Version2.4 2021-05-29T00:53:47Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 20-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1,RFO) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCc1c(c(n(n1)c2ccc(cc2C)C)[O-])C3=C(C(=O)N(C3=O)CC(C)C)N(CC)CC C35960808 RHF 6-31G(d) (6D,7F) CCCc1c(c(n(n1)c2ccc(cc2C)C)[O-])C3=C(C(=O)N(C3=O)CC(C)C)N(CC)CC C01[X(C26H35N4O3)] 198 C1 565 CCCc1nn(c(c1C1=C(N(CC)CC)C(=O)N(C1=O)CC(C)C)[O-])c1ccc(cc1C)C CCCc1nn(c(c1C1=C(N(CC)CC)C(=O)N(C1=O)CC(C)C)[O-])c1ccc(cc1C)C CCCc1nn(c([O-])c1C2=C(N(CC)CC)C(=O)N(CC(C)C)C2=O)c3ccc(C)cc3C InChIKey=ZCNJSMXXNXDXMU-UHFFFAOYSA-M InChI=1S/C26H36N4O3/c1-8-11-19-21(25(32)30(27-19)20-13-12-17(6)14-18(20)7)22-23(28(9-2)10-3)26(33)29(24(22)31)15-16(4)5/h12-14,16,32H,8-11,15H2,1-7H3/p-1 InChI=1/C26H36N4O3/c1-8-11-19-21(25(32)30(27-19)20-13-12-17(6)14-18(20)7)22-23(28(9-2)10-3)26(33)29(24(22)31)15-16(4)5/h12-14,16,32H,8-11,15H2,1-7H3/p-1/fC26H35N4O3/h32h/q-1 CCCc1c(c(n(n1)c2ccc(cc2C)C)[O-])C3=C(C(=O)N(C3=O)CC(C)C)N(CC)CC C01[X(C26H35N4O3)] 198 C01 565 CCCc1nn(c(c1C1=C(N(CC)CC)C(=O)N(C1=O)CC(C)C)[O-])c1ccc(cc1C)C CCC[C]1[N][N@@]([C]([C]1C1=C(N(CC)CC)C(=O)N(C1=O)CC(C)C)[O])[C]1[CH][CH][C]([CH][C]1C)C CCC[C]1[N]N([C]([O])[C]1C2=C(N(CC)CC)C(=O)N(CC(C)C)C2=O)[C]3[CH][CH][C](C)[CH][C]3C InChIKey=QHEHHDBWDFLHRU-UHFFFAOYSA-N InChI=1S/C26H35N4O3/c1-8-11-19-21(25(32)30(27-19)20-13-12-17(6)14-18(20)7)22-23(28(9-2)10-3)26(33)29(24(22)31)15-16(4)5/h12-14,16H,8-11,15H2,1-7H3 InChI=1/C26H35N4O3/c1-8-11-19-21(25(32)30(27-19)20-13-12-17(6)14-18(20)7)22-23(28(9-2)10-3)26(33)29(24(22)31)15-16(4)5/h12-14,16H,8-11,15H2,1-7H3 3517.8330545215 -1447.3913387 1-A 17942.0918 122 443 565 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.44783 -20.44383 -20.34230 -15.49466 -15.46454 -15.45018 -15.41536 -11.25569 -11.25317 -11.17364 -11.17248 -11.16408 -11.14975 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|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 16.7012 21.0769 23.8976 30.4932 35.3725 40.6101 41.8387 48.4855 49.8388 62.7170 72.1926 78.7055 96.0054 97.8820 113.3435 119.3543 139.9598 148.1895 164.8998 174.7053 178.3447 199.4569 202.6943 222.1823 225.7953 229.8662 244.5613 256.9772 260.5408 265.1524 274.3216 291.0836 305.6518 312.1580 317.5378 325.0750 329.8335 334.6147 345.9812 358.7231 373.6626 393.7203 421.1762 436.7907 441.6465 451.8536 454.8445 486.5932 501.4405 515.8663 552.8224 595.2452 612.2790 623.1360 645.5284 651.0248 689.2544 697.1598 747.8548 784.9898 790.9461 801.1350 810.7621 834.2083 841.4844 849.4770 849.7131 854.9186 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103.87 113.24 138.13 140.83 163.08 171.72 201.37 213.21 237.25 251.36 256.60 286.97 291.63 319.67 324.87 330.73 351.87 369.73 374.86 381.50 394.69 418.80 439.76 449.13 456.87 467.71 474.56 481.44 497.79 516.12 537.62 566.48 605.98 628.44 635.43 650.12 654.42 700.10 721.46 742.22 795.39 856.43 880.93 896.55 928.77 936.68 991.68 1003.06 1076.00 1129.43 1138.00 1152.65 1166.51 1200.24 1210.71 1222.21 1222.55 1230.04 1256.91 1261.67 1279.88 1292.56 1329.59 1345.11 1378.39 1393.73 