Version2.4 2021-06-07T02:22:06Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 02-May-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1c(n2ccccc2n1)C(=O)C3=C(C(=O)N([C@H]3c4cccc(c4)OCCC(C)C)CCCOC)[O-] C33814315 RHF 6-31G(d) (6D,7F) Cc1c(n2ccccc2n1)C(=O)C3=C(C(=O)N([C@H]3c4cccc(c4)OCCC(C)C)CCCOC)[O-] C01[X(C28H32N3O5)] 198 C1 604 COCCCN1[C@@H](c2cccc(c2)OCCC(C)C)C(=C(C1=O)[O-])C(=O)c1c(C)nc2n1cccc2 COCCCN1[C@@H](c2cccc(c2)OCCC(C)C)C(=C(C1=O)[O-])C(=O)c1c(C)nc2n1cccc2 COCCCN1[C@@H](c2cccc(OCCC(C)C)c2)C(=C([O-])C1=O)C(=O)c3n4ccccc4nc3C InChIKey=PVWQDZFYDZCEBY-VWLOTQADSA-M InChI=1S/C28H33N3O5/c1-18(2)12-16-36-21-10-7-9-20(17-21)25-23(27(33)28(34)31(25)14-8-15-35-4)26(32)24-19(3)29-22-11-5-6-13-30(22)24/h5-7,9-11,13,17-18,25,33H,8,12,14-16H2,1-4H3/p-1/t25-/m0/s1 InChI=1/C28H33N3O5/c1-18(2)12-16-36-21-10-7-9-20(17-21)25-23(27(33)28(34)31(25)14-8-15-35-4)26(32)24-19(3)29-22-11-5-6-13-30(22)24/h5-7,9-11,13,17-18,25,33H,8,12,14-16H2,1-4H3/p-1/t25-/m0/s1/fC28H32N3O5/h33h/q-1 Cc1c(n2ccccc2n1)C(=O)C3=C(C(=O)N([C@H]3c4cccc(c4)OCCC(C)C)CCCOC)[O-] C01[X(C28H32N3O5)] 198 C01 604 COCCCN1[C@@H](c2cccc(c2)OCCC(C)C)C(=C(C1=O)[O-])C(=O)c1c(C)nc2n1cccc2 COCCCN1[C@@H]([C]2[CH][CH][CH][C]([CH]2)OCCC(C)C)[C]([C](=O)C1=O)[C]([O])C1=[C]([N][C]2[CH]=[CH][CH]=CN12)C COCCCN1[C@@H]([C]2[CH][CH][CH][C]([CH]2)OCCC(C)C)[C]([C]([O])C3=C(C)[N][C]4C=CC=CN34)C(=O)C1=O InChIKey=JVMFDPOGVOKMSK-VWLOTQADSA-N InChI=1S/C28H32N3O5/c1-18(2)12-16-36-21-10-7-9-20(17-21)25-23(27(33)28(34)31(25)14-8-15-35-4)26(32)24-19(3)29-22-11-5-6-13-30(22)24/h5-7,9-11,13,17-18,25H,8,12,14-16H2,1-4H3/t25-/m0/s1 InChI=1/C28H32N3O5/c1-18(2)12-16-36-21-10-7-9-20(17-21)25-23(27(33)28(34)31(25)14-8-15-35-4)26(32)24-19(3)29-22-11-5-6-13-30(22)24/h5-7,9-11,13,17-18,25H,8,12,14-16H2,1-4H3/t25-/m0/s1 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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| 7.7783 17.0943 21.1715 24.1248 28.9615 39.9571 46.0397 51.0239 55.9682 64.5216 80.7911 90.5220 104.0720 110.2580 117.5812 136.0322 140.9393 144.0210 146.6234 162.3295 169.4094 174.2843 179.1474 193.8654 207.2839 234.5065 244.6338 246.9442 269.9154 276.2406 281.4139 282.2130 293.2787 307.2756 319.5890 340.6618 350.5388 371.6402 387.5680 410.0407 418.4907 426.2299 441.3258 479.6572 484.1481 497.5745 516.7470 527.4903 548.8780 552.1463 590.0331 602.5943 642.3675 657.0109 658.6119 676.9227 690.1859 699.7887 727.0396 748.5236 765.9332 793.4974 813.2670 826.8942 838.1895 846.7784 854.5126 863.0489 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158.64 169.17 195.72 202.78 207.21 210.96 233.56 243.74 250.76 257.75 278.93 298.24 337.40 351.97 355.30 388.35 397.45 404.89 406.04 421.96 442.10 459.82 490.14 504.35 534.71 557.62 589.96 602.11 613.25 634.97 690.12 696.58 715.90 743.48 758.94 789.71 794.42 848.93 867.00 924.22 945.29 947.60 973.94 993.02 1006.84 1046.05 1076.96 1102.01 1141.67 1170.11 1189.72 1205.97 1218.33 1229.45 1241.73 