Version2.0 2020-07-27T03:16:06Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 24-Jun-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCN1C2=C([C@H](NC1=O)c3ccc(cc3C)C)C(=O)N(C2)[C@H](Cc4ccccc4)C(=O)NCCOC C35967404 RHF 6-31G(d) (6D,7F) CCN1C2=C([C@H](NC1=O)c3ccc(cc3C)C)C(=O)N(C2)[C@H](Cc4ccccc4)C(=O)NCCOC C01[X(C28H34N4O4)] 204 C1 608 COCCNC(=O)[C@H](N1CC2=C(C1=O)[C@H](NC(=O)N2CC)c1ccc(cc1C)C)Cc1ccccc1 COCCNC(=O)[C@H](N1CC2=C(C1=O)[C@H](NC(=O)N2CC)c1ccc(cc1C)C)Cc1ccccc1 CCN1C(=O)N[C@H](c2ccc(C)cc2C)C3=C1CN([C@H](Cc4ccccc4)C(=O)NCCOC)C3=O InChIKey=CVJZSBJNGBCDDR-RCZVLFRGSA-N InChI=1S/C28H34N4O4/c1-5-31-23-17-32(22(26(33)29-13-14-36-4)16-20-9-7-6-8-10-20)27(34)24(23)25(30-28(31)35)21-12-11-18(2)15-19(21)3/h6-12,15,22,25H,5,13-14,16-17H2,1-4H3,(H,29,33)(H,30,35)/t22-,25-/m1/s1 InChI=1/C28H34N4O4/c1-5-31-23-17-32(22(26(33)29-13-14-36-4)16-20-9-7-6-8-10-20)27(34)24(23)25(30-28(31)35)21-12-11-18(2)15-19(21)3/h6-12,15,22,25H,5,13-14,16-17H2,1-4H3,(H,29,33)(H,30,35)/t22-,25-/m1/s1/f/h29-30H CCN1C2=C([C@H](NC1=O)c3ccc(cc3C)C)C(=O)N(C2)[C@H](Cc4ccccc4)C(=O)NCCOC C01[X(C28H34N4O4)] 204 C01 608 COCCNC(=O)[C@H](N1CC2=C(C1=O)[C@H](NC(=O)N2CC)c1ccc(cc1C)C)Cc1ccccc1 COCC[NH][C](=O)[C@H](N1CC2=C(C1=O)[C@H](NC(=O)N2CC)[C]1[CH][CH][C]([CH][C]1C)C)C[C]1[CH][CH][CH][CH][CH]1 CCN1C(=O)N[C@H]([C]2[CH][CH][C](C)[CH][C]2C)C3=C1CN([C@H](C[C]4[CH][CH][CH][CH][CH]4)C(=O)NCCOC)C3=O InChIKey=CVJZSBJNGBCDDR-RCZVLFRGSA-N InChI=1S/C28H34N4O4/c1-5-31-23-17-32(22(26(33)29-13-14-36-4)16-20-9-7-6-8-10-20)27(34)24(23)25(30-28(31)35)21-12-11-18(2)15-19(21)3/h6-12,15,22,25H,5,13-14,16-17H2,1-4H3,(H,29,33)(H,30,35)/t22-,25-/m1/s1 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840.1807 855.7647 861.6292 878.8983 890.1513 902.9844 923.2637 929.9539 938.4968 966.0606 987.2258 992.8394 993.8146 1012.6837 1027.6784 1046.6292 1066.3928 1089.6251 1090.7304 1101.1849 1103.6318 1106.3878 1109.0409 1117.0800 1119.6834 1125.7916 1131.3752 1132.3354 1166.6937 1171.2142 1174.8845 1184.2090 1203.5116 1213.4518 1217.4302 1218.9009 1229.1622 1242.2786 1253.9758 1268.4842 1281.0249 1291.5843 1303.0302 1303.7871 1304.7868 1315.1117 1320.4874 1331.2416 1331.5431 1341.8105 1354.0457 1358.2011 1367.6434 1383.9716 1390.7000 1402.0197 1405.9574 1413.3219 1420.2484 1428.6834 1450.4503 1487.5594 1497.2446 1507.9689 1516.3380 1525.2392 1534.6676 1546.1049 1552.1291 1565.9864 1566.7026 1571.3061 1572.8330 1582.6788 1598.2044 1618.7541 1621.0277 1627.6899 1632.6112 1632.6958 1636.3149 1638.1727 1642.3833 1642.7658 1644.4416 1646.3673 1649.8131 1653.0047 1653.5066 1656.5320 1657.3047 1671.5126 1677.1182 1683.6603 1742.7756 1772.7424 1784.1640 1811.3370 1820.8469 1886.4870 1909.6325 1935.3068 1950.2966 3170.1083 3184.5597 3202.8214 3205.0072 3205.2929 3210.4491 3219.3555 3228.3302 3229.9823 3236.3277 3255.8650 3261.6353 3264.9372 3266.5396 3270.3252 3270.8775 3280.0304 3292.7842 3297.9502 3303.5705 3304.0496 3308.4251 3315.2676 3341.7280 3345.1676 3350.3277 3351.7537 3355.8752 3366.8937 3374.0885 3376.5298 3386.9296 3817.7716 3865.8099 5.2767 4.5791 5.3110 4.0919 1.4459 2.0641 4.2519 3.9118 3.7750 5.1451 4.1864 3.6831 3.6519 5.1271 3.1425 3.3969 3.9596 4.8266 3.7661 4.3852 5.8820 2.8313 1.3306 3.1197 3.4387 2.1927 1.2224 1.6931 4.0888 4.6832 4.8364 4.1267 2.1171 4.4500 3.7675 4.8384 3.0380 2.3766 3.5642 4.3559 4.3917 3.5875 2.9502 3.2511 4.2043 3.2791 4.0754 3.5498 3.3171 3.2812 2.4236 3.7921 2.9825 2.2734 3.5703 4.9954 6.2040 3.4876 3.6195 1.2607 4.3800 5.1995 2.1118 5.3316 3.7425 3.5418 2.4049 2.1827 9.2499 2.2722 2.4124 4.3729 2.9642 2.4517 2.1981 1.9156 1.2510 2.5391 2.3938 1.3023 3.6682 2.5302 1.5228 