Version2.1 2020-12-27T18:53:51Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 09-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCOc1ccc(cc1)N(CC(=O)Nc2ccccc2C(=O)N3CCCCC3)S(=O)(=O)C C22399540 RHF 6-31G(d) (6D,7F) CCCOc1ccc(cc1)N(CC(=O)Nc2ccccc2C(=O)N3CCCCC3)S(=O)(=O)C C01[X(C24H31N3O5S1)] 186 C1 561 CCCOc1ccc(cc1)N(S(=O)(=O)C)CC(=O)Nc1ccccc1C(=O)N1CCCCC1 CCCOc1ccc(cc1)N(S(=O)(=O)C)CC(=O)Nc1ccccc1C(=O)N1CCCCC1 CCCOc1ccc(cc1)N(CC(=O)Nc2ccccc2C(=O)N3CCCCC3)[S](C)(=O)=O InChIKey=LRJSVKGMJMZNFF-UHFFFAOYSA-N InChI=1S/C24H31N3O5S/c1-3-17-32-20-13-11-19(12-14-20)27(33(2,30)31)18-23(28)25-22-10-6-5-9-21(22)24(29)26-15-7-4-8-16-26/h5-6,9-14H,3-4,7-8,15-18H2,1-2H3,(H,25,28) InChI=1/C24H31N3O5S/c1-3-17-32-20-13-11-19(12-14-20)27(33(2,30)31)18-23(28)25-22-10-6-5-9-21(22)24(29)26-15-7-4-8-16-26/h5-6,9-14H,3-4,7-8,15-18H2,1-2H3,(H,25,28)/f/h25H CCCOc1ccc(cc1)N(CC(=O)Nc2ccccc2C(=O)N3CCCCC3)S(=O)(=O)C C01[X(C24H31N3O5S1)] 186 C01 561 CCCOc1ccc(cc1)N(S(=O)(=O)C)CC(=O)Nc1ccccc1C(=O)N1CCCCC1 CCCO[C]1[CH][CH][C]([CH][CH]1)N(S(=O)(=O)C)CC(=O)N[C]1[CH][CH][CH][CH][C]1C(=O)N1CCCCC1 CCCO[C]1[CH][CH][C]([CH][CH]1)N(CC(=O)N[C]2[CH][CH][CH][CH][C]2C(=O)N3CCCCC3)[S](C)(=O)=O InChIKey=LRJSVKGMJMZNFF-UHFFFAOYSA-N InChI=1S/C24H31N3O5S/c1-3-17-32-20-13-11-19(12-14-20)27(33(2,30)31)18-23(28)25-22-10-6-5-9-21(22)24(29)26-15-7-4-8-16-26/h5-6,9-14H,3-4,7-8,15-18H2,1-2H3,(H,25,28) InChI=1/C24H31N3O5S/c1-3-17-32-20-13-11-19(12-14-20)27(33(2,30)31)18-23(28)25-22-10-6-5-9-21(22)24(29)26-15-7-4-8-16-26/h5-6,9-14H,3-4,7-8,15-18H2,1-2H3,(H,25,28)/f/h25H 3620.8586660624 -1862.0242695 1-A 21402.2895 126 435 561 |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| -92.19628 -20.59073 -20.54154 -20.53804 -20.53400 -20.53354 -15.60044 -15.59277 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2006.74 2014.77 2035.73 2050.99 2068.22 2074.57 2086.87 2088.84 2111.96 2116.75 2130.41 2145.12 2192.59 2196.43 2199.27 2206.47 2233.70 2236.92 2255.14 2270.50 2285.53 2294.30 2303.22 2307.90 2317.71 2327.02 2341.43 2349.83 2357.61 2359.27 2367.00 2367.64 2374.57 2381.44 2391.96 2409.27 2440.11 2477.09 2548.60 2570.70 2600.85 2610.60 2702.36 2848.32 4584.39 4600.14 4601.60 4605.53 4609.76 4614.44 4617.54 4634.02 4654.06 4662.20 4666.00 4672.80 4673.93 4679.89 4685.88 4710.10 4711.51 4778.37 4811.49 4826.55 4826.91 4827.41 4842.91 4843.28 4860.35 4881.68 4887.04 4903.89 4950.38 4966.50 5504.69 0.572193 0.602358 0.603302 0.505013 -1861.452077 -1861.421912 -1861.420967 -1861.519257 3.296663D-04 MUNgauss RevisionA2.0 retrievium 27-Dec-2020 DUDE CCCOc1ccc(cc1)N(CC(=O)Nc2ccccc2C(=O)N3CCCCC3)S(=O)(=O)C C22399540 RHF 6-31G(d) (6D,10F) C1 473.198443 |X|Y|Z| 115.024115 78.164714 45.409410 74.184841 23 6 7 20 3 |36.858105| |12.466242|36.858105| |7.538450|12.548459|36.858105| |5.100130|8.061931|13.541580|73.516695| |3.888092|5.225359|7.976545|25.183612|36.858105| |3.146801|4.086848|5.246568|14.599448|13.670072|36.858105| |2.616814|3.200418|3.982116|9.434565|7.942673|13.834455|36.858105| |2.519676|2.972677|3.779951|8.206387|6.840878|7.912929|13.686447|36.858105| |2.854141|3.334927|4.500048|9.241052|7.923372|6.875828|7.961596|13.774818|36.858105| |3.599094|4.394790|6.691952|13.996849|13.728809|7.925932|6.888311|7.918383|13.724633|36.858105| |2.123976|2.429588|2.950546|6.090888|4.515020|5.140560|7.825835|13.274984|7.729901|5.103939|53.358707| |1.953919|2.206437|2.622070|5.308723|3.753618|4.200439|5.773576|7.656458|5.665376|4.149102|17.884454|36.858105| |1.928435|2.131298|2.537295|4.935465|3.401079|3.525703|4.370639|5.801720|5.302014|3.956144|10.372500|12.464091|36.858105| |2.021687|2.210613|2.670012|5.070860|3.497415|3.450770|4.130102|5.710773|5.936258|4.309565|9.309032|7.951105|15.936055|73.516695| |1.766598|1.933457|2.247361|4.326781|2.873937|2.988630|3.551857|4.265972|3.956684|3.212423|7.032565|7.947771|14.019521|14.928055|53.358707| |1.670833|1.796027|2.062792|3.872795|2.502123|2.530980|2.878596|3.369372|3.304973|2.802522|5.223970|5.057448|7.681535|11.646959|18.448171|36.858105| |1.638298|1.737406|1.996542|3.678820|2.359067|2.334619|2.618831|3.106245|3.165656|2.694761|4.767058|4.250637|6.318029|11.598942|10.613441|13.683711|36.858105| |1.525070|1.595856|1.806546|3.282656|2.059381|2.022672|2.216403|2.554247|2.629782|2.320342|3.805160|3.255955|4.343601|8.016690|7.009083|7.924904|13.789044|36.858105| |1.451584|1.517107|1.696145|3.086033|1.912548|1.891192|2.051404|2.303109|2.342630|2.110235|3.384120|2.911280|3.688221|6.481998|6.177351|6.819082|7.910743|13.746696|36.858105| |1.476092|1.557619|1.738620|3.201588|1.988713|1.992643|2.170486|2.406357|2.400700|2.163959|3.537836|3.135803|3.914894|6.503527|7.032931|7.905000|6.890523|7.996602|13.806256|36.858105| |1.580728|1.691600|1.909607|3.573188|2.259084|2.293580|2.548699|2.854556|2.791149|2.462153|4.272607|3.997430|5.181155|8.024287|10.723714|13.600023|7.903721|6.872252|7.889323|13.691597|36.858105| |1.569305|1.696148|1.897218|3.603409|2.267285|2.353786|2.613596|2.824760|2.681667|2.399403|4.185067|3.963013|4.613065|6.840512|9.099762|7.546760|5.019377|4.456029|5.034086|7.601707|12.665410|36.858105| |1.537417|1.675875|1.872806|3.608727|2.287824|2.433105|2.758294|2.948994|2.703972|2.391523|4.493484|4.395601|4.766885|6.753635|9.345865|6.475644|4.447258|3.828540|4.087094|5.481668|8.095276|15.718031|73.516695| |1.560329|1.678562|1.854033|3.496315|2.157395|2.221700|2.398838|2.529839|2.438505|2.249843|3.612141|3.256468|3.652238|5.678298|6.425671|5.229139|3.962553|3.751890|4.389983|6.364980|7.742832|14.040768|15.088518|53.358707| |1.498988|1.620069|1.764851|3.356086|2.047975|2.143058|2.295568|2.347914|2.226851|2.083755|3.324954|2.941152|3.099757|4.819818|5.162286|3.888693|3.096171|2.934132|3.321783|4.365564|5.014310|7.870979|12.536498|17.748448|36.858105| |1.629344|1.779342|1.930274|3.706841|2.245739|2.365636|2.491478|2.482874|2.348131|2.238433|3.412664|2.962695|3.022116|4.725780|4.784436|3.427114|2.781556|2.591101|2.821583|3.503970|4.061156|5.678693|9.621051|10.499652|12.473822|36.858105| |1.728693|1.870792|2.020642|3.813550|2.274195|2.329844|2.389630|2.393966|2.