1248.54 1277.93 1291.13 1296.86 1331.45 1348.03 1366.30 1389.14 1420.50 1432.60 1452.86 1457.28 1463.05 1491.39 1505.25 1526.52 1553.48 1554.92 1560.42 1573.72 1574.69 1579.23 1584.45 1619.15 1631.45 1649.33 1658.66 1687.45 1692.57 1718.72 1730.88 1757.13 1783.87 1786.69 1799.57 1816.29 1837.52 1848.76 1860.01 1862.88 1868.82 1879.18 1903.85 1921.11 1938.61 1955.65 1970.55 1975.96 2017.11 2030.76 2038.43 2048.74 2054.08 2060.86 2071.46 2077.03 2085.44 2096.33 2141.19 2157.30 2158.78 2169.94 2186.23 2190.09 2225.18 2242.19 2253.51 2258.06 2262.97 2286.63 2288.88 2312.59 2320.56 2334.12 2337.99 2345.70 2348.21 2352.51 2357.28 2358.07 2366.89 2367.68 2374.76 2374.96 2385.21 2386.59 2388.03 2417.38 2422.93 2423.54 2477.75 2493.94 2544.03 2572.21 2612.18 2661.68 2744.17 2822.12 4522.46 4553.95 4560.01 4565.83 4577.68 4584.28 4590.54 4599.92 4607.92 4616.06 4622.74 4629.37 4645.52 4670.81 4672.05 4676.53 4677.42 4686.48 4693.22 4706.17 4727.35 4733.15 4747.50 4770.04 4817.49 4831.05 4859.62 4874.73 4877.35 4883.78 4896.14 4999.85 0.602712 0.635855 0.636800 0.532409 -1616.035797 -1616.002653 -1616.001709 -1616.106100 3.501291D-04 MUNgauss RevisionA2.1 retrievium 07-Jun-2021 DUDE Cc1c(n2ccccc2n1)C(=O)C3=C(C(=O)N([C@H]3c4cccc(c4)OCCC(C)C)CCCOC)[O-] C33814315 RHF 6-31G(d) (6D,10F) C1 490.234196 |X|Y|Z| 123.944695 92.504070 31.898853 71.513486 21 6 7 18 3 |36.858105| |12.741686|36.858105| |7.371332|13.945961|36.858105| |5.213495|8.731766|13.685364|53.358707| |3.828050|5.397203|7.589833|18.994244|36.858105| |3.195461|4.262483|5.163589|11.055999|14.141836|36.858105| |3.216740|4.264612|4.638801|9.473215|7.922132|13.316603|36.858105| |3.895532|5.394518|5.350297|10.789429|6.843312|7.898639|14.120501|36.858105| |5.379884|8.962935|8.606026|18.923473|7.948818|6.886949|7.961756|13.364329|36.858105| |7.716415|13.984385|8.455006|11.714486|5.440296|4.698428|5.233374|7.712280|14.621931|53.358707| |5.655022|7.209219|12.756706|10.376701|6.247531|4.339252|3.686441|3.904502|5.248542|6.955022|36.858105| |4.347458|5.361618|8.223516|9.143632|6.524460|4.522781|3.663218|3.689084|4.645849|5.823017|15.499359|73.516695| |5.364679|5.728799|7.498395|6.982722|4.431902|3.385231|2.982586|3.162014|4.037571|5.661083|13.451957|14.621888|36.858105| |5.660065|5.460317|6.064927|5.961614|3.722504|2.992199|2.744143|2.969184|3.740932|5.493990|7.398815|9.257095|13.491350|36.858105| |4.136836|3.842083|4.142641|4.458550|2.944409|2.458974|2.262327|2.397697|2.877103|4.164307|5.075592|7.337678|8.106224|12.366669|36.858105| |3.653354|3.305116|3.408733|3.809154|2.531775|2.173266|2.035752|2.162701|2.542570|3.712334|3.894955|5.835045|5.422498|7.741118|15.852912|73.516695| |3.615708|3.483008|3.923955|4.305081|2.937693|2.441146|2.201712|2.288384|2.714335|3.826332|5.198422|8.065555|8.196363|8.164090|14.106981|14.933111|53.358707| |3.909665|3.995458|4.871383|5.210790|3.587215|2.867999|2.513961|2.588880|3.123650|4.298258|7.564254|12.063