Version2.1 2021-01-17T16:26:37Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 22-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1ccc2c(c1)c(=O)cc(o2)C(=O)Nc3c(c4c(s3)CCCC4)C(=O)NCCCOC C08869206 RHF 6-31G(d) (6D,7F) Cc1ccc2c(c1)c(=O)cc(o2)C(=O)Nc3c(c4c(s3)CCCC4)C(=O)NCCCOC C01[X(C24H26N2O5S1)] 168 C1 536 COCCCNC(=O)c1c(NC(=O)c2cc(=O)c3c(o2)ccc(c3)C)sc2c1CCCC2 COCCCNC(=O)c1c(NC(=O)c2cc(=O)c3c(o2)ccc(c3)C)sc2c1CCCC2 COCCCNC(=O)c1c(NC(=O)C2=CC(=O)c3cc(C)ccc3O2)sc4CCCCc14 InChIKey=AVRLBUHNQFOEJE-UHFFFAOYSA-N InChI=1S/C24H26N2O5S/c1-14-8-9-18-16(12-14)17(27)13-19(31-18)22(28)26-24-21(23(29)25-10-5-11-30-2)15-6-3-4-7-20(15)32-24/h8-9,12-13H,3-7,10-11H2,1-2H3,(H,25,29)(H,26,28) InChI=1/C24H26N2O5S/c1-14-8-9-18-16(12-14)17(27)13-19(31-18)22(28)26-24-21(23(29)25-10-5-11-30-2)15-6-3-4-7-20(15)32-24/h8-9,12-13H,3-7,10-11H2,1-2H3,(H,25,29)(H,26,28)/f/h25-26H Cc1ccc2c(c1)c(=O)cc(o2)C(=O)Nc3c(c4c(s3)CCCC4)C(=O)NCCCOC C01[X(C24H26N2O5S1)] 168 C01 536 COCCCNC(=O)c1c(NC(=O)c2cc(=O)c3c(o2)ccc(c3)C)sc2c1CCCC2 COCCCNC(=O)[C]1[C](SC2=[C]1CCCC2)NC(=O)C1=CC(=O)[C]2[C]([CH][CH][C]([CH]2)C)O1 COCCCNC(=O)[C]1[C](NC(=O)C2=CC(=O)[C]3[CH][C](C)[CH][CH][C]3O2)SC4=C1CCCC4 InChIKey=AVRLBUHNQFOEJE-UHFFFAOYSA-N InChI=1S/C24H26N2O5S/c1-14-8-9-18-16(12-14)17(27)13-19(31-18)22(28)26-24-21(23(29)25-10-5-11-30-2)15-6-3-4-7-20(15)32-24/h8-9,12-13H,3-7,10-11H2,1-2H3,(H,25,29)(H,26,28) InChI=1/C24H26N2O5S/c1-14-8-9-18-16(12-14)17(27)13-19(31-18)22(28)26-24-21(23(29)25-10-5-11-30-2)15-6-3-4-7-20(15)32-24/h8-9,12-13H,3-7,10-11H2,1-2H3,(H,25,29)(H,26,28)/f/h25-26H 3243.6061281353 -1804.7378533 1-A 22537.0433 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| -91.97394 -20.65167 -20.56789 -20.55374 -20.54151 -20.53311 -15.61454 -15.59229 -11.38038 -11.36306 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1569.9056 1595.0818 1596.2220 1607.8694 1630.4384 1631.2242 1638.0883 1638.1951 1641.7987 1645.4579 1645.6088 1647.0919 1655.9131 1657.3640 1664.6251 1671.0371 1686.7633 1709.2828 1750.2468 1780.1924 1781.3463 1828.5534 1867.0579 1880.2973 1965.2309 1970.6984 3158.1007 3159.8669 3180.4737 3186.3242 3193.9037 3200.9168 3203.7416 3203.9275 3208.7782 3209.7348 3225.4810 3232.8855 3245.7248 3250.1081 3255.1619 3255.6232 3256.4168 3288.0595 3290.5792 3307.7995 3361.7648 3398.2371 3399.5894 3444.4998 3763.7608 3923.9646 5.7277 4.9584 5.9878 4.5233 3.5865 2.2425 4.7208 5.8264 1.2333 3.0671 3.5966 2.8566 5.7269 2.2001 3.4031 3.7277 5.3045 4.4881 5.0361 4.9793 3.7627 4.9035 5.0805 1.3249 4.6496 5.9311 3.5307 8.8264 2.0838 4.4413 4.3650 4.7518 4.1962 4.7411 10.5620 5.2593 2.0711 3.7792 2.4889 2.4269 3.3460 7.7315 5.4491 3.7428 6.4354 6.9149 3.4672 3.8549 5.6036 5.5632 5.4399 6.1634 3.8753 5.7408 5.1321 1.3077 1.3816 3.0659 3.2414 4.9778 6.6395 3.8996 2.9289 1.4461 5.1601 1.4085 1.4545 2.8811 