336139|2.277107|3.204931|2.707626|2.835364|4.586755|4.370851|3.230988|2.708005|2.570438|2.808501|3.411254|3.788200|4.761616|7.482079|8.929871|7.579919|12.445046|36.858105| |1.817642|1.953108|2.148545|4.002185|2.415807|2.418906|2.496092|2.582144|2.580810|2.492555|3.457633|2.948439|3.251723|5.330835|5.093582|3.930224|3.267832|3.107302|3.422313|4.222685|4.707962|5.573890|7.978694|10.521373|6.562642|7.562164|12.446769|36.858105| |1.637464|1.744544|1.922925|3.566603|2.172868|2.183899|2.302602|2.433147|2.419878|2.280333|3.372276|2.934786|3.350217|5.457839|5.562380|4.661867|3.796481|3.731596|4.409567|6.001649|6.382447|7.627004|9.506006|17.743480|7.799121|6.512636|7.518669|12.442284|36.858105| |1.942538|2.175052|2.590314|5.160734|3.627241|3.936868|5.233503|7.140954|5.679934|4.113679|15.721783|7.131491|5.600796|10.005588|5.629013|3.312718|3.213706|2.622787|2.299425|2.335272|2.721218|2.600399|4.934288|3.072636|2.085062|2.096668|1.979261|2.125936|2.117100|388.023441| |1.715574|1.891884|2.204089|4.312425|2.922082|3.147250|3.997833|5.018354|4.235527|3.256117|10.519012|6.921030|5.824797|9.855762|6.163152|3.622651|3.532753|2.851355|2.479234|2.509100|2.931289|2.765941|5.333916|3.193025|2.153650|2.111504|1.965024|2.111183|2.157784|94.571872|73.516695| |2.071033|2.293304|2.771056|5.366631|3.749043|3.796187|4.655280|6.388537|6.172036|4.497188|10.219503|5.175411|4.741805|9.516625|4.865014|3.027275|3.065573|2.550413|2.210777|2.197543|2.499727|2.342559|4.319641|2.818712|1.900710|1.916348|1.849528|2.006908|1.989786|94.876888|13.634972|73.516695| |1.878131|2.123701|2.468261|5.014139|3.430296|3.927943|5.130399|5.682144|4.428444|3.582571|9.651209|5.018350|3.875784|6.675323|4.304606|2.615820|2.505960|2.127649|1.922124|1.970106|2.257880|2.229324|4.278847|2.696357|1.883726|1.918582|1.800474|1.883346|1.854435|76.463120|13.027258|13.156010|36.858105| |17.537165|8.761213|6.812513|8.311122|3.722654|3.005257|2.541542|2.487858|2.850192|3.568766|2.871018|1.966305|1.970800|3.688828|2.472099|1.733363|1.703206|1.592842|1.519419|1.543124|1.645896|1.627572|2.809506|2.215116|1.554680|1.690746|1.816676|1.928596|1.727799|13.625849|3.031693|3.626820|1.822619|0.500000| |17.565946|8.799565|5.492551|7.487998|3.299269|2.790749|2.348790|2.241579|2.480195|3.026881|2.613526|1.780831|1.751607|3.237550|2.205789|1.538294|1.505866|1.410491|1.351245|1.376267|1.466909|1.464123|2.554843|1.991613|1.416622|1.541211|1.634395|1.700160|1.533471|12.567510|2.800844|3.319961|1.727536|0.302032|0.500000| |17.538472|8.761831|6.813196|8.310644|3.726513|3.010340|2.546480|2.491626|2.852716|3.570752|2.873962|1.922988|1.903597|3.583149|2.357820|1.640667|1.624246|1.512600|1.429910|1.443027|1.541171|1.517377|2.646173|2.038842|1.432271|1.541099|1.624046|1.716397|1.565775|13.975967|3.075186|3.784822|1.900038|0.301478|0.302043|0.500000| |8.824012|17.552000|8.947173|13.135403|4.933144|4.057333|3.166926|2.885821|3.155819|4.047258|3.230327|2.131992|2.029060|3.720825|2.501095|1.698097|1.642656|1.507609|1.432375|1.470247|1.597354|1.606466|2.846097|2.154064|1