Version2.4 2021-06-07T05:16:43Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 28-Sep-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE C[C@@H](C(=O)[O-])NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1Cc2c3ccccc3[nH]c2[C@@H]4N1C(=O)c5c4cccc5 C38570445 RHF 6-31G(d) (6D,7F) C[C@@H](C(=O)[O-])NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1Cc2c3ccccc3[nH]c2[C@@H]4N1C(=O)c5c4cccc5 C01[X(C27H27N4O5)] 183 C1 594 CC([C@@H](C(=O)N[C@H](C(=O)[O-])C)NC(=O)[C@@H]1Cc2c([C@@H]3N1C(=O)c1c3cccc1)[nH]c1c2cccc1)C CC([C@@H](C(=O)N[C@H](C(=O)[O-])C)NC(=O)[C@@H]1Cc2c([C@@H]3N1C(=O)c1c3cccc1)[nH]c1c2cccc1)C CC(C)[C@H](NC(=O)[C@@H]1Cc2c([nH]c3ccccc23)[C@@H]4N1C(=O)c5ccccc45)C(=O)N[C@@H](C)C([O-])=O InChIKey=WPMOEVMARARLFO-PCUYSCTGSA-M InChI=1S/C27H28N4O5/c1-13(2)21(25(33)28-14(3)27(35)36)30-24(32)20-12-18-15-8-6-7-11-19(15)29-22(18)23-16-9-4-5-10-17(16)26(34)31(20)23/h4-11,13-14,20-21,23,29H,12H2,1-3H3,(H,28,33)(H,30,32)(H,35,36)/p-1/t14-,20-,21-,23+/m0/s1 InChI=1/C27H28N4O5/c1-13(2)21(25(33)28-14(3)27(35)36)30-24(32)20-12-18-15-8-6-7-11-19(15)29-22(18)23-16-9-4-5-10-17(16)26(34)31(20)23/h4-11,13-14,20-21,23,29H,12H2,1-3H3,(H,28,33)(H,30,32)(H,35,36)/p-1/t14-,20-,21-,23+/m0/s1/fC27H27N4O5/h28,30H/q-1 C[C@@H](C(=O)[O-])NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1Cc2c3ccccc3[nH]c2[C@@H]4N1C(=O)c5c4cccc5 C01[X(C27H27N4O5)] 183 C01 594 CC([C@@H](C(=O)N[C@H](C(=O)[O-])C)NC(=O)[C@@H]1Cc2c([C@@H]3N1C(=O)c1c3cccc1)[nH]c1c2cccc1)C O=C([C@@H]1C[C]2=C([C@@H]3N1C(=O)[C]1[C]3[CH][CH][CH][CH]1)N[C]1[C]2[CH][CH][CH][CH]1)N[C@H]([C]([NH][C@H]([C]([O])=O)C)=O)C(C)C CC(C)[C@H](NC(=O)[C@@H]1CC2=C(N[C]3[CH][CH][CH][CH][C]23)[C@H]4[C]5[CH][CH][CH][CH][C]5C(=O)N14)C(=O)N[C@@H](C)C([O])=O InChIKey=KWCNIJKFMFNKQD-PCUYSCTGSA-N InChI=1S/C27H27N4O5/c1-13(2)21(25(33)28-14(3)27(35)36)30-24(32)20-12-18-15-8-6-7-11-19(15)29-22(18)23-16-9-4-5-10-17(16)26(34)31(20)23/h4-11,13-14,20-21,23,29H,12H2,1-3H3,(H,28,33)(H,30,32)/t14-,20-,21-,23+/m0/s1 InChI=1/C27H27N4O5/c1-13(2)21(25(33)28-14(3)27(35)36)30-24(32)20-12-18-15-8-6-7-11-19(15)29-22(18)23-16-9-4-5-10-17(16)26(34)31(20)23/h4-11,13-14,20-21,23,29H,12H2,1-3H3,(H,28,33)(H,30,32)/t14-,20-,21-,23+/m0/s1/f/h28,30H 3826.5987695748 -1630.4202334 1-A 20872.0577 129 465 594 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.46574 -20.44715 -20.41151 -20.32009 -20.31112 -15.54428 -15.52818 -15.49644 -15.45260 -11.28877 -11.27016 -11.23358 -11.22949 -11.21184 -11.20917 -11.20436 -11.20400 -11.20235 -11.19861 -11.19826 -11.19385 -11.18618 -11.17804 -11.17267 -11.17107 -11.16860 -11.16715 -11.16246 -11.15866 -11.15790 -11.15627 -11.14353 -11.12419 -11.11663 -11.11388 -11.08094 -1.33419 -1.31414 -1.27603 -1.24726 -1.21524 -1.20681 -1.15441 -1.12082 -1.11579 -1.09633 -1.07576 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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| 8.0918 13.3396 18.7335 32.9965 38.1204 43.8716 