1411.26 1413.20 1455.13 1461.75 1464.12 1481.34 1507.08 1532.96 1540.71 1578.21 1588.88 1596.44 1642.77 1664.36 1678.98 1685.30 1686.09 1688.97 1719.75 1730.53 1743.86 1749.72 1785.20 1793.76 1803.75 1804.96 1823.34 1858.64 1874.92 1882.77 1911.95 1933.53 1961.05 1975.12 1980.27 2011.10 2046.42 2062.88 2079.52 2084.91 2108.38 2110.36 2126.28 2167.15 2180.37 2184.20 2190.43 2221.63 2234.79 2237.24 2240.55 2243.68 2246.83 2250.21 2252.73 2262.98 2264.33 2272.95 2282.05 2312.23 2338.80 2340.41 2351.88 2352.40 2353.62 2354.69 2355.30 2356.83 2361.57 2362.33 2365.54 2366.27 2372.35 2372.65 2380.61 2382.79 2385.81 2391.54 2413.35 2431.74 2500.61 2547.36 2584.31 2614.55 2636.61 2803.34 2914.11 4518.99 4576.66 4581.56 4585.61 4591.94 4593.19 4596.17 4601.78 4611.54 4623.43 4630.54 4637.79 4648.48 4653.84 4658.37 4661.83 4666.41 4666.79 4667.36 4679.25 4684.83 4686.15 4689.08 4713.96 4722.01 4731.55 4734.29 4745.22 4745.27 4761.91 4772.80 4786.20 4788.34 4800.18 4931.62 0.617516 0.650979 0.651924 0.548595 -1446.773823 -1446.740359 -1446.739415 -1446.842743 3.465638D-04 MUNgauss RevisionA2.1 retrievium 29-May-2021 DUDE CCCc1c(c(n(n1)c2ccc(cc2C)C)[O-])C3=C(C(=O)N(C3=O)CC(C)C)N(CC)CC C35960808 RHF 6-31G(d) (6D,10F) C1 451.270916 |X|Y|Z| 108.433528 67.143747 40.939085 66.798867 16 6 7 13 3 |36.858105| |12.461220|36.858105| |7.487916|12.438074|36.858105| |4.888943|7.503136|12.631674|36.858105| |3.804087|5.143176|7.233471|13.424732|36.858105| |3.124720|4.083074|5.091472|8.420320|13.363966|36.858105| |3.307540|4.443761|5.338730|8.957461|8.631445|13.772636|53.358707| |4.251753|6.225177|7.887907|14.734928|8.431457|8.266247|18.768944|53.358707| |2.793202|3.555790|3.965436|5.511657|5.314351|7.639167|18.470059|10.746671|36.858105| |2.375028|2.892192|3.262755|4.277258|4.410345|6.240313|10.742516|7.317016|13.704111|36.858105| |2.084487|2.468220|2.689578|3.315897|3.350700|4.330320|7.030147|5.492642|7.888626|13.784778|36.858105| |2.061121|2.428385|2.552495|3.063006|2.988626|3.691899|6.152597|5.130005|6.776979|7.914668|13.736403|36.858105| |2.320144|2.789157|2.856929|3.447048|3.242166|3.952767|7.016356|6.013468|7.949970|6.961071|8.029054|13.735051|36.858105| |2.745511|3.455121|3.573186|4.562452|4.163646|5.225081|10.607685|8.672587|13.615753|7.923260|6.837372|7.807049|13.699926|36.858105| |3.161146|4.085831|3.897084|4.753744|4.083741|4.644078|8.825409|8.815294|7.475317|5.001837|4.435236|5.007035|7.604259|12.609070|36.858105| |1.795038|2.059526|2.134816|2.469171|2.416733|2.865186|4.528615|3.972733|4.407242|5.014204|7.537485|12.601120|7.545255|4.984487|3.791772|36.858105| |2.616289|3.255458|3.861265|5.476293|7.846128|15.485280|11.213276|7.461453|6.516093|6.289629|4.480240|3.687524|3.755506|4.627994|3.969586|2.900554|73.516695| |3.521512|4.390242|5.781474|7.320486|13.147643|7.505612|7.187158|7.077546|3.855095|3.433039|2.755124|2.479355|2.633711|3.203531|3.188837|2.075152|11.012108|36.858105| |2.882191|3.381434|4.243218|5.001385|7.475427|5.850779|5.746091|5.419685|3.322958|3.140270|2.573098|2.284719|2.359137|2.769608|2.684077|1.945121|10.076764|14.126