.536682|1.681578|1.745904|1.805631|1.627497|15.320810|3.318858|4.032903|2.153574|0.172501|0.211938|0.210012|0.500000| |8.823552|17.550621|8.946025|13.138410|4.924465|4.045179|3.157598|2.880061|3.152461|4.044445|3.226219|2.191107|2.110485|3.838768|2.637809|1.800771|1.723891|1.586450|1.521726|1.575773|1.714011|1.738053|3.050901|2.363642|1.689785|1.880213|1.990395|2.055879|1.810412|14.866046|3.264750|3.844518|2.043445|0.209987|0.211931|0.172502|0.303476|0.500000| |6.857889|8.839561|17.535639|16.522482|7.072688|4.773939|3.804854|3.749335|4.599779|6.776957|4.023462|2.688701|2.671147|5.039950|3.238072|2.205536|2.136844|1.936980|1.819751|1.864740|2.045474|2.020161|3.500672|2.701952|1.871100|2.050200|2.180840|2.357742|2.089544|18.203978|3.920940|4.856885|2.371715|0.202986|0.140357|0.168351|0.174190|0.213120|0.500000| |6.854932|8.838213|17.538704|16.525146|7.101771|4.795856|3.822395|3.762964|4.611074|6.791770|4.032148|2.581137|2.510531|4.779823|2.992980|2.023224|1.986602|1.797423|1.671331|1.695274|1.853927|1.819919|3.198654|2.398780|1.667916|1.798293|1.868245|1.997674|1.819527|19.069020|4.016969|5.258816|2.551047|0.168259|0.140322|0.202898|0.213166|0.174169|0.300939|0.500000| |3.111774|4.113214|4.864573|13.493994|8.945573|17.740474|8.895258|5.623596|4.955436|5.654657|5.668314|3.574388|3.022252|5.195571|3.608267|2.277421|2.096391|1.841977|1.743481|1.844613|2.104827|2.191054|4.044376|2.852895|2.059709|2.298329|2.258147|2.291758|2.057230|23.808505|4.925031|5.687896|3.493592|0.081339|0.078316|0.081488|0.117096|0.116666|0.120052|0.120568|0.500000| |2.329483|2.806794|3.326974|7.616679|5.646501|8.952840|17.707729|8.917641|5.660323|4.959194|9.851982|5.733996|4.110264|6.634228|4.703492|2.779631|2.497910|2.123339|1.984094|2.117112|2.492184|2.606948|5.009983|3.245127|2.322370|2.519210|2.359125|2.412911|2.244070|35.993615|7.168487|7.501841|5.441276|0.062750|0.059114|0.062881|0.078190|0.077942|0.088323|0.088709|0.214195|0.500000| |2.646461|2.973889|3.894710|7.444643|5.642453|4.958777|5.666685|8.973265|17.785073|8.909096|9.671426|5.549594|5.830560|13.207300|5.729710|3.586743|3.566934|2.921568|2.534360|2.545616|2.941195|2.730674|4.831534|3.341317|2.200679|2.273414|2.270457|2.554211|2.448068|41.566503|7.995646|12.307691|4.193210|0.074377|0.064165|0.074411|0.077856|0.077818|0.113346|0.113475|0.107655|0.124600|0.500000| |4.002567|4.669152|7.409597|12.484346|8.869267|5.629412|4.964301|5.658202|8.970107|17.769806|5.654164|3.536788|3.552421|7.092536|4.021104|2.666471|2.624401|2.298050|2.084861|2.109404|2.356934|2.263385|3.949769|2.916441|1.971926|2.104291|2.176226|2.408202|2.209438|25.348326|5.190163|7.164969|3.096052|0.112644|0.090972|0.112580|0.115369|0.115437|0.226290|0.225757|0.124085|0.107704|0.216476|0.500000| |1.768768|1.980260|2.303912|4.622247|3.165020|3.562878|4.728310|5.680909|4.393755|3.406391|12.454775|17.638052|8.935730|11.008102|9.818365|4.780383|4.037747|3.144768|2.837236|3.060519|3.863971|3.880834|8.008572|4.278259|2.884523|2.838961|2.538354|2.711317|2.761214|48.563686|14.126182|8.401161