49.6939 64.5519 69.6449 70.9088 82.3197 100.4453 109.1797 118.1903 136.4832 148.9768 156.8827 176.6805 207.1758 210.8279 225.7476 236.7563 242.0924 252.7114 260.2734 264.7809 281.0780 296.6548 324.9307 333.6013 335.9227 344.6298 350.9444 360.8432 384.3170 408.1224 429.1300 451.8248 467.2114 477.6850 479.1527 507.2788 514.9226 528.4839 547.7615 588.4356 611.5698 623.8994 634.3446 648.0002 662.6501 675.6460 684.8343 702.1650 738.9398 748.6843 754.8300 763.9126 782.2514 797.0608 814.9329 827.9795 834.2975 838.2044 838.8728 847.2871 861.3609 872.6574 887.7508 924.6997 937.3304 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0.16259 0.06340 0.05003 11.64 19.19 26.95 47.47 54.85 63.12 71.50 92.88 100.20 102.02 118.44 144.52 157.09 170.05 196.37 214.34 225.72 254.20 298.08 303.33 324.80 340.64 348.32 363.60 374.48 380.96 404.41 426.82 467.50 479.98 483.32 495.85 504.93 519.17 552.95 587.20 617.42 650.08 672.21 687.28 689.39 729.86 740.86 760.37 788.11 846.63 879.91 897.65 912.68 932.33 953.41 972.10 985.32 1010.26 1063.17 1077.19 1086.03 1099.10 1125.49 1146.79 1172.51 1191.28 1200.37 1205.99 1206.95 1219.06 1239.31 1255.56 1277.28 1330.44 1348.61 1352.52 1357.00 1378.44 1389.47 1425.49 1431.69 1436.76 1458.60 1470.51 1486.50 1508.37 1519.31 1521.33 1557.43 1559.18 1577.23 1579.74 1605.11 1610.24 1615.31 1652.74 1686.00 1712.70 1733.18 1753.47 1753.68 1762.57 1774.68 1779.96 1789.46 1796.58 1830.76 1853.44 1866.60 1886.56 1902.04 1913.66 1927.09 1941.39 1950.50 1952.38 1979.33 2000.42 2010.91 2014.83 2018.89 2056.25 2073.10 2079.49 2106.92 2127.50 2148.25 2164.18 2172.81 2193.63 2195.45 2201.77 2207.78 2240.65 2244.74 2269.94 2277.18 2320.88 2344.47 2348.30 2354.68 2360.03 2363.15 2365.24 2368.06 2370.55 2372.09 2391.90 2393.36 2436.34 2483.94 2537.22 2578.97 2586.69 2619.66 2630.13 2705.79 2756.06 2780.50 2825.15 4596.42 4601.34 4603.31 4609.81 4612.37 4655.94 4674.55 4683.78 4688.68 4692.33 4697.48 4732.02 4736.84 4752.68 4753.91 4765.87 4817.20 4825.51 4834.58 4845.95 4850.31 4864.41 4869.14 4887.88 5437.53 5528.98 5649.63 0.546438 0.576691 0.577635 0.480325 -1629.873795 -1629.843543 -1629.842598 -1629.939908 3.263793D-04 MUNgauss RevisionA2.1 retrievium 07-Jun-2021 DUDE C[C@@H](C(=O)[O-])NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1Cc2c3ccccc3[nH]c2[C@@H]4N1C(=O)c5c4cccc5 C38570445 RHF 6-31G(d) (6D,10F) C1 487.198145 |X|Y|Z| 72.757528 120.114570 33.918183 66.675877 20 6 7 18 2 |36.858105| |12.483526|36.858105| |8.912289|17.572165|0.500000| |7.461198|12.194453|0.245256|36.858105| |5.493779|8.026239|0.173695|15.380958|73.516695| |6.551087|8.105873|0.200032|15.548042|15.153725|73.516695| |7.698845|13.071259|0.254846|7.805217|13.265228|9.545736|53.358707| |5.856093|7.707334|0.198660|5.173469|8.929402|7.167940|19.647319|36.858105| |5.634847|6.597443|0.194026|4.402621|7.199392|6.534604|11.499143|15.643007|73.516695| |4.096158|4.978179|0.129362|4.