727|12.574211|7.924873|8.091135|9.656996|17.753147|36.858105| |3.800131|3.798069|4.505473|4.875698|3.354481|2.716812|2.401054|2.477450|2.970733|4.118095|6.712711|11.779754|8.804956|6.033776|6.199500|8.165236|12.427595|17.512209|0.500000| |3.122441|3.340467|4.146438|4.856793|3.605448|2.920789|2.486647|2.471764|2.879317|3.797665|6.030199|11.252420|7.378741|5.417310|5.521459|7.498578|10.554613|12.455437|0.249445|36.858105| |2.901958|3.166964|3.910739|4.787289|3.655631|3.008715|2.542268|2.491443|2.852106|3.697766|5.216691|9.279055|6.123685|5.106940|5.084358|7.230569|8.372918|7.477144|0.155376|13.619788|36.858105| |2.430690|2.660117|3.209668|4.147125|3.300036|2.832876|2.382272|2.279998|2.522873|3.221105|3.994020|7.475803|4.298720|3.746488|3.763130|5.721816|5.962562|5.003120|0.117024|7.935018|13.866354|36.858105| |2.205531|2.394055|2.853431|3.726976|2.993080|2.616690|2.206211|2.097331|2.292549|2.927179|3.523818|6.937669|3.665297|3.144409|3.195717|4.936029|5.176672|4.400756|0.111171|6.803772|7.887289|13.649678|36.858105| |2.297987|2.467358|2.943250|3.762961|2.969332|2.561449|2.171609|2.087077|2.308164|2.977291|3.748457|7.662538|3.891740|3.215478|3.298245|5.021202|5.590350|4.991241|0.134076|7.886693|6.869794|7.980308|13.801888|36.858105| |2.692450|2.864347|3.468205|4.232247|3.226581|2.692175|2.293119|2.248708|2.557350|3.349092|4.731148|9.710217|5.130873|3.979529|4.106082|5.975222|7.493076|7.549925|0.207265|13.827263|7.973775|6.933467|7.924193|13.657633|36.858105| |2.058277|2.188716|2.552649|3.307400|2.607396|2.305481|1.980461|1.899310|2.071232|2.679819|3.135415|6.443447|3.179603|2.684159|2.758503|4.306863|4.564221|3.929704|0.111998|5.276431|4.614988|5.197070|7.862210|14.024426|8.181356|73.516695| |1.815747|1.936567|2.229192|2.957393|2.361807|2.146542|1.853317|1.758026|1.880393|2.417544|2.636706|5.327411|2.639982|2.295053|2.343061|3.738256|3.735142|3.101915|0.086816|3.972555|3.786373|4.503979|6.714097|7.986866|5.254400|24.222195|36.858105| |1.669734|1.763507|1.995715|2.652794|2.096928|1.931206|1.693424|1.613134|1.714027|2.217934|2.315845|4.660032|2.300967|2.020050|2.063357|3.331816|3.250510|2.662773|0.076591|3.197189|2.977194|3.336753|4.401435|5.225759|4.091617|14.405975|12.522465|36.858105| |1.481806|1.563428|1.748261|2.351843|1.862777|1.749299|1.549357|1.469727|1.540956|1.991877|1.980948|3.918458|1.964413|1.759615|1.793297|2.937937|2.762838|2.215562|0.062913|2.600184|2.505990|2.830028|3.567863|3.858379|3.133751|9.027439|7.402368|12.405853|36.858105| |1.453500|1.551431|1.739546|2.381971|1.917084|1.826977|1.610165|1.508116|1.562532|1.997953|1.945006|3.862741|1.896412|1.699279|1.702771|2.787102|2.585097|2.088984|0.058686|2.449316|2.414033|2.756504|3.413044|3.518467|2.872943|7.676731|6.081968|7.455174|12.425293|36.858105| |1.380105|1.443485|1.594036|2.139987|1.676644|1.583566|1.420853|1.356248|1.418336|1.846037|1.786450|3.508831|1.770583|1.597880|1.631405|2.693665|2.495195|1.981759