cl CC(C)(C)CC(=O)N1C[C@@H]2C[C@H](C1)C3=CC=C(NC(=O)N[C]4[CH][CH][C](Cl)[CH][CH]4)C(=O)N3C2 InChIKey=STGMWRKUTMSITC-JKSUJKDBSA-N InChI=1S/C24H29ClN4O3/c1-24(2,3)11-21(30)28-12-15-10-16(14-28)20-9-8-19(22(31)29(20)13-15)27-23(32)26-18-6-4-17(25)5-7-18/h4-9,15-16H,10-14H2,1-3H3,(H2,26,27,32)/t15-,16+/m0/s1 InChI=1/C24H29ClN4O3/c1-24(2,3)11-21(30)28-12-15-10-16(14-28)20-9-8-19(22(31)29(20)13-15)27-23(32)26-18-6-4-17(25)5-7-18/h4-9,15-16H,10-14H2,1-3H3,(H2,26,27,32)/t15-,16+/m0/s1/f/h26-27H 3312.0055939000 -1827.6695509 1-A 24339.5258 121 421 542 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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 7971.2073 38801.3644 43044.8966 0.99996 -0.00869 -0.00290 0.00871 0.99995 0.00538 0.00286 -0.00540 0.99998 1 0.01087 0.00223 0.00201 0.22641 0.04651 0.04193 10.15 13.31 21.89 48.11 62.58 68.59 71.69 83.66 105.02 131.96 182.02 210.19 212.64 215.78 247.81 258.62 317.63 345.64 357.93 374.51 399.33 409.67 435.16 441.90 460.99 492.77 513.64 519.70 526.42 542.44 558.82 584.98 596.09 603.27 617.71 635.91 645.18 648.44 661.55 680.75 724.56 733.70 771.00 811.60 821.76 839.76 914.82 917.88 927.06 971.56 994.46 1009.78 1043.92 1072.18 1124.53 1143.65 1152.34 1174.56 1209.41 1229.36 1240.47 1259.72 1287.51 1329.09 1329.96 1349.40 1375.36 1382.54 1415.48 1426.94 1441.00 1451.17 1461.44 1477.37 1486.97 1489.64 1518.31 1524.88 1541.61 1550.85 1554.72 1592.46 1592.67 1605.04 1644.89 1656.59 1680.95 1684.81 1693.65 1730.65 1741.44 1744.81 1751.24 1809.74 1823.01 1840.37 1862.40 1885.27 1891.24 1907.77 1929.70 1935.61 1963.93 1972.15 1996.61 2006.45 2017.29 2030.04 2040.31 2071.27 2090.47 2093.39 2121.48 2144.94 2162.60 2176.00 2182.66 2193.04 2212.16 2220.67 2236.85 2237.77 2239.75 2245.68 2274.48 2308.10 2311.33 2323.78 2343.49 2356.02 2363.26 2368.67 2375.68 2379.51 2388.45 2389.96 2401.45 2407.78 2409.51 2471.15 2480.82 2559.26 2585.61 2600.90 2650.50 2707.83 2772.06 2800.76 4561.40 4569.99 4589.91 4593.70 4597.85 4613.53 4620.88 4642.72 4658.76 4666.03 4672.41 4675.16 4679.53 4680.72 4692.41 4697.57 4774.08 4779.79 4785.90 4824.10 4833.60 4836.20 4876.22 4886.97 4892.99 4973.70 4993.49 5531.72 5583.11 0.546705 0.574438 0.575382 0.483404 -1827.122846 -1827.095113 -1827.094169 -1827.186147 3.084957D-04 MUNgauss RevisionA2.0 retrievium 11-Jan-2021 DUDE CC(C)(C)CC(=O)N1C[C@@H]2C[C@H](C1)c3ccc(c(=O)n3C2)NC(=O)Nc4ccc(cc4)Cl C04236165 RHF 6-31G(d) (6D,10F) C1 456.192819 |X|Y|Z| 60.117185 34.988270 139.646790 66.473828 22 6 7 18 4 |36.858105| |12.402269|36.858105| 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|3.666018|4.263875|3.652345|3.686912|6.513822|7.581457|9.437803|17.885365|7.822220|6.600731|0.137064|7.590039|12.373136|0.247946|36.858105| |2.842651|3.422947|3.328375|3.091462|4.508763|4.926495|7.142481|8.706129|5.429563|6.574135|0.135856|7.623631|12.589460|0.250755|7.584238|36.858105| |2.692673|3.303403|3.225637|3.149865|4.175958|4.118857|6.066926|6.527531|4.010006|4.492846|0.101164|5.139527|7.629010|0.203197|5.748930|14.190536|36.858105| |2.516696|3.100111|3.195756|2.998164