009667|7.544171|5.733505|10.667265|12.389594|14.283989|36.858105| |3.975617|4.729034|0.116738|4.038856|7.978750|5.715942|10.077540|8.771401|10.544360|17.617739|0.500000| |3.360849|4.197990|0.116073|3.644395|6.992820|5.335322|7.868112|7.485468|10.599735|12.300203|0.244427|36.858105| |3.364187|4.431364|0.121575|4.202689|8.589301|6.029325|7.951755|6.143753|8.551918|7.455605|0.191689|12.417103|36.858105| |2.694172|3.171295|0.086967|2.872118|5.549535|4.349844|5.536013|4.885641|7.543296|7.486493|0.186706|12.435470|7.595768|36.858105| |3.584582|3.961478|0.105594|3.201451|5.821255|4.801193|7.367256|8.006389|12.905323|13.104191|0.256611|7.653034|4.955602|6.515933|53.358707| |3.090995|3.271884|0.085762|2.764258|5.091063|4.220603|5.772079|5.398913|8.812916|7.697100|0.206580|5.485069|3.992277|5.569969|19.347957|36.858105| |2.873462|3.058420|0.078809|2.688740|5.090821|4.096938|5.372701|4.641764|7.221236|6.652956|0.212024|5.082994|3.949347|5.534526|11.516947|15.811080|73.516695| |2.765118|2.805430|0.074951|2.374963|4.268546|3.729494|4.625748|4.186710|7.518162|5.019177|0.131277|4.003335|3.092605|4.090455|10.782479|12.421053|14.092171|36.858105| |2.632071|2.700721|0.073885|2.281300|4.067555|3.609591|4.381594|4.032703|7.566844|4.745868|0.117924|4.029474|3.061143|4.150129|10.104835|8.927687|10.781068|17.634254|0.500000| |3.033378|2.921528|0.077380|2.428279|4.265896|3.851213|4.667598|4.111066|7.656821|4.379164|0.115888|3.407162|2.766372|3.268117|8.356016|7.461857|10.005459|12.311243|0.244952|36.858105| |2.857367|2.697549|0.069902|2.310459|4.102176|3.685050|4.246202|3.507222|6.218144|3.728961|0.105483|2.946293|2.499708|2.869176|6.380673|5.900136|9.417019|7.621484|0.155681|12.679786|36.858105| |2.939543|2.663539|0.068225|2.302963|4.045444|3.720241|4.047512|3.190423|5.648406|3.216456|0.092223|2.576097|2.268592|2.458904|5.089467|4.303917|7.210681|4.894744|0.111255|7.138132|13.176121|36.858105| |3.224875|2.787894|0.071423|2.386009|4.095047|3.908977|4.076811|3.146793|5.699993|2.999189|0.084569|2.421126|2.169229|2.253878|4.582262|3.607798|5.948080|3.962111|0.095562|5.634313|7.278087|13.643245|36.858105| |2.964096|2.535351|0.064758|2.236375|3.838576|3.725881|3.605795|2.689768|4.809222|2.554469|0.072932|2.116968|1.945879|1.980019|3.758543|2.926995|4.988621|3.112708|0.076775|4.023559|5.010304|7.971241|13.835541|36.858105| |2.571412|2.263815|0.057720|2.052065|3.586921|3.420013|3.247478|2.401857|4.209238|2.346279|0.068194|1.973488|1.830481|1.879691|3.421991|2.724653|4.800980|2.867025|0.070305|3.516859|4.549394|6.869874|7.884368|13.594696|36.858105| |2.413998|2.190230|0.055860|1.994542|3.545871|3.286387|3.222118|2.411950|4.173100|2.435552|0.071698|2.047404|1.883315|1.986422|3.600090|2.971592|5.361824|3.145870|0.075475|3.777443|5.263568|7.796983|6.750712|7.867266|13.832107|36.858105| |2.557018|2.353954|0.060136|2.103443|3.753663|3.416768|3.557793|2.736347|4.735279|2.823808|0.083034|2