Version2.1 2021-01-14T23:43:52Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 23-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCN(CC)C(=O)COc1cccc(c1)NC(=O)c2cccnc2SCc3cc(on3)C C46709635 RHF 6-31G(d) (6D,7F) CCN(CC)C(=O)COc1cccc(c1)NC(=O)c2cccnc2SCc3cc(on3)C C01[X(C23H26N4O4S1)] 168 C1 536 CCN(C(=O)COc1cccc(c1)NC(=O)c1cccnc1SCc1noc(c1)C)CC CCN(C(=O)COc1cccc(c1)NC(=O)c1cccnc1SCc1noc(c1)C)CC CCN(CC)C(=O)COc1cccc(NC(=O)c2cccnc2SCc3cc(C)on3)c1 InChIKey=LLFHGRGEMZXZLM-UHFFFAOYSA-N InChI=1S/C23H26N4O4S/c1-4-27(5-2)21(28)14-30-19-9-6-8-17(13-19)25-22(29)20-10-7-11-24-23(20)32-15-18-12-16(3)31-26-18/h6-13H,4-5,14-15H2,1-3H3,(H,25,29) InChI=1/C23H26N4O4S/c1-4-27(5-2)21(28)14-30-19-9-6-8-17(13-19)25-22(29)20-10-7-11-24-23(20)32-15-18-12-16(3)31-26-18/h6-13H,4-5,14-15H2,1-3H3,(H,25,29)/f/h25H CCN(CC)C(=O)COc1cccc(c1)NC(=O)c2cccnc2SCc3cc(on3)C C01[X(C23H26N4O4S1)] 168 C01 536 CCN(C(=O)COc1cccc(c1)NC(=O)c1cccnc1SCc1noc(c1)C)CC CCN(C(=O)CO[C]1[CH][CH][CH][C]([CH]1)NC(=O)[C]1[CH][CH][CH][N][C]1SC[C]1=NOC(=[CH]1)C)CC CCN(CC)C(=O)CO[C]1[CH][CH][CH][C]([CH]1)NC(=O)[C]2[CH][CH][CH][N][C]2SCc3cc(C)on3 InChIKey=LLFHGRGEMZXZLM-UHFFFAOYSA-N InChI=1S/C23H26N4O4S/c1-4-27(5-2)21(28)14-30-19-9-6-8-17(13-19)25-22(29)20-10-7-11-24-23(20)32-15-18-12-16(3)31-26-18/h6-13H,4-5,14-15H2,1-3H3,(H,25,29) InChI=1/C23H26N4O4S/c1-4-27(5-2)21(28)14-30-19-9-6-8-17(13-19)25-22(29)20-10-7-11-24-23(20)32-15-18-12-16(3)31-26-18/h6-13H,4-5,14-15H2,1-3H3,(H,25,29)/f/h25H 3086.4494210296 -1800.8256593 1-A 27716.4012 120 416 536 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -91.94755 -20.63893 -20.58968 -20.54116 -20.51807 -15.61011 -15.60664 -15.58488 -15.57837 -11.36865 -11.34483 -11.32583 -11.30671 -11.30220 -11.29907 -11.29096 -11.29075 -11.27901 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37.5186 44.6044 10.8815 50.6564 13.0110 8.1175 8.3468 101.0493 14.0261 19.8804 1.5027 12.1131 4.9299 27.9788 28.5032 20.3168 18.0726 0.5812 7.5539 32.9692 2.2845 2.0492 1.3215 0.7637 2.1841 2.2523 3.0757 0.9207 0.8016 0.5933 1.6157 0.9428 0.7627 1.6179 0.7603 0.5316 1.6933 1.3059 1.1974 1.6455 0.1726 0.2355 0.9778 0.5288 2.8426 2.6579 1.9264 0.3276 1.5359 0.5142 1.1898 1.6614 1.5630 0.5946 1.8843 1.9904 1.6879 1.1481 2.3187 0.8757 0.7646 2.2616 1.1931 0.9423 0.9642 0.2925 5.7371 6.2579 1.4649 3.9808 1.6857 2.1759 12.0692 5.2934 0.7380 1.6319 1.0579 3.7910 4.1553 1.1450 2.2338 9.3501 23.2371 1.2405 12.5101 2.4921 6.8106 2.0702 9.2721 4.1696 1.6531 2.0258 7.1048 5.8892 1.7834 44.3705 0.6610 1.7889 4.6530 7.5048 0.9662 14.1565 0.8301 3.7613 28.6023 7.3603 0.3626 2.5229 39.1253 4.8268 4.2450 2.6054 19.3144 14.6764 4.6630 14.9994 3.1319 7.9223 9.8027 4.0680 4.7361 3.8069 17.7413 8.1786 12.3762 11.9574 7.9363 17.5214 52.6558 3.8624 2.4348 2.8733 4.8246 5.0670 10.9373 13.9075 5.5327 1.4203 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1 1 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 14.00307 12.00000 12.00000 12.00000 15.99491 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 31.97207 12.00000 12.00000 12.00000 12.00000 15.99491 14.00307 12.00000 