|0.056982|2.251744|2.142741|2.345457|2.831911|3.098132|2.667950|6.978905|4.885751|7.575495|12.435658|7.574880|36.858105| |2.914269|2.780702|3.047445|3.496834|2.438502|2.086251|1.897868|1.955339|2.258444|3.170858|3.812662|6.318238|5.117493|5.116038|7.802393|12.017107|17.966598|7.431604|0.189158|6.041073|4.959679|3.933357|3.615400|3.975908|5.084721|6.000392|2.770749|2.444203|2.078076|1.904521|1.890452|36.858105| |2.474629|2.411769|2.640595|3.138095|2.236511|1.948246|1.771782|1.803754|2.042462|2.827767|3.192212|5.373555|4.057583|4.176852|5.907598|10.206760|10.402690|5.321522|0.130761|5.244386|4.946123|4.177090|3.779746|3.910798|4.542630|5.873701|2.801850|2.433527|2.103814|1.924691|1.895201|12.446662|36.858105| |2.120448|2.051736|2.207340|2.671507|1.914712|1.698327|1.559268|1.583680|1.767705|2.449789|2.593197|4.457375|3.126862|3.186319|4.173487|7.581284|6.787883|3.909275|0.103362|3.902587|3.670106|3.342176|3.210493|3.363079|3.710434|5.374718|2.631904|2.355914|2.064760|1.859847|1.889651|7.562303|12.545832|36.858105| |1.896216|1.856341|1.993738|2.459245|1.782169|1.600914|1.472529|1.485315|1.637305|2.251689|2.297362|3.968798|2.700312|2.770397|3.464870|6.381583|5.321490|3.232479|0.084343|3.366866|3.360303|3.214025|3.083886|3.090719|3.226659|4.981567|2.531551|2.258808|2.025295|1.832537|1.846213|5.092069|7.998411|13.604374|73.516695| |1.690696|1.649559|1.753922|2.183926|1.585346|1.439547|1.333394|1.343982|1.468946|2.022023|1.989695|3.465852|2.283927|2.330305|2.821144|5.220820|4.245085|2.674167|0.071608|2.762331|2.729137|2.663453|2.627022|2.657183|2.726339|4.445500|2.309803|2.118400|1.932367|1.737874|1.791265|3.924030|5.209272|8.148556|24.426107|36.858105| |6.381687|5.988924|5.950643|6.028737|3.644985|3.000414|2.841534|3.157233|4.004859|6.117394|5.968724|7.713583|7.882846|15.722721|7.952299|11.734353|7.487984|5.288432|0.122342|4.116857|4.107362|3.211368|2.714434|2.719300|3.213869|4.123562|2.032288|1.806905|1.598875|1.558468|1.460329|3.981300|3.457584|2.754237|4.379576|2.108919|73.516695| |17.615883|8.897936|6.880892|6.403867|3.621376|2.982167|2.906443|3.371456|4.485190|7.741441|6.243092|8.423405|6.364813|6.530625|4.824361|7.342042|5.794867|4.627379|0.128060|3.485997|3.122469|2.570034|2.344278|2.486672|2.988341|3.949124|1.930881|1.775313|1.560239|1.516018|1.453439|3.366873|2.754512|2.342154|3.655892|1.824303|11.708127|0.500000| |17.551574|9.009386|5.710927|6.163293|3.433968|2.972590|3.076524|3.770566|4.971137|9.850711|4.512009|6.644147|4.199235|4.305711|3.407559|5.509082|4.172626|3.290672|0.091335|2.707243|2.514831|2.156772|1.990347|2.081591|2.404785|3.372386|1.687770|1.571228|1.402694|1.378141|1.317083|2.567640|2.202249|1.927629|3.080661|1.563998|8.387867|0.299572|0.500000| |17.609040|8.948190|5.994371|6.173509|3.458490|2.951275|2.995319|3.597364|4.748291|8.900347|4.842585|6.679014|4.958560|5.866234|4.308640|7.019184|4.867529|3.674753|0.096464|2.967751|2.832167|2.375110|2.128620|2.