.326157|2.089078|2.270339|4.326884|3.717389|6.655641|4.063446|0.093650|5.070097|8.343328|13.600989|7.896309|6.932194|8.046529|13.691464|36.858105| |2.348269|2.232801|0.057416|2.010815|3.642695|3.244584|3.441915|2.688206|4.603635|2.898190|0.085962|2.414731|2.143854|2.428895|4.525593|4.107701|7.657469|4.553575|0.102183|5.179748|8.519484|8.497486|5.356929|4.643009|5.155557|7.596094|13.860482|53.358707| |2.155724|2.070565|0.053281|1.897413|3.468221|3.071277|3.178569|2.452520|4.162551|2.667364|0.079932|2.270009|2.042503|2.315671|4.069710|3.659100|7.073736|3.911647|0.090123|4.170593|5.991188|5.969051|4.280973|3.944236|4.552142|6.675111|9.051475|26.142206|0.500000| |2.485036|2.399732|0.062177|2.118062|3.832176|3.383673|3.784867|3.067935|5.294138|3.402226|0.099220|2.782595|2.387675|2.821439|5.654079|5.518279|9.887247|6.732873|0.138845|7.581595|14.150546|8.506472|5.261298|4.175662|4.186691|5.294432|8.532096|18.839530|0.250471|36.858105| |2.255985|2.249563|0.058993|2.007360|3.677448|3.198524|3.588361|2.953057|5.061975|3.447740|0.100111|2.924744|2.467492|3.124650|5.841154|6.080838|11.536501|7.516295|0.156078|6.276602|7.548120|5.147599|3.772576|3.146483|3.158841|3.810476|5.174019|10.163303|0.185981|12.685808|36.858105| |2.273181|2.301585|0.059866|2.080176|3.871984|3.288789|3.723331|3.028334|5.041353|3.649374|0.109940|3.107190|2.640843|3.391096|5.964540|6.316356|14.046316|6.436396|0.137369|5.198268|6.038978|4.510193|3.425956|2.931179|2.980183|3.585943|4.672060|8.911068|0.177702|8.957724|17.593699|0.500000| |2.332523|2.356863|0.062830|2.064513|3.750968|3.281033|3.791404|3.251530|5.719351|3.867816|0.106618|3.300921|2.669120|3.562957|7.137498|7.743024|12.338743|13.158572|0.260411|7.763756|6.946613|4.574141|3.568591|2.912174|2.799516|3.190625|4.154536|6.974275|0.125727|7.949336|13.045015|0.253270|53.358707| |2.041997|2.062780|0.055814|1.825968|3.299853|2.940903|3.235897|2.744409|4.931671|3.172457|0.085935|2.857604|2.351282|3.126663|5.578359|5.258523|8.541618|7.762791|0.212586|5.666317|5.068119|3.712862|3.040146|2.552270|2.467062|2.771958|3.452721|5.631389|0.105379|5.621915|8.065248|0.171704|19.047773|36.858105| |1.982922|2.014312|0.055304|1.776449|3.187834|2.875493|3.129955|2.680851|4.928794|3.056444|0.080496|2.831733|2.315509|3.093099|5.362823|4.677158|7.306497|6.643472|0.219372|5.027376|4.202224|3.225674|2.762697|2.334737|2.224230|2.433414|2.943754|4.564024|0.085773|4.310350|5.415386|0.126217|11.320632|15.876131|73.516695| |1.837266|1.841121|0.049502|1.659780|3.013127|2.693256|2.848060|2.342873|4.152980|2.665131|0.074208|2.424580|2.066254|2.650892|4.417429|4.060460|7.150692|5.214896|0.135135|4.397214|4.487373|3.502255|2.845431|2.464822|2.462651|2.836141|3.483744|5.943730|0.116674|5.488703|8.071877|0.172213|11.400841|12.828772|14.058628|36.858105| |1.919683|1.910979|0.050679|1.731241|3.162073|2.798312|2.971787|2.409720|4.191739|2.746571|0.078647|2.441369|2.105171|2.641