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 1.00783 11969.0017 40171.6732 48068.2510 0.99997 -0.00730 0.00268 0.00728 0.99993 0.00882 -0.00275 -0.00880 0.99996 1 0.00724 0.00216 0.00180 0.15078 0.04493 0.03755 9.53 15.65 26.79 35.66 46.02 51.57 55.25 77.90 93.65 106.11 110.89 126.98 128.16 147.94 173.49 180.77 198.25 219.72 233.27 246.34 264.99 324.19 329.92 333.34 365.45 374.77 379.45 417.37 424.12 440.25 506.16 528.05 541.30 589.87 600.98 620.07 637.45 676.70 706.65 730.77 738.67 773.15 818.70 838.35 854.37 891.12 938.77 953.69 957.09 981.35 1000.10 1008.48 1030.52 1069.24 1101.75 1148.07 1171.90 1200.87 1203.87 1224.14 1227.92 1233.33 1240.38 1241.87 1298.56 1307.81 1325.76 1376.81 1400.48 1423.19 1438.96 1454.69 1479.65 1503.86 1525.81 1552.74 1565.34 1573.59 1590.81 1593.96 1612.71 1623.89 1646.06 1662.10 1674.12 1682.56 1693.80 1711.40 1716.33 1732.90 1750.81 1756.84 1765.76 1793.02 1805.84 1817.06 1837.24 1852.76 1856.41 1905.61 1925.10 1978.99 1986.39 2021.06 2022.89 2033.10 2049.47 2052.07 2090.23 2095.44 2110.09 2189.88 2215.83 2228.78 2247.29 2256.35 2256.70 2262.24 2264.26 2320.56 2326.16 2327.29 2329.27 2340.01 2350.78 2351.11 2353.47 2357.56 2367.19 2376.51 2381.86 2386.78 2410.45 2481.86 2483.85 2538.79 2577.24 2579.78 2616.69 2640.65 2817.86 2837.41 4607.39 4608.99 4616.78 4634.79 4652.96 4668.85 4685.10 4687.44 4708.23 4711.71 4723.98 4727.91 4742.87 4744.91 4764.15 4782.46 4817.21 4820.71 4852.93 4855.38 4861.69 4901.30 4905.02 4983.89 4991.70 5588.76 0.501495 0.531388 0.532332 0.432906 -1800.324164 -1800.294272 -1800.293327 -1800.392754 3.334798D-04 MUNgauss RevisionA2.0 retrievium 14-Jan-2021 DUDE CCN(CC)C(=O)COc1cccc(c1)NC(=O)c2cccnc2SCc3cc(on3)C C46709635 RHF 6-31G(d) (6D,10F) C1 454.167477 |X|Y|Z| 74.544684 36.107070 144.415179 72.980571 21 6 7 8 16 16 3 1 1 |36.858105| |12.466954|36.858105| |7.627888|13.092729|53.358707| |5.794478|7.650252|17.752886|36.858105| |4.243722|5.662390|10.414852|12.487400|36.858105| |5.573863|7.623386|19.075072|7.900976|5.931610|36.858105| |4.276350|5.304546|11.568514|7.080933|5.807986|15.923417|73.516695| |5.226520|6.604852|10.553228|5.008341|4.185204|12.457930|14.234964|36.858105| |3.903056|4.492258|7.199199|3.994032|3.488008|8.060199|12.995572|13.739688|73.516695| |3.338857|3.678509|5.413791|3.149457|2.834965|5.224676|8.580932|8.054718|25.127748|36.858105| |3.354339|3.641376|4.965725|2.879882|2.615806|4.405490|6.895641|6.754315|14.007064|13.759565|36.858105| |2.751620|2.903951|3.922787|2.379843|2.201419|3.341594|5.443636|4.527587|9.271575|7.988802|13.702034|36.858105| |2.388605|2.503883|3.476091|2.169930|2.022910|2.980146|5.059742|3.805720|8.238704|6.886059|7.903729|13.866739|36.858105| |2.385377|2.518546|3.624921|2.281880|2.122171|3.204765|5.635856|4.004289|9.457536|7.948470|6.832223|7.949948|13.614656|36.858105| |2.740524|2.948573|4.390838|2.707213|2.482664|4.098943|7.296498|5.294912|14.687275|13.658450|7.871933|6.882046|7.911696|13.798583|36.858105| |2.051313|2.146210|3.101243|2.011236|1.891617|2.684861|4.842260|3.158037|7.112092|5.130514|4.542298|5.215504|7.982381|13.532023|7.756249|53.