712|36.858105| |2.720395|3.058123|3.610429|3.902427|5.084246|4.155657|4.453418|4.336608|2.692742|2.544151|2.161173|1.963905|2.034766|2.343510|2.328304|1.707252|7.274892|8.224061|12.686549|36.858105| |2.360669|2.581983|2.976139|3.155470|3.905492|3.391404|3.756532|3.641118|2.349488|2.267083|1.963818|1.787463|1.830909|2.068091|2.041630|1.576064|6.120747|5.483379|7.821638|15.915756|73.516695| |3.111441|3.499410|3.992430|4.142308|5.143663|4.021981|4.458601|4.498028|2.672484|2.449549|2.090389|1.936692|2.046176|2.379876|2.441012|1.682731|6.724971|8.156544|8.232881|13.856525|14.883181|53.358707| |3.819109|4.598867|5.435935|5.778983|7.391589|5.090512|5.582132|5.812573|3.179840|2.808249|2.345057|2.177586|2.344093|2.807730|2.929602|1.858916|7.867806|12.680021|8.321040|8.429072|9.942379|18.683697|36.858105| |4.565981|5.585997|5.931097|5.778214|6.284159|4.531199|5.375097|5.885338|3.102038|2.673540|2.261401|2.146152|2.355724|2.836839|3.086378|1.837582|6.863802|7.819073|5.522772|5.608665|7.546591|11.408408|15.966305|73.516695| |2.896684|3.098604|3.328734|3.292919|3.776068|3.120171|3.640629|3.719257|2.258810|2.081433|1.818420|1.710532|1.808500|2.067943|2.149901|1.509773|5.285303|5.091754|5.123087|7.633623|11.781533|17.936016|7.566777|11.733939|36.858105| |2.465713|2.647556|2.760758|2.812333|3.219876|2.822203|3.315163|3.303146|2.110103|1.960772|1.736418|1.643092|1.731434|1.955507|2.030443|1.462294|4.944183|4.082309|4.185627|5.775402|9.860283|10.375381|5.407988|8.890221|12.421546|36.858105| |2.538234|2.792697|2.826141|2.942080|3.350298|3.000134|3.548854|3.505677|2.266787|2.074870|1.838913|1.756983|1.873179|2.127807|2.243273|1.557253|5.257446|4.058726|3.907135|4.787498|7.672028|8.521307|5.360684|9.498176|7.494686|12.451072|36.858105| |2.241686|2.326693|2.373761|2.356812|2.597801|2.312645|2.798857|2.820119|1.816199|1.697908|1.526692|1.457735|1.533072|1.708445|1.781736|1.313590|4.043003|3.133085|3.195096|4.129085|7.455519|6.796992|3.940005|6.854658|7.612547|12.439004|7.548402|36.858105| |2.500176|2.880100|3.584112|4.233733|5.876567|5.369032|5.396015|4.913440|3.257274|3.247292|2.668820|2.312570|2.322812|2.669113|2.498959|1.979107|10.064283|7.637267|13.822700|7.685940|11.581179|7.205746|5.211386|7.064049|3.866054|3.355164|3.138368|2.698627|53.358707| |2.124331|2.408188|2.852215|3.312543|4.327888|4.332693|4.535230|4.042261|2.896042|2.976736|2.524931|2.187990|2.161327|2.420369|2.249277|1.904026|8.872807|5.221853|7.791799|6.237844|11.044242|6.010016|4.103398|5.834917|3.467924|3.219833|3.015778|2.619837|17.877122|36.858105| |1.904185|2.099246|2.453497|2.727754|3.335999|3.282764|3.665927|3.369367|2.405901|2.496989|2.183566|1.912884|1.875147|2.058856|1.924325|1.699705|6.432800|3.907062|5.331541|4.950761|9.887503|4.970560|3.305224|4.869647|3.065538|2.859288|2.601872|2.427153|10.412802|12.473186|36.858105| |2.530213|2.906285|3.730449|4.408012|5.689990|5.343329|5.694350|5.246505|3.461044|3.537539|2.873698|2.445596|2.426606|2.779202|2.546897|2.083211|9.490941|6.132344|7.760952|5.141754|8.089838|5.545432|4.275955|6.190910|3.159238|2.739296|2.601631|2