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25.3286 32.9639 42.7714 55.7476 18.4452 83.6679 39.2230 82.9836 57.5122 28.9600 6.0366 75.9348 19.7771 39.8923 50.5853 15.8391 2.7833 1.9538 4.4833 210.1407 44.5113 5.4362 0.4331 1.1989 0.2608 0.1278 0.1271 2.0026 1.0600 0.5772 0.3500 1.3255 0.0359 0.8058 0.0415 0.0912 0.4082 0.7264 1.1020 1.5015 0.2507 0.2489 0.7197 0.6279 0.0795 0.2887 2.0494 0.6233 1.3961 0.4292 1.5947 1.4712 1.6700 1.6238 3.1138 0.9822 3.5246 0.9429 0.2245 5.3372 0.8445 1.5355 5.4834 3.0467 2.0214 6.4212 6.7477 0.7407 7.5206 3.2544 4.1086 5.9431 2.9170 2.8810 11.4833 8.6563 0.5870 1.0973 4.2201 3.6606 2.9957 1.1088 2.7933 6.6848 0.9566 2.2097 1.4823 0.7131 1.7926 19.6649 4.8342 2.0953 9.3949 3.4176 3.8800 8.0829 0.8748 4.9660 0.2706 4.9961 5.7931 4.7160 10.3425 1.8334 0.2692 2.8245 0.7570 16.8931 9.4476 15.8222 3.8607 2.0528 12.2293 1.6529 6.1277 5.0568 5.0962 6.3253 3.9936 7.3885 9.6101 8.6324 22.5138 42.7609 26.9527 16.3883 17.1820 17.8003 7.4975 24.6453 60.7934 1.0994 11.7369 37.4888 2.8745 18.0381 43.5065 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6 6 6 6 8 7 6 6 6 8 6 1 1 1 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 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 15.99491 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 12.00000 31.97207 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 15.99491 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 13580.7576 27061.2337 40161.4742 0.99998 -0.00616 -0.00131 0.00615 0.99998 -0.00221 0.00132 0.00220 1.00000 1 0.00638 0.00320 0.00216 0.13289 0.06669 0.04494 18.06 27.07 37.11 37.96 66.88 70.98 83.58 88.98 104.27 111.41 142.24 167.58 181.55 189.32 195.75 202.31 224.61 258.80 262.99 269.45 273.53 315.47 320.27 349.45 351.67 385.30 415.99 463.27 488.86 519.98 534.74 547.83 564.12 567.83 583.69 615.21 647.81 690.89 719.11 727.59 765.90 794.36 815.87 827.20 835.01 838.19 866.19 880.51 891.45 932.27 1000.00 1029.40 1094.93 1114.63 1172.96 1189.32 1196.09 1207.30 1223.97 1230.80 1245.15 1274.54 1320.25 1327.58 1338.19 1352.37 1390.08 1407.04 1421.30 1454.99 1455.15 1495.88 1500.14 1531.98 1553.47 1558.25 1590.57 1597.19 1627.00 1633.86 1673.41 1684.37 1696.70 1697.39 1730.98 1746.51 1753.78 1775.72 1798.23 1821.85 1830.33 1858.33 1867.84 1870.75 1888.72 1901.45 1935.89 1950.33 1959.33 1974.90 1994.37 2003.90 2010.20 2033.70 2048.48 2059.09 2060.48 2070.35 2079.68 2125.41 2166.53 2185.89 2196.57 2205.41 2217.83 2241.28 2258.74 2294.97 2296.61 2313.37 2345.84 2346.97 2356.84 2357.00 2362.18 2367.45 2367.66 2369.80 2382.49 2384.58 2395.02 2404.25 2426.88 2459.28 2518.21 2561.30 2562.96 2630.88 2686.28 2705.33 2827.53 2835.40 4543.80 4546.34 4575.99 4584.41 4595.32 4605.41 4609.47 4609.74 4616.72 4618.09 4640.75 4651.40 4669.87 4676.18 4683.45 4684.12 4685.26 4730.78 