282|4.479057|4.237976|7.886721|5.162385|0.123107|4.552395|5.201186|4.053849|3.147848|2.738293|2.807778|3.371009|4.271036|8.063050|0.163553|7.420422|12.567219|0.246045|11.213354|8.165635|9.706114|13.820381|36.858105| |1.742741|1.726526|0.045693|1.588676|2.908419|2.588168|2.645998|2.098655|3.633412|2.351245|0.068043|2.119756|1.876525|2.280792|3.681423|3.329173|6.325683|3.790657|0.093187|3.538361|4.140793|3.554489|2.836605|2.570020|2.726424|3.323949|3.991494|7.459312|0.169020|5.663513|7.224017|0.177235|7.046001|5.222127|7.136900|7.959606|13.758821|36.858105| |1.559392|1.547613|0.041312|1.432001|2.612681|2.351536|2.343063|1.853673|3.239619|2.054909|0.058739|1.893306|1.689316|2.043173|3.182965|2.782303|5.176849|3.160580|0.081188|2.960966|3.300166|2.915270|2.428258|2.234898|2.356054|2.779777|3.191387|5.464400|0.120348|4.118454|4.952654|0.124661|5.612533|4.535026|6.630928|6.974098|8.009910|13.744211|36.858105| |1.514439|1.509907|0.040674|1.390696|2.526293|2.288177|2.280885|1.822836|3.222572|2.019808|0.056796|1.885163|1.668637|2.046864|3.160484|2.729160|4.946335|3.172430|0.084402|2.917859|3.092516|2.688107|2.281388|2.078686|2.140194|2.454657|2.817728|4.634423|0.097307|3.671824|4.471360|0.110441|5.630755|5.015970|7.632475|8.038608|6.887353|7.864487|13.677621|36.858105| |1.625582|1.628207|0.044058|1.483151|2.687153|2.429225|2.479100|2.014845|3.590925|2.253415|0.062524|2.100430|1.823390|2.295450|3.620459|3.163425|5.589929|3.845743|0.104457|3.404836|3.458047|2.879975|2.430247|2.161812|2.176062|2.469846|2.905665|4.758197|0.096042|4.031900|5.165884|0.122237|7.158116|7.368238|10.998208|13.775721|7.878964|6.780494|7.914536|13.770630|36.858105| |17.527083|8.818507|0.173873|6.782626|9.769816|10.423263|9.488332|5.262204|8.523571|3.964401|0.112292|3.194052|3.205962|2.623534|4.754794|3.120346|5.278510|2.775695|0.071863|3.070759|3.001523|3.165947|3.485998|3.261642|2.847160|2.658355|2.785349|3.436712|0.064465|2.625513|2.346481|0.066134|3.229369|2.056936|3.501987|1.871488|1.984503|1.812920|1.610278|1.548139|1.650262|0.500000| |17.604776|8.897053|0.214722|6.920325|8.761761|12.922002|7.637022|4.524047|8.014375|3.369025|0.090871|2.902601|2.959059|2.377683|4.088193|2.635717|4.392226|2.407360|0.064367|2.629879|2.497096|2.592752|2.869853|2.709818|2.367984|2.201194|2.290483|2.860983|0.054031|2.198480|2.007194|0.056011|2.816214|1.841155|3.198049|1.671508|1.738099|1.592976|1.438703|1.400491|1.495490|0.300885|0.500000| |17.546966|8.793374|0.213600|5.437640|7.772632|8.670899|9.414021|6.171356|11.765687|4.227232|0.110264|3.389766|3.232360|2.730055|5.300647|3.323664|5.327589|3.045503|0.080910|3.446721|3.162175|3.245540|3.636067|3.240053|2.728094|2.544235|2.733287|3.386715|0.062570|2.671294|2.398723|0.066100|3.423737|2.198395|3.812832|1.955540|2.030969|1.825847|1.631819|1.592310|1.721938|0.300211|0.299047|0.500000| |6.117827|9.337300|0.190848|8.068126|17.108356|9.461634|25.886617|9.392454