.292260|17.835253|7.599497|6.062429|36.858105| |2.258148|2.602234|3.221885|3.906074|4.803867|5.267133|5.844974|5.058697|3.789439|4.193801|3.387353|2.760596|2.643616|2.964702|2.599289|2.340243|10.190895|4.610668|5.260054|3.839214|6.249931|4.372829|3.404406|5.170686|2.599425|2.349433|2.293667|1.998618|10.291959|6.395732|5.277282|12.464519|36.858105| |17.509448|8.756720|6.792179|4.517393|3.509028|2.941115|4.296985|5.534980|2.710803|2.335693|2.062685|2.037344|2.274670|2.658723|2.996291|1.783454|4.403022|3.213888|2.694724|2.516736|3.933262|3.801641|3.342088|6.738878|2.591572|2.218173|2.252365|2.031979|3.263276|2.038079|1.847982|2.486065|2.235682|0.500000| |17.525495|8.775476|6.777346|4.523708|3.735692|3.004550|4.161171|5.144947|2.569648|2.224714|1.952091|1.910508|2.118710|2.483425|2.792028|1.673102|4.533217|3.659463|3.023826|2.935136|4.526003|4.668426|4.154572|8.945265|3.255407|2.695431|2.717629|2.464144|3.517521|2.187706|1.972907|2.578190|2.253092|0.301363|0.500000| |17.518836|8.759077|5.454979|4.048216|3.272340|2.790215|4.045429|5.034411|2.584188|2.203576|1.965561|1.972474|2.234108|2.608098|3.065331|1.735612|4.235007|3.051653|2.546405|2.440459|3.814724|3.802933|3.344958|7.149858|2.667255|2.330726|2.434858|2.152750|3.032804|1.932385|1.740489|2.234268|2.026697|0.301437|0.301565|0.500000| |8.843082|17.556758|8.886637|6.891559|4.677098|4.008070|6.373032|9.280019|3.878320|3.074868|2.644730|2.654688|3.129265|3.930080|4.891476|2.236658|5.695313|3.826859|3.027169|2.707026|4.124786|4.101783|3.834180|7.920889|2.683258|2.361524|2.518220|2.091471|3.614743|2.257449|1.971850|2.718426|2.514196|0.209822|0.172843|0.211999|0.500000| |8.856868|17.576290|8.895980|6.921062|5.260608|4.171456|5.949608|7.726235|3.492725|2.833523|2.422162|2.389189|2.752940|3.415972|4.114173|2.028479|5.982764|4.657497|3.521301|3.251739|4.827668|5.259587|5.234507|12.434386|3.440791|2.961481|3.219395|2.569526|3.974501|2.467757|2.127763|2.845168|2.542517|0.172786|0.211459|0.211499|0.303136|0.500000| |6.922827|8.863370|17.578578|8.930282|6.918820|4.658581|6.099256|7.868190|3.411573|2.918393|2.431537|2.288556|2.509957|3.055420|3.265755|1.942313|6.540708|6.556311|4.787254|4.187282|6.026449|6.475339|6.603146|12.586198|3.907623|3.089408|3.070342|2.636431|5.285836|3.029428|2.620682|3.939941|3.239092|0.170958|0.205229|0.140831|0.174272|0.212095|0.500000| |6.858790|8.861915|17.506708|8.990980|5.776481|4.470473|6.622161|9.657052|3.797673|3.204450|2.671110|2.531591|2.801189|3.430894|3.641632|2.131751|6.209707|4.710885|3.734334|3.183994|4.804250|4.611612|4.295352|7.976503|2.888663|2.427262|2.449363|2.127817|4.528501|2.670002|2.348226|3.631070|3.191447|0.203763|0.167888|0.140358|0.213826|0.174284|0.303283|0.500000| |2.323943|2.804034|3.262460|4.292496|4.695151|6.781462|9.936526|6.865015|8.975927|17.783898|8.932892|5.641570|5.003015|5.654957|4.083000|4.089354|13.097831|3.711280|3.498252|2.760220|4.380109|3.523922|2.935192|4.838681|2.170980|2.033369|2.121781|1.750024|5.129263|3.447133|2.853766|4.230061|5.397365|0.063606|0.061338|0.059317|0.080728|0.076256|0.082855|0.089214|0.500000