|5.124950|0.049269|0.045200|0.048485|0.053631|0.054692|0.065054|0.063284|0.087384|0.139005|0.121225|0.082587|0.500000| |2.014227|2.301740|2.721928|5.620498|3.967344|4.602903|6.328449|7.347039|5.375072|4.183535|12.625744|17.588581|8.894644|10.974077|9.805948|4.755395|3.846491|3.039707|2.810873|3.113516|4.011005|4.240297|8.491598|4.830091|3.269837|3.405728|3.061930|3.280881|3.169419|38.227838|8.995793|7.479831|4.342191|0.056381|0.051109|0.054394|0.061549|0.064453|0.077778|0.072797|0.110009|0.179975|0.137314|0.097785|0.302816|0.500000| |1.699916|1.870412|2.148667|4.184449|2.757993|2.944277|3.516810|4.029187|3.593201|2.983050|6.647102|7.721567|9.374239|10.819307|25.985330|9.389831|5.849780|4.333605|4.079717|4.866355|7.445467|7.724763|16.780804|7.034405|4.284229|3.920680|3.402347|3.815196|4.164824|27.583502|7.604359|5.804486|3.114653|0.048337|0.043591|0.046083|0.049645|0.052477|0.062658|0.057964|0.073761|0.098248|0.102177|0.075469|0.214237|0.215644|0.500000| |1.689077|1.792148|2.079313|3.825582|2.478801|2.436910|2.757964|3.365625|3.479228|2.890187|5.252428|4.528454|6.928339|14.518195|9.710813|8.934189|17.814019|8.933851|5.641926|4.968639|5.638996|4.093503|6.788439|4.534505|2.714524|2.507149|2.445484|2.892768|3.214178|26.019173|7.196932|6.332815|2.746804|0.048579|0.042928|0.046869|0.047198|0.048934|0.061528|0.058155|0.060152|0.072367|0.112804|0.078331|0.118321|0.108801|0.147373|0.500000| |1.487176|1.542870|1.741736|3.133853|1.953408|1.902304|2.068552|2.383227|2.485927|2.210462|3.523650|2.914368|3.772462|7.237442|5.684435|5.650385|8.976175|17.717843|8.912697|5.669607|4.951717|3.560592|5.617863|4.229621|2.521920|2.267045|2.268112|2.695882|3.137644|17.759122|4.809984|4.414121|2.035395|0.043143|0.038229|0.041230|0.040552|0.042355|0.051759|0.048543|0.048187|0.054870|0.077425|0.061526|0.078417|0.074994|0.099354|0.216561|0.500000| |1.371065|1.421612|1.574844|2.844466|1.743117|1.717575|1.843235|2.046164|2.090108|1.910595|2.974453|2.501683|3.060422|5.440815|4.918940|4.925027|5.631500|8.885691|17.728541|8.924678|5.624228|4.105992|6.095931|5.170305|2.994217|2.558278|2.577736|3.083944|3.916354|14.568852|3.905297|3.535430|1.740963|0.039912|0.035609|0.037561|0.037323|0.039610|0.046861|0.043171|0.044295|0.049605|0.062510|0.052823|0.068076|0.067422|0.092486|0.124045|0.213976|0.500000| |1.407995|1.481899|1.636077|3.009374|1.848146|1.857606|2.002477|2.177791|2.163731|1.982043|3.163839|2.763897|3.294203|5.460519|5.707128|5.637607|4.961811|5.671064|8.946271|17.725049|8.942458|7.095383|9.153439|9.428371|4.790684|3.672025|3.585910|4.344463|6.588584|14.886944|3.969984|3.503641|1.804924|0.040906|0.036674|0.038103|0.038893|0.041866|0.048653|0.044119|0.048280|0.054611|0.062872|0.053731|0.075457|0.077585|0.114873|0.107802|0.124428|0.215359|0.500000| |1.413780|1.514317|1.633847|3.075752|1.854516|1.923548|2.036070|2.078400|1.993875|1.885368|2.925816|2.528617|2.674013|4.257167|4.353669|3.366747|2.794073|2.734144|3.157181|4.066189|4.308584|5.953039|9.381485|12.558304|17.517657|8.850413|6.864727|5.822131|7.114496