|10.779694|7.384878|0.223681|5.802674|6.511243|4.190546|6.723669|4.068423|7.099946|3.195980|0.083221|3.150031|2.951690|2.818399|2.789553|2.509073|2.311479|2.320502|2.545380|3.392916|0.064820|2.708177|2.598085|0.076392|3.667437|2.297904|3.916793|2.048901|2.157036|1.936993|1.712293|1.656356|1.787472|0.169453|0.133242|0.147460|0.500000| |3.308286|4.104253|0.119839|3.474283|6.380497|5.210305|7.198480|7.125698|11.617583|8.926075|0.174602|17.508466|8.881231|8.906291|9.455120|4.879267|7.627632|3.849852|0.112618|3.328235|2.804628|2.459420|2.345188|2.046526|1.889239|1.940882|2.196701|3.075793|0.058714|2.607278|2.724008|0.078372|4.271534|2.787375|5.044722|2.340394|2.312500|2.006193|1.812226|1.825679|2.046963|0.084930|0.080434|0.094584|0.137969|0.500000| |3.240320|4.158672|0.108793|4.142300|8.999379|5.906453|7.473992|5.381148|7.387222|6.734712|0.203654|8.767639|17.523694|6.881498|6.252199|3.936220|7.316862|3.010041|0.080746|2.696623|2.506073|2.289180|2.169944|1.962571|1.868832|1.937482|2.141747|3.009213|0.059043|2.434770|2.518916|0.076340|3.615340|2.318802|3.991503|2.070017|2.141936|1.925147|1.722840|1.684067|1.823749|0.088669|0.079135|0.085153|0.185817|0.173224|0.500000| |2.888825|3.683927|0.104158|3.593746|7.195648|5.383137|6.080609|4.693424|7.096914|5.453766|0.140623|8.820450|17.538131|7.012539|5.588566|3.431128|6.048547|2.764178|0.077350|2.462847|2.230812|2.029206|1.943282|1.757163|1.661895|1.709952|1.884323|2.643050|0.051741|2.151327|2.248122|0.066546|3.318342|2.196897|3.890810|1.942738|1.958132|1.757443|1.600587|1.591826|1.736606|0.076236|0.072482|0.077514|0.133926|0.213389|0.301932|0.500000| |3.893843|5.540307|0.154677|5.306812|10.793849|7.342752|9.720418|6.810183|9.353245|6.736182|0.170705|8.661508|17.613590|5.481337|6.172605|3.620979|6.243051|2.889224|0.079368|2.680304|2.427253|2.245266|2.189812|1.974769|1.841219|1.868593|2.052898|2.817034|0.054524|2.281820|2.304274|0.067642|3.369348|2.187474|3.838134|1.931340|1.972002|1.767888|1.594917|1.572985|1.711597|0.100465|0.095049|0.101358|0.219722|0.210094|0.302987|0.302000|0.500000| |2.568907|2.930345|0.080850|2.604466|4.913347|4.003168|5.016985|4.558624|7.441414|6.762839|0.163499|8.731333|5.496795|17.591834|9.882826|6.476007|10.752885|4.846645|0.142030|3.640915|3.103668|2.587505|2.341898|2.032758|1.924752|2.046184|2.370467|3.493680|0.067520|3.056872|3.483987|0.103402|5.692759|3.691215|6.593557|3.017672|2.937626|2.478838|2.220318|2.253608|2.581209|0.069462|0.063094|0.073818|0.102104|0.214056|0.139716|0.143044|0.122041|0.500000| |2.436150|2.870281|0.080095|2.666102|5.145988|4.104863|4.791956|4.059589|6.479953|5.463350|0.138970|8.819678|7.054383|17.530637|6.589978|4.260787|7.556680|3.386014|0.097190|2.785216|2.474642|2.158473|2.001121|1.781163|1.697824|1.784943|2.011689|2.915988|0.057219|2.445474|2.700148|0.080647|4.141845|2.769035|4.952281|2.390748|2.356852|2.069193|1.884996|1.901592|2.117869|0.065497|0.060816