4734.41 4759.19 4836.83 4889.31 4891.25 4955.87 5415.21 5645.71 0.505413 0.534353 0.535297 0.441190 -1804.232440 -1804.203500 -1804.202556 -1804.296663 3.156364D-04 MUNgauss RevisionA2.0 retrievium 17-Jan-2021 DUDE Cc1ccc2c(c1)c(=O)cc(o2)C(=O)Nc3c(c4c(s3)CCCC4)C(=O)NCCCOC C08869206 RHF 6-31G(d) (6D,10F) C1 454.156244 |X|Y|Z| 86.656815 121.351305 17.362419 56.730830 21 6 7 8 16 18 1 1 1 |36.858105| |12.609738|36.858105| |7.535503|13.556099|36.858105| |5.009880|7.843681|13.882617|36.858105| |4.438052|6.847853|8.017076|13.692170|36.858105| |4.992508|7.872238|6.891762|7.887508|13.801526|36.858105| |7.552513|13.860339|7.995465|6.860165|7.959464|13.604874|36.858105| |3.785432|5.043614|4.489669|5.061611|7.698920|12.880061|7.586535|36.858105| |3.628650|4.487027|3.801128|3.993664|5.322634|8.070329|6.630162|15.893125|73.516695| |3.036300|3.896406|3.803485|4.588872|6.894905|7.708346|5.036100|12.950435|14.421546|36.858105| |2.951211|3.835153|4.046765|5.322158|8.166998|6.929469|4.592669|7.839919|9.604808|14.359283|36.858105| |3.373232|4.604466|5.301020|8.135059|14.047544|7.966347|5.216948|6.722587|8.398916|8.075976|14.207637|73.516695| |2.412407|2.979393|3.190241|4.041492|5.209930|4.483911|3.375171|4.964854|7.016267|7.680006|12.658705|14.223081|36.858105| |2.166082|2.603954|2.710249|3.271376|4.081395|3.788904|2.966259|4.434518|6.662547|6.739020|8.092354|9.724735|15.923994|73.516695| |2.316290|2.835575|3.164107|4.083572|4.826980|3.898266|3.063450|3.945674|5.718301|5.241129|7.931008|13.046324|14.088419|14.985270|53.358707| |1.994188|2.365418|2.618328|3.225817|3.594874|3.038937|2.507874|3.091119|4.690321|3.894688|5.101281|8.553313|7.822996|11.885962|18.762303|36.858105| |1.884814|2.203008|2.476381|3.007849|3.173369|2.670403|2.273128|2.631833|4.054993|3.138228|3.946848|7.133915|5.157212|8.041934|10.640439|13.947132|36.858105| |1.648413|1.887866|2.082479|2.446194|2.567590|2.240397|1.947514|2.243769|3.543347|2.635301|3.143390|5.522090|3.998790|6.783973|7.067111|8.148255|13.051365|36.858105| |1.584718|1.810277|1.960204|2.282431|2.452284|2.189770|1.896233|2.252665|3.590759|2.688837|3.139822|5.271445|4.121436|7.490480|6.764361|7.702682|8.181508|14.186347|36.858105| |1.749555|2.031351|2.177991|2.575724|2.887651|2.589611|2.179354|2.747152|4.320095|3.456356|4.112567|6.457721|6.081273|11.980364|9.475944|11.011754|7.385286|7.403311|10.965744|388.023441| |1.412457|1.589509|1.699682|1.936611|2.066535|1.887251|1.662494|1.954393|3.177297|2.286506|2.571029|4.304532|3.214793|6.025825|4.914199|4.826225|5.026843|7.481749|12.647959|48.021664|36.858105| |1.325440|1.477882|1.587829|1.791922|1.873553|1.707847|1.525940|1.740967|2.842948|1.991231|2.228552|3.830563|2.680509|4.874518|4.136086|3.896788|4.408195|6.625696|7.642237|32.808154|12.445064|36.858105| |1.366571|1.524614|1.657638|1.876477|1.931221|1.737