|13.301503|3.435338|3.065569|1.702597|0.040808|0.037298|0.037543|0.039920|0.043885|0.048103|0.042981|0.051646|0.057054|0.054974|0.050051|0.069176|0.076640|0.097501|0.068264|0.066161|0.081393|0.130263|0.500000| |1.438179|1.559354|1.698917|3.253188|1.996374|2.117242|2.299827|2.346324|2.187340|2.025413|3.387734|3.030070|3.121974|4.775157|5.237430|3.836855|3.040068|2.847235|3.176873|4.117210|4.817162|7.657188|14.728224|12.508404|17.696265|8.793760|5.506764|4.905371|5.676153|15.201831|3.979556|3.416951|1.945156|0.041154|0.037798|0.038321|0.041388|0.044999|0.049567|0.044827|0.056655|0.065621|0.059966|0.052869|0.084750|0.093322|0.125435|0.074618|0.068191|0.079386|0.122977|0.301869|0.500000| |1.550998|1.693147|1.813151|3.487386|2.089095|2.217435|2.316921|2.270463|2.135732|2.054024|3.114097|2.651198|2.642313|4.167988|4.086187|2.906485|2.420733|2.274795|2.463429|2.980795|3.358119|4.464470|7.952577|7.627610|8.862415|17.535032|8.796834|5.498555|4.884509|13.792936|3.470308|3.152337|1.809314|0.044488|0.041051|0.040700|0.044734|0.049881|0.053007|0.046909|0.060771|0.065839|0.057129|0.053646|0.071556|0.084073|0.092889|0.061428|0.056098|0.063028|0.087314|0.214418|0.211148|0.500000| |1.728600|1.912776|2.098086|4.097811|2.521239|2.702768|2.886544|2.854063|2.646577|2.498394|3.921220|3.468011|3.446705|5.262041|5.425362|3.687195|2.931030|2.649060|2.807206|3.450112|4.193213|5.892679|10.673398|9.414424|8.895639|17.529462|8.816056|6.751768|5.695079|16.671914|4.167208|3.759262|2.140311|0.049600|0.045179|0.045388|0.050273|0.056145|0.061720|0.054110|0.072629|0.081622|0.070297|0.064215|0.091279|0.115061|0.126550|0.074163|0.064233|0.069657|0.096599|0.174052|0.214980|0.302520|0.500000| |1.609468|1.722008|1.838106|3.430918|2.023245|2.060827|2.102672|2.108185|2.069807|2.027438|2.834768|2.364522|2.482324|4.070124|3.810693|2.877993|2.472436|2.404956|2.669629|3.207906|3.400145|4.142275|6.516945|7.779736|6.793186|8.855969|17.494624|8.854796|6.729712|12.706665|3.171550|2.988248|1.636601|0.047023|0.042554|0.042087|0.044768|0.050808|0.054917|0.047456|0.055808|0.057795|0.056263|0.054336|0.062358|0.072813|0.081799|0.062018|0.059516|0.069519|0.096523|0.201488|0.139533|0.215821|0.173524|0.500000| |1.846538|2.012411|2.157141|4.088794|2.407843|2.466322|2.479402|2.435979|2.382177|2.367439|3.190412|2.640424|2.707231|4.418392|4.034692|2.909179|2.480913|2.336408|2.493903|2.934415|3.262023|3.932781|6.432505|6.683295|5.506128|8.795816|17.546726|8.816128|5.485732|13.932382|3.406515|3.269407|1.801341|0.053957|0.048597|0.047731|0.051966|0.060251|0.064761|0.054715|0.067124|0.067767|0.063401|0.062731|0.068130|0.083720|0.086573|0.063436|0.058035|0.063883|0.083911|0.139942|0.123137|0.209185|0.214050|0.303345|0.500000| |1.858186|1.971177|2.151607|3.933996|2.335794|2.292990|2.322759|2.402930|2.454133|2.416609|3.172428|2.633513|2.913501|4.925587|4.422737|3.459315|3.016417|2.938410|3.225311|3.800243|4.009962|4.378473|6.431640|7.644068|4.917283|5.497990|8.795291|17.532745|8.872891|14.075339|3.469326|3.377016|1.759427|0.055347|0.048352|0.