| |1.893264|2.201259|2.407832|2.903536|2.986384|3.758628|5.711009|4.618257|5.631893|8.954863|17.678424|8.902167|5.674183|4.930729|3.545933|6.965047|7.142241|2.534088|2.428110|2.054628|3.363301|2.671908|2.163022|3.676594|1.716909|1.646276|1.727806|1.454795|3.502796|2.484782|2.182483|2.788770|3.376864|0.052267|0.049714|0.049629|0.064669|0.060007|0.061493|0.066849|0.216197|0.500000| |2.234191|2.641760|2.625895|3.057036|2.845507|3.328521|5.682487|5.179377|5.657470|4.993768|5.686060|8.950579|17.668207|8.967528|7.145297|7.026688|5.622053|2.366270|2.124527|1.867456|3.004714|2.580717|2.158182|3.907240|1.699927|1.637007|1.777831|1.463339|2.825232|1.942642|1.704218|2.149214|2.304122|0.060830|0.056454|0.060711|0.083027|0.072707|0.064371|0.071571|0.108309|0.124478|0.500000| |3.605844|4.724877|4.376471|5.090901|4.060024|4.344064|8.271892|9.731357|6.384261|4.465383|3.943598|4.338595|6.078477|8.830102|17.600895|3.407501|6.418110|3.159468|2.637997|2.294457|3.573996|3.293239|2.923720|5.544511|2.138949|1.989445|2.169290|1.757568|3.332485|2.171928|1.877571|2.533401|2.548259|0.096232|0.085822|0.096826|0.169038|0.125840|0.098416|0.116230|0.104685|0.089782|0.162390|0.500000| |3.375877|4.518669|4.245387|5.333155|4.667494|5.239114|9.460014|9.335055|6.890745|4.656856|3.978412|4.236014|5.767390|8.859476|17.593213|3.290537|7.806366|3.620239|2.969682|2.579188|3.966678|3.743865|3.372499|6.416940|2.403769|2.274394|2.560853|1.969982|3.665510|2.412193|2.034292|2.676853|2.676220|0.086200|0.083605|0.090707|0.145728|0.133459|0.099440|0.104989|0.110291|0.090594|0.148737|0.304479|0.500000| |2.827966|3.490299|3.249864|3.766406|3.345027|3.740874|6.518551|6.449439|5.578746|4.206186|4.013176|4.802153|7.353794|8.893354|17.536765|3.856079|5.961703|2.737388|2.357354|2.089560|3.300603|2.985231|2.574240|4.841705|1.968525|1.885916|2.093307|1.675142|3.006296|2.025023|1.754058|2.234615|2.288764|0.074654|0.069851|0.078077|0.114400|0.098713|0.077730|0.085224|0.096698|0.091198|0.228971|0.300022|0.300411|0.500000| |1.761554|1.999551|2.074515|2.360678|2.279333|2.646488|4.190965|3.788366|3.957027|4.451973|6.265604|8.810628|6.207617|4.402630|3.469720|17.504676|4.691144|1.963647|1.844106|1.623005|2.671788|2.176593|1.763168|3.103409|1.439835|1.386814|1.465634|1.252456|2.562067|1.801020|1.625288|2.004935|2.247106|0.049105|0.045507|0.047301|0.060487|0.054095|0.052382|0.058347|0.103885|0.168250|0.166487|0.090030|0.083176|0.097446|0.500000| |1.756031|2.006215|2.041120|2.334254|2.273492|2.655832|4.172735|3.727125|3.946375|4.195656|5.627037|8.824638|7.102775|4.695074|3.795158|17.548281|4.756055|1.968547|1.837611|1.631762|2.680471|2.209135|1.791094|3.177235|1.468042|1.430678|1.534279|1.290716|2.515472|1.782387|1.593539|1.919775|2.117805|0.048234|0.045391|0.047623|0.060750|0.055294|0.051644|0.056237|0.096673|0.142347|0.215304|0.093657|0.091367|0.112496|0.302152|0.500000| |1.671063|1.905406|1.990483|2.300511|2.300079|2.734608|4.172836|3.620422|3.938878|4.688401|7.047900|8.826406|5.653337|4.178823|3.257677|17.546845|5.055698|2.005213|1.908051|1.678939|2.775185|2.232641|1.792368|3.122604