215|1.557238|1.741357|2.825262|1.974100|2.237131|3.940152|2.654010|4.671540|4.220747|3.970396|4.874640|7.560236|6.803242|29.990785|7.578480|12.468982|36.858105| |1.510007|1.702292|1.878572|2.161244|2.210554|1.947303|1.730778|1.927324|3.083999|2.196668|2.552933|4.581281|3.057579|5.205216|5.123815|5.019044|7.157263|12.566546|7.660958|33.645723|6.313125|7.542941|12.436114|36.858105| |2.026294|2.377057|2.759358|3.397884|3.405269|2.772212|2.388680|2.618190|4.006906|3.008922|3.800942|7.477534|4.476286|6.678739|8.912513|7.701159|12.804894|7.184123|5.062152|33.865359|3.689492|3.496895|4.009625|5.786476|36.858105| |2.314626|2.775883|3.329411|4.289544|4.189947|3.242899|2.760489|2.958451|4.436029|3.362755|4.384711|9.364269|4.848209|6.852578|9.664067|6.703102|8.056142|5.126703|4.070354|29.803633|3.101989|2.899388|3.239719|4.269653|15.676672|73.516695| |1.858950|2.133020|2.463704|2.923367|2.849788|2.381537|2.111423|2.242848|3.500559|2.506865|3.031554|5.919820|3.432391|5.352849|6.151352|5.222000|7.839277|6.250216|4.390324|27.225492|3.433266|3.488932|4.151545|6.206435|14.132936|15.220866|53.358707| |1.915376|2.175779|2.554017|2.977237|2.779468|2.320030|2.102595|2.134424|3.348274|2.314632|2.749302|5.527826|2.948091|4.593228|5.013613|3.901988|5.030069|4.235508|3.290433|21.367965|2.725591|2.796142|3.255605|4.354870|7.806915|12.434224|17.862312|36.858105| |1.683751|1.870983|2.150432|2.423542|2.276716|1.959053|1.806718|1.824398|2.912253|1.958916|2.262087|4.428007|2.420175|3.887309|3.952999|3.130449|3.926319|3.668346|2.923439|18.393894|2.539557|2.716748|3.205403|4.118829|5.129489|8.062664|10.627485|12.495645|36.858105| |1.677126|1.835747|2.113493|2.324073|2.137391|1.856154|1.744935|1.710020|2.749837|1.799282|2.045027|4.035318|2.127082|3.426357|3.373334|2.578976|3.060067|2.850448|2.379061|15.451137|2.112199|2.236521|2.566353|3.104935|3.847464|6.549584|6.827284|7.537705|12.537704|36.858105| |1.497422|1.619576|1.832291|1.986326|1.850350|1.635739|1.547641|1.524279|2.476576|1.600721|1.794039|3.477049|1.872683|3.066571|2.920302|2.255665|2.643436|2.560179|2.176519|13.967283|1.984325|2.141767|2.451727|2.863744|3.143050|5.268720|5.400775|5.110924|8.067864|13.668063|73.516695| |1.453640|1.552056|1.747296|1.860506|1.720522|1.535899|1.471870|1.426323|2.332801|1.479929|1.639884|3.179664|1.687208|2.772607|2.586291|1.965224|2.242954|2.164278|1.882557|12.302836|1.733414|1.852368|2.082204|2.369627|2.619727|4.514057|4.273529|3.916901|5.219354|8.137963|24.313598|36.858105| |17.543000|8.837366|6.704512|4.596773|3.979604|4.284351|5.883368|3.345199|5.694151|2.766701|2.725314|5.540628|2.269445|3.630589|3.001056|1.916629|1.829540|1.604738|1.535990|11.950217|1.371851|1.295784|1.336369|1.479508|1.981709|4.004249|2.504189|1.917222|1.694343|1.704481|2.706528|1.486934|0.500000| |17.588129|8.848517|5.557474|4.159