|3.659504|3.559459|5.497611|5.246849|3.349496|3.710154|0.087192|3.917591|4.986660|0.131689|4.178721|7.887592|13.315420|36.858105| |2.479453|3.020705|3.265020|2.825169|3.473307|3.538786|5.678151|5.127791|3.413590|3.849962|0.091677|3.785647|4.437084|0.111359|3.787550|6.850878|7.959061|14.184436|36.858105| |2.595119|3.104135|3.364717|2.766820|3.654530|4.040655|6.592226|6.070267|4.246540|5.073286|0.118142|4.592871|5.050713|0.117936|4.217495|7.903053|6.852247|7.829319|13.037583|36.858105| |2.444099|2.847587|3.174255|2.515206|3.219661|3.628031|6.255674|5.270374|3.899990|4.602797|0.114016|3.938310|4.017590|0.095497|3.515556|5.415617|4.768599|5.385629|8.149098|15.676819|73.516695| |2.788289|3.314846|3.409898|2.898214|4.167471|4.875897|7.571497|8.195934|5.737842|7.525729|0.156088|6.772879|7.657018|0.159399|5.767516|13.786349|8.085574|6.885417|7.881507|13.908092|15.021228|53.358707| |2.733209|3.097965|3.181582|2.636607|3.821787|4.884291|8.111207|8.482587|7.460452|12.451720|0.250391|7.620494|6.508524|0.135449|5.324643|7.552112|5.099172|4.492480|5.097172|7.984136|12.942809|17.546398|36.858105| |2.252935|2.697249|3.007928|2.555994|2.941883|2.969216|4.948508|4.145717|2.832444|3.122797|0.077448|3.009819|3.355518|0.086124|2.993412|4.571384|5.097986|7.718556|13.632447|8.075643|12.953791|7.169956|4.019054|53.358707| |2.074467|2.466817|2.732016|2.418285|2.620638|2.562930|4.280622|3.526292|2.394365|2.582577|0.064958|2.544996|2.846228|0.075356|2.592595|3.671182|4.260256|6.242474|7.716720|5.177872|8.546348|5.338423|3.141113|19.042671|36.858105| |2.051964|2.451395|2.649327|2.470509|2.611401|2.488171|4.090811|3.431566|2.292088|2.449622|0.061335|2.479970|2.837157|0.076934|2.592293|3.611965|4.433326|6.574845|6.640945|4.449068|7.019030|4.933442|2.883794|11.472300|15.851067|73.516695| |1.901018|2.213886|2.483660|2.164727|2.295346|2.265995|3.873555|3.081689|2.134256|2.284498|0.058639|2.217021|2.407806|0.063706|2.228609|2.976964|3.289189|4.339714|5.261182|4.155090|7.467564|4.408594|2.749158|11.414405|13.892946|14.899692|53.358707| |1.725459|1.982624|2.203471|1.973487|2.022885|1.974575|3.389811|2.669261|1.851519|1.958605|0.050765|1.917984|2.073236|0.055616|1.943444|2.480055|2.739179|3.447189|3.865463|3.188847|5.706541|3.576666|2.287136|7.135398|7.621425|11.606912|18.459555|36.858105| |1.605976|1.815453|2.027477|1.794406|1.832072|1.806392|3.146889|2.430196|1.708485|1.799492|0.047224|1.743673|1.851889|0.049512|1.750043|2.171049|2.333668|2.822264|3.178001|2.779228|5.135196|3.165994|2.087181|5.610549|5.148899|7.907219|10.883379|13.680551|36.858105| |1.468916|1.642716|1.815761|1.640593|1.645350|1.613009|2.814110|2.166017|1.524380|1.594409|0.042068|1.555052|1.647023|0.044393|1.567641|1.894546|2.033895|2.399495|2.615905|2.321318|4.246874|2.720881|1.814714|4.369443|3.887115|6.410524|7.073736|7.888944|13.796721|36.858105| |1.431728|1.603113|1.750356|1.624525|1.605999|1.556390|2.693651|2.092812|1.461853|1.524100|0.040082|1.504593|1.606977|0.043732|1.531979|1.838443|2.000992|2.353243|2.489231|2.177262|3.895617|2.590278|1.714976|4.050851|3.672601|6