|0.068072|0.101054|0.212376|0.173568|0.215570|0.142770|0.301860|0.500000| |2.619753|3.046729|0.081373|2.826579|5.591691|4.267465|5.334706|4.470052|6.715514|6.812537|0.199191|8.767221|6.810918|17.547477|7.998451|5.580812|11.086266|3.990925|0.107472|3.200104|2.915993|2.507981|2.269592|2.007835|1.931523|2.064299|2.359439|3.480233|0.068511|2.942887|3.294436|0.102984|4.917084|3.113766|5.311025|2.706404|2.762128|2.404400|2.131521|2.104215|2.331927|0.072437|0.064161|0.072865|0.116623|0.173464|0.202181|0.169808|0.139122|0.301928|0.301050|0.500000| |3.696337|3.998735|0.110077|3.136580|5.519139|4.780837|7.060507|7.932846|15.740738|9.245595|0.184084|6.422165|4.398252|5.329095|25.992698|9.389189|10.833155|7.598530|0.221639|6.511867|4.599691|3.713635|3.447493|2.794800|2.491625|2.574343|3.073153|4.272526|0.077692|3.898270|3.915391|0.106458|6.648926|3.994682|7.093946|3.124492|3.096290|2.553877|2.239407|2.250591|2.593245|0.097277|0.086427|0.115829|0.125032|0.185159|0.109975|0.104250|0.116784|0.166422|0.118218|0.129580|0.500000| |3.631026|3.443462|0.090825|2.757252|4.766040|4.336547|5.545518|5.024558|9.686262|4.994198|0.128300|3.703227|3.000584|3.365801|9.413177|7.165816|9.432872|8.758339|0.201431|17.563006|8.895038|6.573627|5.905270|4.160108|3.493343|3.592622|4.591792|5.996334|0.101086|5.752462|4.828611|0.120159|7.681895|4.391700|7.287291|3.537540|3.660066|2.983995|2.546142|2.504698|2.861046|0.100921|0.085455|0.118638|0.100418|0.101389|0.080287|0.073071|0.082337|0.101718|0.079344|0.090264|0.218939|0.500000| |2.753936|2.633209|0.071078|2.205466|3.837521|3.554953|4.068958|3.537759|6.822603|3.663371|0.095515|3.004875|2.474403|2.905507|6.676568|5.534782|7.797280|8.847278|0.226273|17.525181|8.894217|6.102198|5.203388|3.810190|3.307432|3.482427|4.491353|6.145718|0.103232|6.126876|5.325183|0.120513|9.122166|5.712439|9.589384|4.409456|4.307757|3.391842|2.931764|2.965501|3.509733|0.076376|0.067726|0.087367|0.076112|0.083675|0.066397|0.062296|0.066978|0.090360|0.070467|0.077994|0.151286|0.303540|0.500000| |3.564654|3.020920|0.078251|2.515514|4.240630|4.129921|4.362256|3.420378|6.417870|3.148355|0.086401|2.529238|2.249628|2.312420|4.840704|3.659472|5.823639|4.040074|0.100157|5.920044|6.452394|8.848597|17.712548|8.930657|5.616037|4.887917|5.613313|5.900104|0.099135|4.562382|3.479002|0.087916|4.727850|2.990717|4.957224|2.719529|2.913960|2.589820|2.253311|2.160516|2.334568|0.104251|0.087725|0.116401|0.080829|0.069100|0.061607|0.055897|0.063670|0.066865|0.057057|0.063661|0.104701|0.188363|0.156832|0.500000| |3.013551|2.519795|0.064704|2.228818|3.771863|3.769997|3.483791|2.566343|4.638835|2.384191|0.067434|1.999911|1.858239|1.854182|3.450806|2.618584|4.438726|2.755290|0.069517|3.481795|4.035855|5.656773|8.957107|17.717599|8.885175|5.628208|4.982907|5.008406|0.089689|3.411255|2.696715|0.070434|3.477960|2.278346|3.772086|2.189771|2.385628|2.249789|1.993359|1.875097|1.949236|0.091671|0