358707| |1.940931|2.023519|2.973637|1.967197|1.852754|2.573422|4.774045|2.902044|6.507979|4.308452|3.666721|3.906632|5.160154|7.623977|6.278117|19.003013|36.858105| |2.047721|2.137859|3.207239|2.133258|1.994441|2.818943|5.361443|3.111195|7.138603|4.483892|3.612327|3.620433|4.452596|6.514323|6.559872|11.436370|15.941540|73.516695| |1.684261|1.745558|2.539215|1.708378|1.626785|2.143681|3.968815|2.364584|5.057305|3.239670|2.907285|3.149145|4.014373|5.046671|4.231102|10.788040|12.671090|14.346276|36.858105| |1.574037|1.642829|2.369972|1.598274|1.541566|1.981411|3.643751|2.186194|4.584597|2.939509|2.719460|2.999126|3.794988|4.458697|3.690799|8.886358|7.601448|9.727781|13.780758|36.858105| |1.413579|1.467597|2.106183|1.436104|1.391966|1.735144|3.188089|1.886509|3.863124|2.422329|2.278963|2.493970|3.029072|3.384458|2.911655|6.086664|5.037697|7.253105|7.934411|13.743582|36.858105| |1.359044|1.398449|2.009495|1.380062|1.331256|1.646672|3.035611|1.770694|3.603540|2.225152|2.084260|2.249533|2.680918|2.997511|2.647701|5.240446|4.518689|6.868143|7.022015|8.078700|13.842935|36.858105| |1.422667|1.454937|2.101363|1.443710|1.380517|1.728814|3.201391|1.853292|3.800132|2.334683|2.155711|2.301276|2.741909|3.137758|2.808855|5.514920|5.069770|7.929155|8.002284|6.943345|8.009668|14.388736|53.358707| |1.576808|1.615081|2.348040|1.599674|1.518258|1.957848|3.637678|2.117666|4.437736|2.756787|2.492468|2.653277|3.232127|3.876488|3.441065|7.196286|7.483337|11.297561|13.532494|7.985526|6.972328|8.353117|19.717655|36.858105| |1.657062|1.674406|2.450175|1.677446|1.568735|2.042244|3.816879|2.180334|4.563562|2.765632|2.461331|2.546204|3.001171|3.609253|3.397578|6.100762|6.109160|11.283320|6.872696|4.719122|4.226158|4.884610|9.773428|10.725864|388.023441| |1.453574|1.456538|2.108650|1.461336|1.373959|1.720881|3.193491|1.814937|3.680148|2.201297|2.018189|2.096359|2.406194|2.735082|2.577768|4.418760|3.956422|7.036624|4.633869|3.723355|3.714065|4.656624|9.254291|6.883319|74.365413|36.858105| |1.454885|1.442802|2.089640|1.458666|1.361919|1.692224|3.141700|1.763768|3.534316|2.077385|1.905333|1.949122|2.184638|2.456008|2.377661|3.794798|3.286636|6.078565|3.549558|2.934483|2.883825|3.409430|6.039843|4.629929|50.069063|12.713499|36.858105| |1.473528|1.460519|2.134368|1.505661|1.403606|1.725938|3.238167|1.768288|3.528794|2.030243|1.841703|1.848637|2.039109|2.305584|2.299012|3.477284|3.010835|5.799958|3.125936|2.613124|2.539144|2.913242|4.952137|3.864709|40.337950|7.214634|13.316024|36.858105| |1.436195|1.408744|2.044646|1.448104|1.344292|1.634627|3.043532|1.668368|3.279851|1.877553|1.723251|1.726039|1.877145|2.082820|2.082927|3.073572|2.574074|4.900438|2.629486|2.250726|2.194130|2.475912|4.057944|3.125537|30.274237|5.228718|8.768129|14.190853|36.858105| |1.401207|1.368347|1.965688|1.382890|1.283218|1.565511|2.882563|1.616054|3.164903|1.835122|1.707699|1.731768|1.888895|2.066262|2.030329|3.058285|2.517857|4.666177|2.602387|2.243945|2.204689|2.501113|4.085926|3.101011|29.273409|5.360648|8.994984|8.735703|14.373629|73.516695| |1.412086|1.387796|1.990713|1.388883|1.293044|1.596773|2.934302