048595|0.050241|0.057755|0.066257|0.055473|0.060488|0.061761|0.067790|0.066005|0.067151|0.079986|0.089816|0.075060|0.072212|0.082668|0.108923|0.130513|0.108031|0.123157|0.138353|0.215794|0.209657|0.500000| |1.979397|2.153680|2.413849|4.544265|2.790815|2.790372|2.894921|3.018925|3.022985|2.900297|3.992715|3.440643|3.822435|6.208831|5.912785|4.383756|3.564437|3.254390|3.443974|4.179931|4.965058|5.748848|8.426841|9.398243|5.710288|6.753976|8.836217|17.516987|8.889511|16.975679|4.163182|3.993526|2.087864|0.058329|0.050936|0.051849|0.055031|0.062912|0.074145|0.062009|0.072394|0.076770|0.082532|0.077040|0.085489|0.108527|0.121478|0.088577|0.078072|0.084310|0.113047|0.133267|0.127585|0.138476|0.196717|0.173715|0.215289|0.302702|0.500000| |1.670593|1.768782|1.967564|3.614104|2.214237|2.194067|2.320015|2.504805|2.536642|2.371857|3.482135|3.024104|3.605210|6.011460|6.015564|5.420417|4.505668|4.532001|5.480473|7.518592|7.528763|7.230528|8.878271|12.392051|5.655128|4.890570|5.500982|8.851141|17.701027|15.648724|3.995688|3.716469|1.894170|0.049161|0.043223|0.044620|0.045686|0.050559|0.059780|0.052096|0.056760|0.062066|0.072614|0.064467|0.078305|0.088609|0.119009|0.102967|0.103416|0.131366|0.213591|0.144836|0.127370|0.107650|0.127838|0.138846|0.123486|0.212893|0.217336|0.500000| |1.528526|1.614380|1.757113|3.234533|1.945396|1.951595|2.039641|2.136785|2.130099|2.028134|2.958061|2.524402|2.833055|4.686417|4.591647|3.844621|3.290214|3.362729|4.074269|5.328716|5.109374|5.843554|7.873140|12.496518|7.044036|5.721243|6.746660|8.823221|17.526259|13.470188|3.442262|3.184751|1.680656|0.044811|0.040031|0.040628|0.041952|0.046571|0.052812|0.046297|0.051543|0.055475|0.059879|0.054979|0.066917|0.074883|0.095655|0.078318|0.080398|0.105686|0.177567|0.213289|0.144654|0.128336|0.131967|0.196879|0.138499|0.215447|0.173922|0.303147|0.500000| |1.776004|2.011300|2.305369|4.714473|3.183348|3.751284|4.943770|5.139846|3.914808|3.234195|8.974102|5.163521|3.818054|6.284647|4.374193|2.628382|2.465973|2.096931|1.917483|1.990114|2.296413|2.310233|4.520658|2.784149|1.967349|2.002921|1.850683|1.913082|1.887568|57.428854|12.174589|9.722922|17.636073|0.047992|0.045696|0.049461|0.056616|0.054456|0.061816|0.065071|0.095186|0.157870|0.101987|0.077716|0.156072|0.127455|0.090531|0.073777|0.055226|0.048194|0.050910|0.049189|0.057061|0.052746|0.062418|0.046672|0.051335|0.049238|0.058719|0.053054|0.047533|0.500000| |1.761339|1.963190|2.252340|4.472319|2.971639|3.285532|4.023726|4.423027|3.737127|3.122849|7.171894|4.071190|3.365817|5.930546|3.832596|2.395430|2.340767|2.015878|1.818036|1.842952|2.079572|2.034727|3.879740|2.472018|1.727128|1.744596|1.644380|1.720134|1.706831|58.125642|11.749564|12.080190|17.613319|0.047427|0.045221|0.049879|0.055521|0.052218|0.060083|0.065336|0.082784|0.116151|0.101636|0.077284|0.117572|0.098533|0.076642|0.071583|0.054197|0.046093|0.047023|0.043746|0.049550|0.045895|0.053423|0.041877|0.045570|0.044917|0.052439|0.048566|0.043318|0.298271|0.500000| 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