539|3.966621|4.728133|7.240848|3.804805|6.812538|2.987588|2.813854|5.511720|2.306827|3.740951|2.966704|1.886012|1.769905|1.561698|1.515798|11.956025|1.360052|1.272638|1.303331|1.429232|1.874290|3.756487|2.341504|1.755231|1.555026|1.542513|2.468418|1.347990|0.301838|0.500000| |17.543311|8.837756|6.704337|4.596898|3.979953|4.284988|5.884383|3.345897|5.694925|2.767494|2.725896|5.540945|2.269944|3.632484|3.000431|1.916834|1.826698|1.604935|1.538608|11.978093|1.375775|1.295553|1.343398|1.480055|1.970151|3.999146|2.471230|1.879076|1.660146|1.661766|2.643099|1.448588|0.302145|0.301840|0.500000| |7.019077|8.874605|17.700202|9.012756|5.685778|4.960392|5.675170|3.581303|5.577560|3.149036|3.369836|7.605541|2.790284|4.270320|3.858674|2.413055|2.336513|1.984256|1.851948|14.335931|1.616350|1.527291|1.605946|1.819186|2.644098|5.634068|3.287167|2.566028|2.181253|2.186239|3.362809|1.822129|0.190991|0.140588|0.190985|0.500000| |4.076581|5.584215|8.878580|17.738205|8.930070|5.639352|4.947170|4.134796|5.951785|4.030896|4.903916|13.305516|4.023593|5.728710|5.922833|3.480957|3.347630|2.668438|2.431414|19.132750|2.040513|1.903002|2.020934|2.367282|3.974430|9.408901|4.627093|3.532202|2.786252|2.662254|3.961665|2.068931|0.107932|0.095583|0.107940|0.214827|0.500000| |6.927047|8.914515|5.649997|4.947651|5.683643|8.977671|17.738741|7.096791|13.199418|4.616939|3.992949|7.513157|3.036893|4.900520|3.704269|2.272902|2.058678|1.792986|1.764317|14.409059|1.565285|1.436458|1.455860|1.600879|2.131187|4.289298|2.588557|1.886404|1.644086|1.590881|2.534000|1.360953|0.151036|0.219561|0.151070|0.124061|0.107470|0.500000| |2.643420|3.243322|3.139475|3.649538|4.970182|5.507972|4.063699|8.635014|12.771264|17.790024|9.162224|10.215757|7.095708|13.296526|6.474196|3.741602|2.987307|2.579415|2.703674|25.226146|2.333385|2.007324|1.958384|2.145962|2.778153|5.344304|3.185896|2.140102|1.838143|1.683216|2.688761|1.398292|0.067552|0.073364|0.067576|0.074377|0.091823|0.108677|0.500000| |2.507036|3.115373|3.612616|4.883010|5.563446|4.177024|3.286291|3.962803|5.669432|4.951359|7.552030|15.610076|9.313658|10.790516|25.876015|9.469782|7.368505|4.767393|4.283526|37.526906|3.207888|2.811590|2.953006|3.647203|7.610173|17.718237|6.827167|4.198955|3.174831|2.718230|4.098616|2.038925|0.066406|0.064480|0.066417|0.089925|0.152154|0.079257|0.119050|0.500000| |1.385655|1.555108|1.655374|1.877201|2.006017|1.844379|1.629224|1.917365|3.132119|2.236160|2.489608|4.151653|3.080669|5.825458|4.611964|4.366796|4.411720|6.017155|8.931929|43.149163|17.511493|8.827154|6.585713|5.275066|3.344010|5.142608|4.197447|2.502708|2.335653|1.971090|3.301561|1.636361|0.037214|0.037151|0.037652|0.043718|0.054674|0.042753|0.063697|0.083948|0.500000| |1.380382|1.549866|1.642688|1.861829|2.002836|1.851007|1.631474|1.939683|3.176263|2.274912|2.518869|4.152