|1.473138|1.434705|1.522897|1.289474|2.672620|1.917870|1.719786|2.060247|2.344962|0.046045|0.043662|0.044802|0.056701|0.052391|0.050912|0.055061|0.111237|0.210021|0.144186|0.081606|0.081325|0.091056|0.302174|0.301691|0.500000| |3.275280|3.433047|3.565020|3.383840|3.706260|3.021594|3.622888|3.800691|2.244384|2.039510|1.786496|1.697766|1.813923|2.082537|2.206077|1.498856|4.995342|4.753847|4.427091|5.757238|8.783835|12.701047|7.382744|13.586408|17.604106|8.816880|6.865902|6.849825|4.631857|3.008745|2.675248|2.904506|2.420745|0.079673|0.104919|0.084080|0.080970|0.107821|0.117617|0.084863|0.058399|0.046575|0.047657|0.061582|0.068727|0.056182|0.039812|0.040644|0.040370|0.500000| |2.688764|2.804923|3.049913|2.973685|3.364763|2.815097|3.315888|3.393436|2.080329|1.943604|1.708953|1.602908|1.679970|1.901927|1.958010|1.424542|4.803818|4.442368|4.728421|7.148916|12.668536|12.609051|5.861645|9.075903|17.579576|8.855664|5.488927|7.121849|5.112089|3.400619|3.140564|3.109240|2.535085|0.068146|0.084418|0.068621|0.067939|0.084036|0.099887|0.075500|0.056660|0.045174|0.043898|0.054419|0.059902|0.049974|0.037935|0.038377|0.038726|0.301338|0.500000| |2.247300|2.429500|2.581765|2.687286|3.143912|2.818649|3.263247|3.188171|2.092053|1.973954|1.750036|1.641933|1.711519|1.920500|1.960708|1.464076|5.069937|4.011172|4.382390|6.270656|11.725592|9.583286|4.900813|7.633353|8.957477|17.534042|8.900521|8.917330|4.905970|3.606403|3.214886|2.863268|2.460718|0.056963|0.067417|0.058796|0.060954|0.074261|0.079520|0.063839|0.057427|0.046422|0.044745|0.053035|0.060600|0.050595|0.038507|0.039648|0.040161|0.174597|0.214548|0.500000| |2.240432|2.444432|2.455761|2.570812|2.897792|2.685634|3.216547|3.140645|2.101020|1.944292|1.746020|1.675858|1.776946|1.990550|2.087974|1.499383|4.802514|3.388957|3.335322|3.966002|6.659770|6.438117|4.155306|7.346072|5.466380|8.794191|17.525697|6.908519|3.806966|2.773673|2.430230|2.344399|2.111255|0.055833|0.065868|0.060386|0.062376|0.077253|0.072854|0.060101|0.055065|0.045821|0.047102|0.055692|0.065681|0.054811|0.039123|0.041212|0.040924|0.140170|0.123190|0.212987|0.500000| |2.642215|3.006027|3.091690|3.342245|3.947493|3.554065|4.090622|3.962629|2.576473|2.341402|2.048601|1.944199|2.078072|2.389504|2.506226|1.703364|6.272729|4.840949|4.562046|5.365740|8.135282|9.440958|6.323367|10.735362|6.800176|8.754470|17.585246|5.481104|4.853483|3.404646|2.824974|2.898870|2.559426|0.065080|0.077436|0.069721|0.075587|0.096988|0.092314|0.073501|0.066647|0.053153|0.054307|0.066559|0.080661|0.064287|0.044255|0.046479|0.046253|0.169601|0.139302|0.212676|0.301817|0.500000| |2.762220|3.007526|2.941250|2.982287|3.272650|2.893396|3.512641|3.551137|2.242656|2.025430|1.800318|1.738605|1.874206|2.136453|2.299849|1.542047|4.945128|3.839149|3.536328|4.156142|6.573860|7.580258|5.212633|10.235842|6.782271|8.771239|17.534000|6.817203|3.883843|2.683225|2.337985|2.436598|2.155734|0.066981|0.082671|0.074549|0.074730|0.098437|0.088597|0.070252|0.056911|0.046720|0.049775|0.062286|0.073265|0.059824|0.040427|0.042393|0.041614|0.203221|0.139997|0.173376|0.300881|0.302