.445239|6.201435|6.855319|7.985969|13.789342|36.858105| |1.512899|1.712775|1.857757|1.751917|1.727726|1.658014|2.837921|2.236764|1.546499|1.615041|0.042127|1.610165|1.742774|0.047701|1.654489|2.011797|2.235605|2.675404|2.775726|2.354186|4.121645|2.796708|1.818233|4.517338|4.309069|8.015050|6.975516|7.933040|6.919893|7.959734|13.800986|36.858105| |1.664058|1.911486|2.086329|1.943236|1.948128|1.870466|3.180448|2.531762|1.740015|1.829546|0.047314|1.822811|1.991712|0.054249|1.873821|2.353312|2.654554|3.304819|3.477453|2.835946|4.917225|3.287506|2.092671|5.930443|6.264310|11.746274|10.492571|13.694593|7.944585|6.854580|7.929681|13.754142|36.858105| |1.285687|1.420775|1.536179|1.447479|1.415057|1.370100|2.379599|1.840294|1.290617|1.337639|0.035403|1.324385|1.405816|0.038454|1.349560|1.578658|1.703602|1.950638|2.030988|1.815437|3.246412|2.207141|1.482124|3.184429|2.756410|4.915193|4.375431|4.210831|4.769223|7.024829|10.915722|7.020813|4.753238|448.794386| |17.633071|8.743634|6.868882|5.513549|6.695537|6.562919|13.886073|6.194604|3.870351|3.015449|0.076163|2.692679|2.922077|0.072764|3.678860|2.847339|2.628281|2.453210|2.462557|2.646644|4.499928|3.896942|2.899351|3.048432|2.036509|3.535772|2.556052|1.695741|1.588711|1.448855|1.402034|1.472440|1.620030|10.101777|0.500000| |17.511741|8.753303|5.481360|6.933596|6.881653|5.512505|9.482969|5.694701|3.421595|2.742438|0.068831|2.588393|2.896760|0.074461|3.736431|2.755138|2.614746|2.398980|2.322747|2.418997|4.016600|3.591639|2.589800|2.852988|1.941000|3.446739|2.413846|1.618421|1.504313|1.383155|1.355929|1.436255|1.573510|9.826646|0.300917|0.500000| |17.535763|8.800522|6.881151|7.033825|5.465078|4.559392|8.525664|4.721773|2.950679|2.450719|0.062213|2.270293|2.507356|0.064299|3.049730|2.496532|2.405832|2.297659|2.276266|2.350762|3.984632|3.360001|2.414163|2.874332|1.972723|3.472015|2.491060|1.679423|1.573819|1.449006|1.414061|1.487780|1.623905|10.251537|0.301221|0.302041|0.500000| |6.878226|8.799948|17.536091|7.035330|5.467497|4.571339|8.505673|4.758871|2.958819|2.571783|0.064422|2.344840|2.628692|0.066487|3.041714|2.813991|2.772379|2.792520|2.854155|2.891508|4.939144|3.918874|2.713354|3.690644|2.527143|4.373665|3.193586|2.122333|1.974980|1.787684|1.726699|1.820760|2.019656|12.265915|0.169483|0.140503|0.205706|0.500000| |5.481674|8.753589|17.517169|6.928380|6.893185|5.554122|9.449541|5.810352|3.445690|3.055490|0.074208|2.786915|3.244264|0.080582|3.713312|3.668387|3.661512|3.753254|3.853523|3.841371|6.322606|5.125410|3.353596|4.830510|3.213432|5.533094|3.903082|2.506259|2.267906|2.006577|1.933976|2.072945|2.364836|13.435651|0.140122|0.122488|0.140517|0.302010|0.500000| |6.873011|8.744074|17.629774|5.513260|6.697049|6.597393|13.805448|6.277469|3.888194|3.250731|0.080340|2.819523|3.119279|0.075971|3.663265|3.350397|3.131603|3.089793|3.255311|3.510596|6.053362|4.862408|3.469786|4.090224|2.669843|4.509161|3.339560|2.158658|2.007518|1.789657|1.706859|1.794831|2.014685|12.023537|0.204687|0.140132|0.169699|0.301274|0.300943|0.500000| |6.933674|8.717202|5.505005|17.526037|7.016562|4.566