|1.668701|3.301752|1.944892|1.812205|1.863114|2.068140|2.272097|2.187365|3.447489|2.871773|5.211954|3.058911|2.601578|2.573203|2.992009|5.055617|3.800277|36.829448|7.896083|14.851440|8.505238|8.654941|24.823721|53.358707| |1.407848|1.373496|1.994966|1.428508|1.324263|1.579188|2.944395|1.589631|3.083097|1.738601|1.599317|1.584483|1.695537|1.865470|1.893522|2.695405|2.218292|4.250127|2.225089|1.940925|1.888917|2.089188|3.318621|2.550696|23.356118|3.729341|5.209821|7.319759|12.786348|14.108620|7.223601|36.858105| |17.562320|8.772346|9.283064|5.061658|3.744379|5.748364|7.852694|5.801744|7.795526|3.758864|3.758475|3.041707|2.628643|2.631494|3.048408|3.047196|2.111165|3.972437|1.813346|1.678453|1.498834|1.443552|2.069268|1.697260|12.793822|1.566451|1.570804|1.587458|1.547433|2.688817|2.077098|1.510973|0.500000| |17.543335|8.817509|7.573033|4.531184|3.626668|4.379325|6.217548|4.367804|6.017760|3.026084|3.152674|2.649443|2.283202|2.235380|2.507810|2.628892|1.814779|3.362108|1.590107|1.497020|1.351250|1.298056|1.840984|1.489958|11.060624|1.376226|1.375512|1.385363|1.354924|2.365134|1.827371|1.327457|0.300905|0.500000| |17.568054|8.782448|9.375132|6.207649|4.368726|4.981685|7.234191|4.349809|6.108596|2.936462|2.883807|2.420037|2.151030|2.175024|2.488298|2.590944|1.827178|3.449643|1.598127|1.490794|1.346938|1.303013|1.861490|1.510135|11.370171|1.412713|1.424624|1.454306|1.424391|2.459922|1.883680|1.408652|0.302082|0.301404|0.500000| |8.862464|17.571956|12.586104|7.405234|6.200663|5.825882|7.981529|5.005320|6.558888|3.116552|3.111402|2.562878|2.236480|2.240564|2.574325|2.640915|1.838015|3.435068|1.606564|1.524874|1.372797|1.308572|1.843905|1.491745|10.935840|1.350733|1.338102|1.356172|1.310659|2.263215|1.754216|1.282748|0.173048|0.213946|0.210746|0.500000| |8.851104|17.616004|12.402873|5.675451|4.740089|7.160456|8.832271|7.658482|8.759118|4.139099|4.282640|3.324773|2.778494|2.740389|3.198741|3.120549|2.122838|3.941269|1.821949|1.724209|1.532090|1.448766|2.041764|1.668162|12.161608|1.480775|1.454767|1.460192|1.402751|2.434149|1.904232|1.357019|0.210008|0.213502|0.173099|0.306814|0.500000| |4.921327|5.756408|12.512544|17.653547|8.865472|7.505869|14.094061|4.730371|7.148411|3.140497|2.794040|2.326366|2.158877|2.311052|2.764786|2.798646|2.041328|3.992910|1.768523|1.639840|1.472790|1.423215|2.040103|1.666442|12.571597|1.535098|1.540833|1.604830|1.541995|2.597847|1.988490|1.527440|0.128538|0.108325|0.149357|0.147757|0.127837|0.500000| |6.467808|7.528735|12.557432|17.576193|8.842067|5.855583|9.206872|4.237274|6.084875|2.804312|2.631188|2.209662|2.011079|2.088090|2.428933|2.521255|1.809110|3.461489|1.586129|1.486592|1.344615|1.297602|1.847455|1.495698|11.187539|1.385307|1.390585|1.434959|1.391370|2.370846|1.814879|1.380276|0.146867|0.140775|0.216802|0.219643|0.148441|0.303245|0.500000| |4.296190|5.972040|9.393983|8.773098|17.537303|5.230152|8.525789|4.009153|5.829727|2.733073|2.593252|2.191205|1.990696|2.054272|2.370858|2.483928|1.768168|3.341842|1.560021|1.490038|1.348414|1.284837|1.803439|1.451326|10.575048|1.308327|1.292476|1.323287|1.269481|2.167255|1.676