184893|2.532347|3.465180|1.731847|1.587337|1.417850|1.390464|1.319225|2.892771|2.497229|2.134630|3.415745|1.709574|13.388886|0.302871|0.299802|0.500000| |3.575710|4.761906|6.937271|12.546522|17.832056|8.893189|5.592843|4.948940|5.728822|6.061001|7.015388|14.724156|4.894434|3.898983|3.132313|4.708147|4.388686|4.089558|0.105246|4.313414|4.370814|3.941089|3.571601|3.546430|3.858631|5.414792|2.720992|2.368755|2.073367|2.132158|1.841638|2.662135|2.441482|2.071282|3.417019|1.698276|6.484827|0.097861|0.088200|0.090093|0.500000| |2.734209|3.474456|4.150241|7.816429|9.094471|17.745211|8.726076|5.634043|4.961502|5.058248|3.758672|7.199427|3.036518|2.687051|2.271475|3.591573|3.111944|2.672403|0.070543|2.806744|2.926563|2.849990|2.673376|2.584849|2.643240|4.172405|2.223065|1.996707|1.823044|1.932795|1.641307|1.984975|1.877572|1.648537|2.784011|1.413032|4.729925|0.072218|0.071106|0.070914|0.213282|0.500000| |2.753323|3.470436|3.676412|6.800799|5.655368|8.775672|17.706011|9.037820|5.638570|5.688925|3.058544|5.457646|2.558187|2.385179|2.013209|3.260967|2.674062|2.211028|0.058957|2.208006|2.268144|2.164179|2.024431|1.983127|2.063700|3.252470|1.734891|1.596933|1.477274|1.545853|1.360208|1.719804|1.621090|1.441058|2.436237|1.248836|4.391002|0.069705|0.074263|0.072214|0.123191|0.211205|0.500000| |3.648577|4.719214|4.367337|7.712309|4.940103|5.591179|8.936408|17.749700|8.863915|9.389718|3.303440|5.524173|2.781048|2.677640|2.201119|3.586545|2.839008|2.312391|0.061860|2.194389|2.208100|2.032265|1.879713|1.872364|2.009689|3.056445|1.600464|1.480898|1.358573|1.391906|1.262362|1.804007|1.670023|1.479583|2.474329|1.266915|5.129611|0.086769|0.101549|0.095358|0.107541|0.123073|0.213804|0.500000| |3.120122|3.410976|4.179719|5.050719|3.753170|3.082499|2.639815|2.620663|3.029426|3.959147|5.367302|8.743083|6.621587|6.067931|5.814125|8.209592|8.569922|6.948774|0.140353|8.886266|17.735605|8.946190|5.622908|4.951816|5.665480|6.510741|3.130285|2.550719|2.201991|2.141644|1.913293|4.794547|4.821446|3.525168|5.796624|2.642314|8.752075|0.092066|0.073901|0.086478|0.120697|0.081914|0.065094|0.064573|0.500000| |2.276523|2.497300|2.962762|3.916455|3.138366|2.765807|2.343402|2.226945|2.424247|3.080603|3.510868|6.409219|3.731165|3.413252|3.400790|5.333294|5.108138|4.078623|0.096557|5.641657|8.966153|17.695400|8.924532|5.672379|4.981576|7.447304|3.901200|2.976484|2.624951|2.608745|2.186390|3.405882|3.722169|3.049429|5.397233|2.541017|5.398223|0.065790|0.056362|0.062573|0.101671|0.078066|0.059696|0.055403|0.215853|0.500000| |1.975243|2.140676|2.508870|3.344566|2.709952|2.437709|2.070288|1.950609|2.093758|2.664226|2.985021|5.837313|3.053459|2.691627|2.730790|4.324062|4.290808|3.526671|0.090990|4.918872|5.638493|8.899837|17.751804|8.868480|5.622228|12.448296|7.412174|4.666806|3.951902|3.867743|3.026772|3.060258|3.257464|2.880978|5.069335|2.487391|4.235499|0.057731|0.050037|0.053174|0.088218|0.070308|0.053462|0.048882|0.