316|7.059199|5.121084|2.960210|2.547929|0.062751|2.522776|3.001010|0.079812|3.743159|2.975564|3.028485|2.808456|2.600696|2.553423|4.109922|3.710198|2.499250|3.178600|2.217632|4.063766|2.701361|1.821168|1.658343|1.526217|1.519501|1.640054|1.807678|10.951060|0.140852|0.207487|0.173428|0.142351|0.140938|0.122518|0.500000| |5.505708|8.717740|6.939384|17.530870|7.012987|4.572429|7.050718|5.150299|2.964690|2.637979|0.064253|2.590709|3.140510|0.082611|3.729881|3.337979|3.534739|3.427487|3.162597|2.993880|4.756230|4.200329|2.713834|3.877945|2.722986|5.022943|3.262102|2.176776|1.949887|1.774002|1.765937|1.926962|2.158926|12.519790|0.122525|0.140960|0.142399|0.173726|0.207497|0.140885|0.301161|0.500000| |6.971510|8.768783|6.963425|17.549128|5.545824|4.002631|6.686602|4.398754|2.652287|2.318361|0.057854|2.232127|2.579335|0.067721|3.060604|2.661946|2.716875|2.649336|2.538967|2.480249|4.089120|3.466899|2.349750|3.211516|2.265087|4.100312|2.811483|1.908653|1.752898|1.615519|1.601070|1.715476|1.882810|11.534913|0.142046|0.171276|0.212301|0.212073|0.170880|0.141982|0.301829|0.301836|0.500000| |5.487937|8.850052|6.868168|7.209989|17.533955|8.965119|10.944334|9.667392|4.665050|3.967002|0.090800|3.839299|5.043917|0.122642|6.744164|5.368310|5.216836|4.529142|4.149531|4.204321|6.319507|6.472236|4.036433|4.634303|3.016689|5.404908|3.501853|2.241016|1.995798|1.778359|1.741466|1.894686|2.164867|12.193597|0.137853|0.141534|0.123366|0.141664|0.207407|0.165050|0.177235|0.217881|0.144878|0.500000| |6.891591|8.850384|5.488324|7.178313|17.516170|8.963910|11.030901|9.502167|4.659637|3.687307|0.086879|3.631496|4.520898|0.113896|6.812627|4.162416|3.903230|3.330289|3.078927|3.197023|5.012368|5.023724|3.425979|3.564542|2.371892|4.263542|2.837797|1.861004|1.688854|1.530987|1.505458|1.621602|1.813204|10.740630|0.165945|0.208132|0.141873|0.123346|0.141391|0.138037|0.216969|0.176016|0.144569|0.304542|0.500000| |3.327678|3.413720|3.108839|2.817017|4.395791|6.282035|10.348320|12.411536|17.478988|8.864817|0.219686|6.898185|5.740095|0.128151|6.946614|4.451505|3.462091|2.899571|2.898860|3.458377|5.713258|6.064223|5.477457|3.340911|2.121947|3.649591|2.598120|1.679860|1.558575|1.404065|1.352885|1.428218|1.592041|9.673773|0.101891|0.093070|0.078107|0.074259|0.083179|0.093711|0.078183|0.075458|0.068987|0.111653|0.121262|0.500000| |3.648196|3.821007|3.723515|2.996483|4.766843|7.679006|15.118687|12.563769|17.702908|8.801269|0.213837|5.521069|4.963701|0.108736|5.699030|4.539832|3.522651|3.095222|3.257665|4.091149|7.028921|6.987114|6.875496|3.789622|2.351153|3.948893|2.897225|1.847124|1.720971|1.533781|1.460566|1.533443|1.720629|10.356475|0.116262|0.095952|0.085686|0.086953|0.099106|0.119500|0.079717|0.080388|0.073957|0.120860|0.119013|0.302512|0.500000| |2.522983|2.712590|2.507917|2.418087|3.449129|4.128332|6.406907|7.970452|6.920434|8.800767|0.212437|17.541456|8.829705|0.212390|6.947594|5.533512|4.174283|3.274702|3.133066|3.647787|5.746336|6.692912|5.517964|3.505602|2.232855|3.903446|2.683941|1.733021|1.587365|1.429978|1.389418|1.482090|1.659916|9.912376|0