239|0.500000| |2.139837|2.194953|2.269188|2.235973|2.459205|2.187068|2.650052|2.675612|1.723859|1.625259|1.464093|1.392581|1.455329|1.614499|1.670332|1.258999|3.829186|2.972900|3.107656|4.069122|7.716794|6.363379|3.633438|6.182675|6.950678|8.747276|5.478944|17.532484|3.640254|2.605416|2.478229|2.283506|1.977575|0.054524|0.065655|0.056747|0.054832|0.066155|0.070481|0.057217|0.046793|0.038954|0.038537|0.045994|0.050816|0.043580|0.033479|0.034254|0.034398|0.168898|0.215075|0.213455|0.141037|0.122437|0.139252|0.500000| |2.027401|2.111352|2.138889|2.149230|2.364536|2.154631|2.622172|2.615227|1.724479|1.621280|1.469857|1.408161|1.476598|1.632172|1.698118|1.276402|3.816259|2.786839|2.853165|3.559832|6.506317|5.579235|3.373245|5.889836|5.507737|8.770433|6.900266|17.539385|3.358814|2.451508|2.282540|2.107263|1.871484|0.051326|0.061012|0.054585|0.053475|0.064633|0.064839|0.053625|0.046288|0.039026|0.039287|0.046229|0.052027|0.044698|0.033736|0.034952|0.034918|0.140000|0.143808|0.212565|0.207623|0.140896|0.169261|0.301598|0.500000| |2.379768|2.430185|2.425671|2.359989|2.541158|2.244942|2.760071|2.823149|1.790847|1.659677|1.495184|1.438175|1.523378|1.700549|1.795793|1.296892|3.865726|3.005737|2.965174|3.687840|6.430529|6.250471|3.845518|7.043900|6.873684|8.762583|6.813414|17.511919|3.402100|2.382872|2.203861|2.168120|1.896930|0.059380|0.073373|0.064097|0.060338|0.075097|0.074886|0.060232|0.047162|0.039416|0.040596|0.049521|0.055200|0.047021|0.034425|0.035508|0.035199|0.202731|0.174524|0.173473|0.169124|0.139326|0.201393|0.301118|0.301657|0.500000| |2.032985|2.324085|2.728935|3.244031|4.202065|4.557352|4.767477|4.096714|3.124009|3.317392|2.808649|2.385992|2.318159|2.574518|2.337378|2.068129|10.059941|4.658865|6.130960|4.825269|8.290569|5.087166|3.641445|5.350037|3.006530|2.855166|2.770336|2.357030|12.434952|17.540297|8.822726|6.898318|7.199751|0.054374|0.057358|0.051673|0.061530|0.065989|0.078416|0.071445|0.109346|0.077643|0.057343|0.061965|0.069150|0.058490|0.053966|0.053385|0.058405|0.074197|0.080745|0.087564|0.071849|0.087488|0.069134|0.064454|0.062114|0.060160|0.500000| |2.109345|2.388646|2.767928|3.187996|4.163086|4.116657|4.318905|3.870545|2.760519|2.780993|2.382451|2.099807|2.096746|2.350438|2.220707|1.834681|8.429871|5.226952|7.706084|7.161830|13.116820|6.744372|4.372600|6.162137|3.892951|3.742343|3.488388|2.957920|12.593865|17.646104|8.923482|5.624274|4.824948|0.055556|0.060671|0.053698|0.061902|0.069247|0.082123|0.070768|0.087111|0.064636|0.052772|0.059186|0.067012|0.055897|0.047957|0.048184|0.051275|0.091218|0.104367|0.120902|0.089345|0.110791|0.083692|0.080965|0.077224|0.073300|0.305411|0.500000| |1.936201|2.107092|2.455643|2.660494|3.211036|3.040618|3.435310|3.234547|2.235341|2.276371|1.998125|1.775525|1.759361|1.937561|1.840310|1.583260|5.761211|3.886291|5.346918|5.490629|12.072660|5.368020|3.421717|5.015364|3.365311|3.087570|2.711432|2.635011|9.408412|8.842552|17.588148|5.420220|4.401572|0.052097|0.056409|0.049088|0.054397|0.059423|0.074232|0.065126|0.071019|0.055056|0.044748|0.050244|0.054222|0.046697|0.042211|0.041