124160|0.216337|0.500000| |2.693803|2.815761|3.345794|4.045671|3.030363|2.546363|2.199257|2.175825|2.478490|3.284733|4.507130|9.386589|4.795222|3.725232|3.860171|5.683471|7.024663|6.978373|0.229467|8.913406|5.646704|4.984493|5.665000|8.970612|17.724411|13.545474|4.891138|4.135077|3.114507|2.804711|2.727009|4.962030|4.184657|3.575545|5.410747|2.632494|5.385529|0.084265|0.067649|0.069470|0.098589|0.069060|0.055103|0.054354|0.124069|0.108030|0.124202|0.500000| |1.732163|1.834521|2.093398|2.768495|2.193766|2.004124|1.745605|1.662045|1.774453|2.293255|2.456232|4.834822|2.509806|2.229066|2.312775|3.734159|3.669298|2.950635|0.081118|3.767958|3.731223|4.576357|6.771553|7.029144|4.742749|16.533948|17.506507|8.839509|6.835176|5.533868|4.576177|2.771766|2.904926|2.767463|4.851256|2.495050|3.524235|0.051059|0.044655|0.046338|0.069480|0.057522|0.045544|0.042232|0.086465|0.113094|0.227509|0.119610|0.500000| |1.824293|1.974425|2.291082|3.098052|2.528905|2.317813|1.975882|1.848574|1.959893|2.486714|2.682763|5.477817|2.625762|2.275253|2.273191|3.617737|3.560001|2.993725|0.082617|3.840274|3.794026|4.641694|6.856660|7.177730|4.844300|16.598470|17.554689|8.789791|6.594098|6.621214|4.421976|2.570878|2.591318|2.396079|4.122260|2.109423|3.613224|0.053382|0.047101|0.048279|0.081669|0.067720|0.051505|0.046514|0.087774|0.114181|0.225519|0.122164|0.301287|0.500000| |1.719613|1.825200|2.070949|2.766550|2.195949|2.023159|1.768694|1.680617|1.784079|2.300217|2.398636|4.912797|2.337125|2.028054|2.041863|3.278191|3.204383|2.674283|0.078072|3.158142|2.887798|3.156753|4.044893|4.908264|4.044388|13.009918|8.926005|17.521970|8.808357|6.818736|6.835343|2.372312|2.307453|2.211955|3.722925|1.960356|3.228318|0.050779|0.045138|0.045040|0.069005|0.058184|0.046290|0.042767|0.069099|0.077951|0.115155|0.117131|0.174004|0.214125|0.500000| |1.661678|1.733014|1.945519|2.551449|1.985027|1.818534|1.609523|1.549313|1.656669|2.166396|2.266135|4.505926|2.289460|2.022111|2.099662|3.406531|3.338986|2.693718|0.078479|3.179016|2.900040|3.169646|4.075629|4.980248|4.091976|13.511637|8.997916|17.540550|8.845622|5.470711|7.113870|2.572026|2.557293|2.527678|4.275322|2.276512|3.201484|0.049423|0.043473|0.043943|0.061833|0.051670|0.042081|0.039670|0.069277|0.078127|0.115925|0.118657|0.211712|0.174459|0.303736|0.500000| |1.439403|1.512213|1.685099|2.258513|1.780377|1.671852|1.486602|1.414416|1.483957|1.924850|1.907415|3.722362|1.916466|1.735732|1.787051|2.947694|2.749157|2.168867|0.060947|2.553723|2.501281|2.860508|3.596454|3.760675|3.033720|8.463593|6.888105|8.901997|17.482228|8.916885|8.935951|2.089757|2.158166|2.140379|3.792893|2.047459|2.807703|0.042079|0.037757|0.038504|0.054872|0.048274|0.039400|0.036400|0.061240|0.074566|0.113251|0.082378|0.208762|0.165935|0.173839|0.212391|0.500000| |1.343616|1.428907|1.587810|2.180051|1.746750|1.680708|1.496042|1.402615|1.444226|1.851202|1.754625|3.444170|1.715434|1.554786|1.560290|2.575165|2.345