.072805|0.071206|0.061324|0.061036|0.070484|0.072304|0.067909|0.067607|0.059346|0.096696|0.097606|0.206604|0.141022|0.500000| |2.285042|2.522392|2.427774|2.276424|3.129920|3.644813|5.758729|6.624980|5.501450|8.781421|0.210388|17.541914|8.799513|0.211283|5.499986|6.939238|4.992069|3.925815|3.825765|4.604874|7.084510|8.761806|7.004659|4.171647|2.592027|4.479165|3.077167|1.953789|1.775367|1.581613|1.529296|1.636728|1.854767|10.792475|0.065484|0.063036|0.056457|0.059250|0.070188|0.069966|0.062636|0.065178|0.056314|0.091771|0.085138|0.141168|0.123072|0.302260|0.500000| |3.924274|4.812632|3.955232|4.342773|7.749657|7.175460|8.800380|12.409711|5.663776|4.946557|0.108605|5.538120|8.864543|0.216752|17.708496|6.995992|6.158320|4.455269|3.861373|4.041499|5.927082|7.029070|4.445778|4.158079|2.694971|4.884850|3.120376|2.008541|1.793189|1.609476|1.584345|1.724680|1.957284|11.191423|0.104655|0.111920|0.090528|0.091034|0.113569|0.105393|0.124292|0.125039|0.096776|0.245347|0.238461|0.142090|0.127772|0.142163|0.123588|0.500000| |3.458463|3.790012|3.195286|3.350228|5.396368|6.125448|8.273270|12.409951|6.956142|5.762184|0.129080|6.934416|8.855314|0.217810|17.473545|5.533309|4.507511|3.433912|3.136363|3.445151|5.292942|6.095048|4.402684|3.492193|2.266950|4.048195|2.695906|1.752763|1.592344|1.440148|1.411945|1.518257|1.700279|10.083297|0.096765|0.101504|0.080433|0.075913|0.088111|0.089111|0.097527|0.091958|0.078581|0.145312|0.170296|0.203843|0.142722|0.209139|0.141806|0.302789|0.500000| |2.619887|3.182086|3.002151|3.144258|4.008085|3.789519|5.551551|5.950856|3.623652|3.924454|0.090430|4.694382|7.073176|0.221277|5.621448|9.107494|17.748441|8.782931|5.674723|4.943748|6.682505|7.786136|4.132608|5.608494|3.688437|7.107110|3.973765|2.512683|2.150775|1.906512|1.901875|2.135053|2.497298|13.157802|0.070029|0.072063|0.065192|0.072674|0.093094|0.079592|0.086229|0.098382|0.075049|0.137623|0.109068|0.090269|0.087822|0.111826|0.126076|0.177854|0.128036|0.500000| |2.355910|2.884948|2.964225|2.896383|3.292228|3.097524|4.841619|4.448082|2.852688|3.085848|0.074340|3.281406|4.079431|0.112686|3.566176|5.645886|8.761380|17.813014|9.072394|5.581116|7.648261|6.759593|3.587724|9.388041|6.713997|14.885700|6.166945|3.707558|2.950290|2.528077|2.532359|2.958686|3.710048|16.744947|0.063023|0.062708|0.060583|0.073582|0.096701|0.078161|0.075720|0.093393|0.071967|0.111984|0.084737|0.070251|0.073921|0.078844|0.091760|0.107975|0.084133|0.212168|0.500000| |2.371154|2.643341|2.734387|2.304696|3.144417|3.827451|6.523447|6.322339|5.537372|8.855813|0.230160|6.528810|5.279634|0.118822|4.229678|6.048361|4.472776|4.120280|4.770076|7.241489|13.061560|12.531492|17.602851|5.350947|3.084716|4.982308|3.735385|2.285245|2.101702|1.825620|1.716411|1.809583|2.077431|11.912662|0.069573|0.062751|0.059185|0.066344|0.080101|0.082182|0.060981|0.066046|0.057906|0.092082|0.079857|0.124899|0.146422|0.137566|0.192961|0.101145|0.102116|0.102707|0.093371|0.500000| |2.916681|3.293925|3.510316|2.728467|3.947835|5.208779|9.280252|8.200028|7.174446|8.796456|0.204142|5.565402|5.100513|0.110817|