481|0.044236|0.080332|0.098852|0.097215|0.069866|0.080336|0.067531|0.076149|0.068074|0.065926|0.173345|0.214529|0.500000| |1.873478|2.057324|2.423501|2.684450|3.214137|3.188505|3.633716|3.352863|2.406511|2.535175|2.223592|1.932864|1.877943|2.049954|1.898014|1.721579|6.166278|3.615892|4.699813|4.178751|7.970346|4.389381|3.020193|4.526816|2.730428|2.516801|2.316224|2.174152|9.308216|8.743618|17.539130|6.570821|6.010372|0.051068|0.053632|0.047437|0.054011|0.057140|0.071337|0.065598|0.081361|0.062293|0.047284|0.051750|0.055098|0.048000|0.046044|0.044535|0.048446|0.067709|0.077857|0.076728|0.060118|0.069513|0.058838|0.061722|0.056785|0.055659|0.208323|0.173397|0.300556|0.500000| |1.735955|1.905292|2.182420|2.420031|2.909419|2.930539|3.329065|3.041727|2.232269|2.336170|2.080049|1.830796|1.783322|1.933762|1.805498|1.644266|5.836772|3.326414|4.297998|4.151136|8.378745|4.368279|2.903751|4.372772|2.783910|2.689883|2.471682|2.316741|7.586543|8.822463|17.510218|4.625688|4.390604|0.046759|0.049779|0.044511|0.050100|0.053906|0.064086|0.058047|0.073523|0.058259|0.045232|0.048630|0.052897|0.046144|0.043566|0.042951|0.046565|0.067747|0.078924|0.084922|0.065398|0.074081|0.061424|0.065637|0.061550|0.058163|0.213880|0.214291|0.300004|0.301878|0.500000| |2.382330|2.652863|3.347801|3.717564|4.462334|4.119863|4.672673|4.463163|2.931631|3.005875|2.525864|2.182373|2.158259|2.428199|2.251707|1.895063|7.271068|4.908499|6.143622|4.686308|7.841786|5.066984|3.755334|5.548030|2.997139|2.588172|2.405631|2.211733|12.436740|6.496842|6.292164|17.455460|8.867359|0.065754|0.068117|0.058572|0.068741|0.071595|0.099846|0.092596|0.097487|0.068924|0.053764|0.062795|0.065172|0.055587|0.051144|0.048679|0.052189|0.076580|0.084424|0.075309|0.060572|0.072826|0.062794|0.062190|0.056404|0.058100|0.157754|0.137106|0.164133|0.207706|0.130472|0.500000| |2.919911|3.418672|4.655550|5.601474|7.178493|6.117417|6.611270|6.363532|3.816112|3.748864|2.982311|2.560561|2.589070|3.033971|2.808136|2.153443|9.717006|7.166081|7.685887|5.004383|7.498922|5.760837|4.748142|6.932630|3.245987|2.749993|2.640332|2.302342|12.617330|5.653641|4.601027|17.660104|8.931388|0.079995|0.082209|0.070243|0.087981|0.091154|0.136441|0.126764|0.122016|0.078654|0.063527|0.078873|0.082062|0.067367|0.057797|0.055175|0.058329|0.084941|0.087631|0.077891|0.065325|0.081805|0.069912|0.063289|0.058343|0.061366|0.145752|0.129349|0.120709|0.134018|0.102982|0.303553|0.500000| |2.256446|2.579340|3.202887|3.805186|4.358945|4.716583|5.684553|5.067079|3.781933|4.250980|3.476143|2.822094|2.679061|2.974343|2.585943|2.400481|8.568558|4.009167|4.307733|3.289141|5.382326|3.882453|3.061334|4.778302|2.358007|2.124182|2.078825|1.836343|7.569713|4.728090|4.220709|8.878343|17.518264|0.063057|0.061995|0.056144|0.070003|0.068672|0.087981|0.091094|0.151079|0.097005|0.064789|0.071449|0.072490|0.063243|0.065028|0.059787|0.066464|0.062016|0.064199|0.061038|0.053282|0.063713|0.055010|0.050589|0.047787|0.048893|0.142111|0.105577|0.102386|0.135501|0.100577|0.212025|0.220645|0.500000| 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