858|1.247504|0.102172|0.105610|0.119612|0.202883|0.142006|0.173068|0.209990|0.500000| |3.738014|4.950292|9.364282|8.836495|17.592769|6.299212|11.982256|4.406891|6.733679|3.035908|2.742089|2.299959|2.130258|2.262787|2.677165|2.745688|1.982594|3.813304|1.732213|1.643493|1.477066|1.406231|1.981632|1.606079|11.729800|1.433493|1.412112|1.455183|1.383049|2.339883|1.813011|1.355568|0.095413|0.089580|0.103609|0.141713|0.123091|0.213173|0.173450|0.300482|0.500000| |3.652751|4.468060|7.582489|8.829533|17.541360|4.586563|8.346604|3.423069|5.279665|2.472517|2.288106|1.964030|1.827025|1.919438|2.216162|2.363475|1.716648|3.287358|1.523457|1.445108|1.314732|1.264117|1.785051|1.434035|10.571993|1.313851|1.308610|1.355841|1.303174|2.205385|1.692887|1.292473|0.090430|0.088679|0.108184|0.136425|0.105514|0.212517|0.213310|0.301260|0.301038|0.500000| |4.803227|6.476117|9.283981|4.596800|4.138726|8.901351|11.259562|17.526080|16.573055|7.121561|6.860353|4.631668|3.773525|3.818474|4.797869|4.111620|2.731313|5.083379|2.260267|2.132752|1.847096|1.717651|2.416547|2.009232|14.410875|1.703436|1.643357|1.637883|1.545125|2.672629|2.120793|1.470669|0.138785|0.117499|0.110123|0.144091|0.236107|0.115615|0.109511|0.115517|0.122086|0.093243|0.500000| |6.283757|7.051750|9.641913|4.650292|3.751915|8.804958|10.785250|17.568705|16.616245|7.120423|6.794694|4.607095|3.768883|3.825939|4.816512|4.118048|2.761406|5.205379|2.270527|2.091377|1.816343|1.716826|2.454915|2.055192|15.205698|1.795745|1.758548|1.756769|1.673209|2.901826|2.287357|1.597562|0.214685|0.144660|0.137082|0.141513|0.230256|0.121565|0.115945|0.101322|0.104844|0.087295|0.301213|0.500000| |3.856436|4.240613|5.477988|3.083273|2.782659|4.673271|6.932778|7.437382|12.443963|8.848578|17.771491|8.926814|5.648510|4.935187|5.601899|4.924730|3.044907|5.392927|2.498866|2.362051|2.023088|1.865783|2.618023|2.188746|15.496249|1.825627|1.742822|1.696105|1.602617|2.823996|2.272935|1.502991|0.119324|0.102094|0.089155|0.099278|0.146423|0.081030|0.078914|0.077982|0.079784|0.066902|0.229004|0.224120|0.500000| |2.643377|2.758360|3.621039|2.216073|2.062969|2.979158|4.812365|3.912978|7.461017|5.672540|8.933394|17.715089|8.984454|5.652102|4.956518|5.754567|3.288439|5.403036|2.777307|2.699919|2.301870|2.083916|2.874286|2.385406|16.235907|1.928891|1.801731|1.704766|1.605808|2.883891|2.369099|1.480888|0.080285|0.072330|0.064443|0.068540|0.088239|0.059603|0.057920|0.057724|0.059254|0.051374|0.114079|0.113310|0.216512|0.500000| |2.132891|2.213461|3.045656|1.934804|1.818432|2.552192|4.360885|3.142368|6.529762|4.957664|5.630613|8.947413|17.702987|8.851745|5.631603|10.012782|4.839562|7.128109|4.060680|3.985130|3.216445|2.814211|3.850718|3.273833|20.983133|2.417294|2.169921|1.995303|1.840186|3.328721|2.817611|1.653126|0.064626|0.057277|0.053824|0.055673|0.067666|0.053463|0.050273|0.049907|0.052941|0.046049|0.087300|0.087214|0.124347|0.216534|0.500000| |2.639718|2.843111|4.372859|2.763486|2.538420|4.139690|7.825070|4.925170|13.645172|8.963826|5.646406|4.966273|5.621412|8.877523|17.833179|9.481613|6.791150|14.810728|4.445817|3.749703|2.962009|2.731403|