132|3.143195|6.063093|4.636114|4.382210|4.322006|5.753856|8.899098|45.555223|17.540307|8.810047|5.526165|4.884223|3.273591|5.007880|4.152644|2.480793|2.317855|1.958080|3.283271|1.628108|0.037290|0.037103|0.037186|0.043255|0.053959|0.042923|0.065370|0.083280|0.303883|0.500000| |1.238615|1.371155|1.463388|1.635170|1.706964|1.572110|1.415424|1.607498|2.648067|1.822516|2.009614|3.446521|2.376274|4.359539|3.579262|3.244978|3.552752|4.865964|5.569597|27.339783|8.841262|17.551359|8.807609|5.490731|2.933453|4.452356|4.000032|2.439667|2.406559|2.025888|3.496279|1.721603|0.033631|0.033153|0.033709|0.039192|0.047933|0.037224|0.051305|0.067976|0.220553|0.205994|0.500000| |1.316134|1.465491|1.574446|1.773598|1.850370|1.687835|1.511124|1.717886|2.808013|1.958459|2.188012|3.771031|2.614913|4.739952|4.026597|3.745060|4.252670|6.107707|6.642983|30.647469|8.844556|17.519556|8.862783|6.956469|3.453809|5.070219|4.804913|2.845618|2.795624|2.295991|3.926965|1.904386|0.035916|0.035100|0.035601|0.042120|0.052323|0.039527|0.054774|0.076397|0.174258|0.220109|0.303028|0.500000| |1.367190|1.524601|1.654941|1.871000|1.927802|1.737774|1.558511|1.743879|2.832281|1.975416|2.232715|3.926135|2.640506|4.657115|4.167127|3.867609|4.600606|6.642960|6.291506|29.443967|6.991330|8.864188|17.521938|8.853426|3.804746|5.620035|5.182304|3.046331|2.961226|2.416986|4.092446|1.977894|0.036957|0.036247|0.037500|0.044510|0.055846|0.040509|0.054485|0.081002|0.197024|0.140558|0.210471|0.173818|0.500000| |1.293111|1.431202|1.554895|1.742597|1.774989|1.603785|1.452336|1.598762|2.608621|1.788556|2.007845|3.567419|2.328543|4.083281|3.653891|3.301028|3.996018|5.529399|4.953261|24.304809|5.505245|8.810099|17.546588|8.857008|3.522161|5.161713|5.189147|3.120346|3.217427|2.597237|4.523496|2.155161|0.035269|0.034255|0.035390|0.042146|0.052141|0.037806|0.049176|0.072191|0.138228|0.123375|0.214557|0.210458|0.303081|0.500000| |1.481796|1.663607|1.836221|2.100494|2.133903|1.884201|1.684589|1.857997|2.982080|2.100426|2.426101|4.379110|2.859914|4.860977|4.733213|4.460929|6.153443|8.856769|6.138994|29.572293|5.327502|6.649213|8.891093|17.471554|5.445208|7.189238|8.757669|4.602006|4.551149|3.351046|5.549301|2.541930|0.040611|0.038941|0.040209|0.049608|0.063944|0.043324|0.056911|0.094663|0.121427|0.124014|0.139202|0.199417|0.174746|0.221637|0.500000| |1.541734|1.735853|1.933488|2.223478|2.237412|1.955024|1.747467|1.908598|3.047166|2.150638|2.507093|4.597199|2.933887|4.896734|4.947568|4.625787|6.646949|8.872483|5.810824|29.157384|4.859918|5.514610|8.845169|17.571134|6.160223|8.128214|9.513622|4.922790|4.688810|3.450117|5.598178|2.570673|0.041944|0.040326|0.042234|0.052408|0.068465|0.044702|0.057735|0.101258|0.122133|0.108510|0.123400|0.140554|0.219752|0.209160|0.303274|0.500000| |1.711085|1.944570|2.207087|2.575887|2.548695|2.176989