4.709468|5.866379|4.371839|4.080889|4.796860|7.417596|13.826386|12.495393|17.649214|5.427455|3.113592|4.998306|3.785365|2.310214|2.131291|1.847180|1.730646|1.819901|2.089699|11.998319|0.087587|0.075129|0.071681|0.082608|0.101937|0.110399|0.070658|0.077256|0.068091|0.113272|0.095382|0.144389|0.216333|0.123626|0.140452|0.113095|0.109580|0.100187|0.092550|0.304804|0.500000| |2.210861|2.606169|2.953265|2.422798|2.813757|2.917449|4.983164|4.053952|2.846083|3.154194|0.079474|2.942824|3.164624|0.080079|2.846192|4.184808|4.343430|5.819381|9.518312|8.118326|16.078052|6.983106|4.164478|26.011933|9.258315|10.773911|10.674240|4.975878|4.183595|3.215940|2.890088|3.110797|3.956774|18.353385|0.061868|0.056801|0.057714|0.074260|0.095256|0.083971|0.061372|0.073641|0.062642|0.088259|0.069258|0.068243|0.079235|0.070049|0.083368|0.079129|0.068279|0.098775|0.142424|0.115727|0.118566|0.500000| |1.900035|2.194651|2.490363|2.108797|2.270584|2.283279|3.957344|3.100537|2.179068|2.341076|0.060560|2.229673|2.378835|0.062200|2.204714|2.927145|3.125271|3.996398|5.061568|4.296960|8.210628|4.477987|2.858402|10.939043|9.406137|10.841049|26.082566|9.377882|7.709935|4.948328|4.100948|4.297743|5.747225|24.046649|0.052661|0.048999|0.050803|0.065312|0.079192|0.069533|0.053583|0.064039|0.056020|0.069872|0.056974|0.053922|0.061042|0.054979|0.063188|0.062222|0.054474|0.076297|0.110561|0.080078|0.081610|0.252062|0.500000| |1.621276|1.823754|2.054561|1.777537|1.839960|1.837972|3.232637|2.470382|1.753866|1.851621|0.048852|1.771216|1.860509|0.049314|1.758475|2.179920|2.299754|2.754408|3.182597|2.870952|5.467776|3.241103|2.167020|5.650441|4.821838|7.099878|10.038699|8.888594|17.697405|8.974584|5.676193|4.974781|5.642538|31.633178|0.044901|0.042013|0.044094|0.055507|0.063523|0.057231|0.045520|0.053222|0.048232|0.055312|0.046886|0.044307|0.049464|0.044700|0.050100|0.049638|0.044418|0.058320|0.077973|0.060994|0.062106|0.123358|0.237010|0.500000| |1.394520|1.544389|1.707484|1.535658|1.540187|1.518565|2.668656|2.035827|1.443075|1.505618|0.039990|1.461382|1.534085|0.041282|1.465944|1.746752|1.851872|2.148080|2.344393|2.129530|3.938990|2.519032|1.705033|3.842312|3.274806|5.381687|5.742827|5.626578|8.931399|17.746926|8.920747|5.656305|4.944732|53.587143|0.038358|0.036479|0.038336|0.046929|0.051895|0.047026|0.039755|0.045733|0.042190|0.045840|0.039878|0.037054|0.040518|0.037491|0.041266|0.041613|0.037592|0.048299|0.062086|0.047803|0.048424|0.079964|0.117117|0.216675|0.500000| |1.462675|1.651078|1.769949|1.707217|1.664807|1.586186|2.703735|2.142186|1.476153|1.536085|0.040063|1.544488|1.677712|0.046299|1.597602|1.917283|2.142532|2.527249|2.555460|2.173664|3.763029|2.626799|1.709296|4.021189|3.740352|7.257676|5.644422|5.649947|4.978390|5.660719|8.944224|17.743947|8.947070|53.677456|0.039365|0.038789|0.040017|0.048309|0.054584|0.047220|0.044693|0.052206|0.046507|0.050662|0.043745|0.038076|0.040484|0.039708|0.043569|0.046467|0.040932|0.057675|0.078468|0.047120|0.047281|0.076258|0.098197|0.107929|0.124386|0.500000| 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