.078104|0.091661|0.066941|0.054153|0.051797|0.046800|0.052900|0.052586|0.046698|0.051887|0.072055|0.102384|0.093481|0.215542|0.500000| |2.385359|2.099348|0.053676|1.934657|3.378707|3.261977|2.964065|2.164454|3.789740|2.104589|0.061154|1.798851|1.690549|1.715117|3.020508|2.374255|4.211232|2.468730|0.061523|2.936824|3.620919|4.949937|5.634020|8.884732|17.708965|8.971110|5.689937|5.626703|0.106624|3.421375|2.710086|0.071980|3.299743|2.174103|3.521440|2.187060|2.467051|2.439633|2.149088|1.955776|1.967629|0.073370|0.062047|0.069354|0.058967|0.047938|0.048028|0.042895|0.047403|0.048499|0.043409|0.048973|0.061116|0.081568|0.077706|0.123979|0.215529|0.500000| |2.172606|1.998564|0.051111|1.851571|3.319664|3.063411|2.932264|2.179920|3.746978|2.225093|0.065896|1.903562|1.768085|1.868222|3.250563|2.685358|4.943581|2.807698|0.068083|3.221400|4.294304|5.569633|4.887050|5.600585|8.894427|17.702226|8.833390|9.131417|0.188311|4.609102|3.537420|0.094453|3.973754|2.581017|4.026710|2.709260|3.250135|3.347686|2.820419|2.442508|2.400733|0.066295|0.055527|0.062736|0.059358|0.049982|0.050846|0.044890|0.048535|0.053270|0.046964|0.054307|0.064084|0.084665|0.083224|0.106398|0.123724|0.214938|0.500000| |1.758529|1.734594|0.045555|1.607969|2.955340|2.619845|2.653217|2.075024|3.556374|2.311806|0.067933|2.070288|1.857086|2.207031|3.547520|3.183944|6.188725|3.482370|0.084550|3.339354|4.055446|3.638013|2.892892|2.673184|2.916863|3.662105|4.320376|8.335117|0.212074|5.630486|6.457270|0.172323|6.106971|4.245630|6.004198|5.637822|8.840311|17.713135|8.916749|5.616224|4.903758|0.051315|0.044660|0.050833|0.054338|0.053998|0.053425|0.048125|0.048776|0.065534|0.055585|0.065322|0.067877|0.079882|0.087237|0.072085|0.064567|0.072736|0.105731|0.500000| |1.461329|1.447185|0.038601|1.350224|2.465358|2.227689|2.173800|1.701351|2.966555|1.869400|0.053651|1.732120|1.566175|1.859408|2.844582|2.442564|4.567638|2.707013|0.069906|2.581214|2.887482|2.639918|2.239451|2.103730|2.247978|2.643587|2.936024|4.893529|0.110263|3.522566|4.009941|0.104705|4.595315|3.611305|5.482495|5.003617|5.678409|8.939386|17.708611|8.917060|5.643723|0.042026|0.037653|0.042254|0.044297|0.046044|0.044525|0.041354|0.041229|0.055462|0.048012|0.054019|0.055660|0.062896|0.070932|0.057557|0.052456|0.057766|0.076098|0.215981|0.500000| |1.398001|1.394240|0.037703|1.290955|2.341471|2.135406|2.088587|1.660255|2.944282|1.823823|0.051114|1.721500|1.537697|1.864622|2.817169|2.380571|4.296660|2.721033|0.073608|2.532205|2.651246|2.358020|2.045860|1.887308|1.942842|2.196315|2.463551|3.930862|0.082613|3.052986|3.571166|0.090467|4.614586|4.048531|6.531709|5.682357|4.959651|5.622032|8.906511|17.717542|8.915602|0.039592|0.036132|0.040728|0.042151|0.046559|0.043032|0.041017|0.040381|0.056667|0.048649|0.053023|0.056068|0.061504|0.072054|0.054148|0.047788|0.049879|0.061069|0.123998|0.215958|0.500000| 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