762|1.872239|0.052459|2.161603|2.148095|2.434155|2.923605|2.960368|2.480271|6.219552|4.616756|5.448542|8.774762|17.535061|7.007150|1.733861|1.762085|1.717419|3.034391|1.634432|2.554660|0.038777|0.035521|0.035840|0.053362|0.049408|0.040156|0.036165|0.053688|0.065036|0.091663|0.067371|0.123825|0.136129|0.140061|0.122972|0.212013|0.500000| |1.504540|1.616973|1.826186|2.512823|2.042338|1.946182|1.700119|1.582644|1.638276|2.082494|2.046548|4.064625|1.994270|1.785470|1.782379|2.908510|2.702268|2.190679|0.060713|2.615683|2.634863|3.094541|3.893700|3.839729|3.045198|8.102626|6.664654|6.683967|8.709782|17.563709|5.484536|1.974141|2.011691|1.921039|3.383564|1.786882|2.910734|0.043471|0.039422|0.040080|0.063569|0.057578|0.045290|0.040404|0.064618|0.082151|0.128047|0.080418|0.172959|0.226819|0.165942|0.137544|0.213615|0.302481|0.500000| |1.484348|1.591615|1.787298|2.462710|1.992419|1.905807|1.675592|1.563207|1.614784|2.056458|1.990888|3.997910|1.913634|1.701780|1.687840|2.751121|2.556440|2.090155|0.059191|2.426862|2.363144|2.651215|3.235978|3.407941|2.848449|7.409841|5.468334|6.802409|8.770043|17.522495|6.785389|1.865349|1.856436|1.782199|3.089131|1.643796|2.778013|0.042951|0.039232|0.039215|0.061546|0.056222|0.044727|0.040018|0.058395|0.069238|0.098785|0.078322|0.130147|0.170110|0.203573|0.140359|0.173558|0.301452|0.301718|0.500000| |1.377834|1.429036|1.571099|2.089298|1.620590|1.521907|1.371972|1.319378|1.387379|1.818688|1.767281|3.448007|1.770367|1.603831|1.654964|2.742420|2.543968|2.000975|0.057895|2.254652|2.123609|2.297952|2.755907|3.060274|2.678746|6.899325|4.594615|6.929783|8.756015|5.490647|17.544039|1.955600|1.961651|1.984848|3.438646|1.894050|2.598014|0.040501|0.036531|0.036630|0.049323|0.043476|0.036387|0.034185|0.052712|0.059194|0.080509|0.077019|0.122639|0.110653|0.168992|0.215081|0.213509|0.142217|0.122379|0.138971|0.500000| |1.285193|1.343397|1.475086|1.990105|1.559170|1.485370|1.340451|1.277886|1.328090|1.728477|1.636022|3.186304|1.621600|1.477159|1.506378|2.503735|2.280397|1.795263|0.051254|2.024378|1.953184|2.141279|2.538439|2.700590|2.346964|5.836687|4.030239|5.489765|8.758336|6.933240|17.534530|1.725391|1.742440|1.744106|3.060963|1.682502|2.417806|0.037413|0.034153|0.034253|0.047239|0.042878|0.035840|0.033166|0.048959|0.056276|0.076041|0.065986|0.108977|0.105147|0.139711|0.143621|0.213502|0.211543|0.141811|0.168077|0.301394|0.500000| |1.399235|1.466789|1.619309|2.181469|1.711594|1.620112|1.454002|1.386190|1.447132|1.880373|1.808731|3.580510|1.773016|1.590618|1.610045|2.649259|2.456780|1.970517|0.057135|2.217089|2.089067|2.257459|2.698634|2.991577|2.627135|6.708892|4.491008|6.843650|8.771646|6.837183|17.523438|1.844904|1.822564|1.803877|3.101885|1.686578|2.587344|0.040911|0.037236|0.036962|0.052142|0.046680|0.038690|0.035833|0.051948|0.058229|0.078787|0.075642|0.111614|0.116476|0.202332|0.174741|0.173708|0.172065|0.139034|0.200375|0.301568|0.301452|0.500000| |2.