|1.939048|2.084023|3.287526|2.336069|2.775834|5.260094|3.188602|5.123271|5.554926|4.930955|7.409412|6.982731|4.749277|27.551477|3.770735|3.993703|4.821994|7.751577|9.426388|10.947815|26.140422|9.057501|7.467094|4.720306|7.037501|3.095181|0.047132|0.044336|0.046350|0.060012|0.081187|0.049024|0.061526|0.119479|0.091608|0.092542|0.091570|0.115190|0.116633|0.123957|0.253340|0.227859|0.500000| |2.028485|2.313608|2.736388|3.197594|2.954208|2.451205|2.224600|2.233490|3.492394|2.404505|2.855871|5.819551|3.002929|4.642139|5.035683|3.768548|4.594976|3.797271|3.060747|20.606045|2.544025|2.572238|2.884758|3.742347|6.812155|11.884635|12.389551|17.530598|8.815005|6.883100|8.386376|3.790352|0.056924|0.051420|0.054764|0.076461|0.105969|0.055177|0.061305|0.118417|0.064678|0.065611|0.062703|0.073671|0.074769|0.076647|0.111292|0.111502|0.197154|0.500000| |2.020969|2.300496|2.744616|3.207710|2.921500|2.411526|2.196238|2.185678|3.417175|2.346719|2.792460|5.738230|2.933913|4.526354|4.961896|3.740723|4.659051|3.867634|3.071028|20.401908|2.556611|2.585926|3.020730|3.909018|7.175411|13.180155|12.572670|17.615450|8.823800|6.840182|8.349866|3.773596|0.055930|0.051046|0.055600|0.077427|0.108247|0.054371|0.059743|0.118297|0.066546|0.064457|0.063435|0.071664|0.080922|0.080155|0.109238|0.125843|0.182423|0.303686|0.500000| |1.599090|1.770571|2.020368|2.268292|2.147215|1.860342|1.716481|1.744637|2.795487|1.878245|2.159883|4.184267|2.329657|3.775800|3.795178|3.059377|3.874279|3.768764|2.983545|18.316927|2.626410|2.860976|3.505641|4.469407|4.855564|7.503997|9.678575|8.853823|17.552902|8.930856|13.073292|4.876388|0.044418|0.041179|0.044059|0.056815|0.071865|0.043574|0.049243|0.083644|0.067714|0.065612|0.070692|0.080435|0.090811|0.099525|0.133863|0.149723|0.196406|0.173205|0.211727|0.500000| |1.600519|1.774092|2.013754|2.261265|2.157953|1.876798|1.728106|1.767847|2.835040|1.907235|2.188591|4.212959|2.364961|3.845348|3.830579|3.079804|3.847282|3.718271|2.983805|18.503420|2.621517|2.854456|3.313325|4.249025|4.745832|7.236790|9.631680|8.828363|17.523561|8.958755|13.171379|4.895597|0.044842|0.041323|0.043574|0.056321|0.071058|0.043945|0.050113|0.083698|0.065936|0.067041|0.069948|0.083703|0.082661|0.093512|0.138798|0.127776|0.217152|0.210192|0.173113|0.302602|0.500000| |1.747494|1.911076|2.206619|2.415656|2.205969|1.915338|1.807756|1.754493|2.820422|1.834712|2.080315|4.128583|2.139570|3.435180|3.366115|2.529182|2.940961|2.695476|2.280758|15.106175|2.019235|2.112477|2.367383|2.850153|3.689167|6.429020|6.311174|6.877560|8.828728|17.473849|16.559968|7.291720|0.049763|0.044525|0.047802|0.063657|0.076829|0.045702|0.047502|0.075639|0.052165|0.052601|0.053177|0.060736|0.061750|0.065939|0.085866|0.085547|0.120677|0.206338|0.169459|0.173873|0.212834|0.500000| 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