4.010003|3.666237|26.415493|2.743012|2.535457|2.491430|2.227042|3.795865|3.118704|2.022944|0.081028|0.066352|0.067824|0.069382|0.083467|0.080175|0.068247|0.066194|0.076872|0.063399|0.120826|0.121694|0.123976|0.107747|0.123532|0.500000| |1.909351|1.985323|2.826138|1.842843|1.742516|2.398699|4.281848|2.805329|6.063923|4.299371|4.086429|4.958020|7.705642|9.361892|5.769828|26.085511|9.486975|10.915886|7.735062|7.193631|4.922514|4.107465|5.680218|5.217266|29.806237|3.188607|2.704599|2.433332|2.167151|3.891570|3.391849|1.895307|0.057591|0.050479|0.049251|0.050244|0.059034|0.052007|0.047549|0.047042|0.051299|0.044626|0.075729|0.075680|0.092698|0.117212|0.236425|0.142807|0.500000| |1.623442|1.710498|2.461420|1.648749|1.599226|2.064944|3.777213|2.304249|4.843217|3.154714|2.945532|3.293259|4.226950|4.904650|3.959377|9.591421|7.048370|9.118952|8.939420|17.714501|8.913054|5.701575|6.789596|5.655602|27.640399|3.112124|2.556102|2.322067|2.033042|3.596741|3.133787|1.782388|0.047935|0.042955|0.042461|0.044130|0.050275|0.046678|0.042453|0.043138|0.047546|0.041431|0.063246|0.060755|0.070570|0.082059|0.123989|0.108907|0.220913|0.500000| |1.344732|1.400263|1.999665|1.366591|1.333739|1.636336|2.994920|1.775819|3.592164|2.243766|2.141054|2.348984|2.806483|3.043415|2.637829|5.228648|4.091607|6.069432|5.631866|8.851256|17.750451|8.906845|7.755916|5.006968|24.279653|3.108603|2.500893|2.233758|1.962194|3.511329|3.091365|1.713636|0.039387|0.035859|0.035583|0.036578|0.040684|0.038744|0.035607|0.036056|0.039297|0.035039|0.048766|0.047457|0.053284|0.061035|0.083498|0.073730|0.118239|0.212843|0.500000| |1.262652|1.296143|1.855758|1.282030|1.240780|1.507639|2.774620|1.609850|3.233877|1.977541|1.869265|2.009118|2.348085|2.570562|2.303746|4.318964|3.601276|5.665819|5.030052|5.689936|8.913719|17.714540|12.738092|5.903341|28.914356|4.227425|3.190412|2.738657|2.360707|4.266148|3.881626|2.006210|0.037108|0.033611|0.033736|0.033851|0.037205|0.036681|0.033619|0.033328|0.036300|0.032866|0.043519|0.043483|0.046996|0.052302|0.068582|0.065778|0.093810|0.124406|0.213123|0.500000| |1.376306|1.387426|2.013224|1.404042|1.330938|1.639321|3.057573|1.715946|3.465048|2.057728|1.886487|1.952904|2.229864|2.528703|2.398073|4.080499|3.657628|6.515084|4.410826|3.693233|3.837023|5.015418|9.960206|6.520155|56.391585|17.647484|8.944704|6.447286|4.686789|8.174420|8.304276|3.490258|0.040924|0.036217|0.037236|0.035922|0.039141|0.040963|0.036929|0.035209|0.038684|0.035469|0.045004|0.046833|0.047605|0.050068|0.062265|0.071226|0.081960|0.085319|0.089671|0.130624|0.500000| |1.413940|1.412933|2.026893|1.398785|1.316067|1.645950|3.024297|1.751131|3.528344|2.135304|1.990623|2.099510|2.421102|2.694097|2.483620|4.367814|3.765532|6.412169|4.501265|3.738490|3.818083|4.856565|9.364906|6.473992|56.010772|17.661665|8.989009|5.469358|4.474088|8.831039|10.348739|3.314423|0.042326|0.037403|0.038047|0.036437|0.040074|0.040555|0.036962|0.034998|0.038027|0.034908|0.045922|0.048409|0.050067|0.054134|0.068773|0.071867|0.090130|0.086672|0.089194|0.124577|0.301820|0.500000| 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