765492|2.669011|2.954162|3.424760|2.417310|2.070224|1.871729|1.914812|2.200278|3.062802|3.745625|6.491460|4.767768|4.394117|5.806363|8.855855|12.629371|7.301996|0.213463|6.303319|4.778729|3.919023|3.808068|4.453798|5.920837|6.868034|3.070216|2.728843|2.271411|2.049262|2.069817|17.556150|8.829892|6.873041|8.364234|3.792957|6.177042|0.088955|0.068640|0.074592|0.074006|0.055050|0.047199|0.048976|0.120862|0.092168|0.089035|0.171786|0.084284|0.077549|0.073694|0.081088|0.063063|0.051446|0.058555|0.055852|0.059929|0.051924|0.056197|0.500000| |2.908790|2.686323|2.849928|3.265042|2.245298|1.940642|1.793120|1.866271|2.152784|3.072848|3.431499|5.613914|4.494761|4.749642|7.284548|12.861030|12.596231|5.780731|0.156319|4.592867|3.926133|3.226159|2.998331|3.264479|4.018868|5.113341|2.418919|2.186054|1.886079|1.733314|1.742261|17.549970|8.863072|6.989448|8.422936|3.829116|6.849000|0.093980|0.071901|0.081045|0.066869|0.051075|0.045301|0.048299|0.108694|0.079895|0.072411|0.112618|0.067149|0.062663|0.059294|0.064084|0.052635|0.044192|0.049558|0.047311|0.050225|0.044434|0.047399|0.302166|0.500000| |2.510276|2.432070|2.628626|3.125593|2.209655|1.933576|1.772896|1.814652|2.054115|2.860685|3.099564|5.089966|3.963799|4.361573|6.380367|12.195815|9.522478|4.789269|0.114641|4.589080|4.633353|3.902733|3.402480|3.388027|3.848215|5.104448|2.496702|2.177733|1.915428|1.778583|1.730937|8.883480|17.590877|8.921364|12.885208|4.846888|6.595932|0.076724|0.061742|0.071803|0.066217|0.051550|0.045093|0.046851|0.134711|0.100542|0.082818|0.097890|0.071946|0.065367|0.057650|0.062772|0.054613|0.045558|0.051832|0.047734|0.049441|0.044592|0.046339|0.173901|0.212345|0.500000| |2.399019|2.399725|2.684392|3.236746|2.352707|2.046220|1.836171|1.846522|2.079499|2.831965|3.288290|5.658683|4.090964|4.028288|5.242602|8.548413|9.370540|5.464380|0.130944|6.172720|6.123882|5.287008|4.716874|4.747421|5.353478|6.824858|3.227960|2.711644|2.323489|2.123150|2.052479|8.830113|17.579571|8.919570|12.979120|4.855199|5.924930|0.073375|0.059273|0.066716|0.072448|0.055249|0.046671|0.047172|0.156774|0.127450|0.110265|0.128877|0.094349|0.082585|0.070522|0.078556|0.066608|0.053604|0.062310|0.056468|0.058703|0.052222|0.054468|0.212446|0.173684|0.302212|0.500000| 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|2.117761|2.012384|2.127584|2.562800|1.815969|1.616466|1.499411|1.535155|1.715398|2.403545|2.460241|4.181198|2.963659|3.091796|4.087996|7.792675|6.318516|3.587756|0.096480|3.407297|3.183280|2.872109|2.749397|2.889435|3.217091|4.691796|2.317786|2.115211|1.870917|1.695697|1.736607|6.885760|8.833038|17.466039|16.563722|7.345719|4.822624|0.065166|0.053769|0.059586|0.053968|0.043369|0.038539|0.040084|0.086854|0.073642|0.069138|0.088110|0.066873|0.059162|0.055807|0.062942|0.053532|0.043751|0.048366|0.045433|0.050700|0.044731|0.046360|0.169137|0.209654|0.213327|0.173806|0.301284|0.500000| 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