3.0309 6.1466 1.3654 2.0098 1.5234 1.7624 1.7337 2.2057 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1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 14564.0065 19292.9107 27463.0222 0.99907 0.04283 0.00544 -0.04285 0.99907 0.00426 -0.00525 -0.00449 0.99998 1 0.00595 0.00449 0.00315 0.12392 0.09354 0.06572 16.79 18.89 29.60 36.19 45.75 49.47 59.88 66.92 71.58 75.55 84.21 99.77 112.79 125.32 147.16 165.77 169.62 178.31 210.36 242.13 252.61 274.57 287.13 303.86 320.12 329.28 339.92 351.24 364.98 385.46 408.08 424.27 432.48 447.53 474.87 502.58 540.47 555.65 568.99 586.44 603.33 617.77 660.23 685.38 716.31 737.76 765.57 795.96 823.31 827.63 845.28 864.19 871.51 890.09 913.80 932.71 979.70 1002.28 1028.30 1043.33 1103.05 1120.07 1133.03 1156.72 1174.63 1184.86 1196.17 1208.83 1231.25 1239.69 1264.54 1280.73 1299.19 1328.37 1338.00 1350.29 1389.95 1420.40 1428.47 1429.88 1457.03 1478.60 1505.87 1534.30 1567.73 1569.32 1584.36 1587.88 1591.85 1595.66 1607.23 1610.97 1619.76 1627.80 1629.18 1678.61 1685.12 1690.40 1703.81 1731.58 1745.89 1751.61 1753.73 1768.49 1787.36 1804.19 1825.07 1843.11 1858.30 1874.77 1875.86 1877.30 1892.15 1899.89 1915.36 1915.79 1930.57 1948.17 1954.15 1967.73 1991.23 2000.91 2017.19 2022.86 2033.46 2043.42 2055.56 2086.87 2140.27 2154.20 2169.63 2181.67 2194.48 2208.04 2224.50 2233.17 2253.11 2254.14 2260.76 2262.96 2277.12 2299.46 2329.03 2332.30 2341.88 2348.96 2349.09 2354.29 2356.97 2363.02 2363.57 2365.98 2368.76 2373.71 2378.31 2379.03 2383.38 2384.49 2404.93 2413.00 2422.41 2507.47 2550.58 2567.01 2606.11 2619.79 2714.23 2747.54 2784.47 2806.04 4561.08 4581.87 4608.15 4611.29 4611.70 4619.12 4631.93 4644.85 4647.22 4656.35 4684.46 4692.77 4697.52 4699.82 4705.27 4706.06 4719.23 4737.58 4745.01 4753.10 4753.79 4760.09 4769.93 4808.00 4812.95 4820.37 4822.43 4828.36 4844.21 4854.56 4858.07 4873.04 5492.92 5562.04 0.632954 0.666431 0.667376 0.561745 -1596.794394 -1596.760916 -1596.759972 -1596.865603 3.542881D-04 MUNgauss RevisionA2.0 retrievium 27-Jul-2020 DUDE CCN1C2=C([C@H](NC1=O)c3ccc(cc3C)C)C(=O)N(C2)[C@H](Cc4ccccc4)C(=O)NCCOC C35967404 RHF 6-31G(d) (6D,10F) C1 490.258006 |X|Y|Z| 79.538385 95.218122 44.459818 69.569896 23 6 7 20 3 |36.858105| |12.493952|36.858105| |7.633389|13.014106|53.358707| |5.680378|7.645816|18.932565|36.858105| |4.221427|5.107178|10.858570|14.354779|36.858105| |3.699080|4.335929|8.846790|7.657797|12.720583|36.858105| |3.397348|3.735389|7.048867|5.984556|9.010930|17.618975|0.500000| |4.353830|5.187967|11.086233|7.182548|8.052974|13.019295|0.256309|53.358707| |5.929200|7.781107|18.648219|8.039352|6.833757|7.452945|0.163510|19.138772|36.858105| |5.816741|7.023846|11.487308|5.485401|4.775587|5.246101|0.125272|11.579636|15.855548|73.516695| |2.969952|3.510706|6.477172|5.355394|7.513276|12.456591|0.247551|10.482026|5.337237|7.515644|36.858105| |2.915144|3.585191|6.393709|4.978052|5.999690|7.568924|0.156199|8.784968|5.176866|7.589672|13.688628|36.858105| |2.429763|2.907604|4.827244|3.714941|4.278671|5.009655|0.116343|6.080024|3.819524|5.989553|7.875847|13.818599|36.858105| |2.137726|2.471211|4.034456|3.158606|3.720343|4.392179|0.109821|5.148196|3.183186|5.055533|6.782245|7.934231|13.696923|36.858105| |2.162769|2.451959|4.067781|3.260708|4.030923|4.984426|0.131803|5.458740|3.230125|5.046406|7.947865|6.967850|8.008840|13.756431|36.858105| |2.482091|2.814500|4.870201|4.010185|5.355338|7.444212|0.201111|7.140952|3.923690|5.883822|13.663790|7.937507|6.826328|7.810391|13.659865|36.858105| |2.360436|2.572908|4.362617|3.622082|4.805216|6.298049|0.210244|6.192780|3.472726|5.282296|7.461347|4.995574|4.425821|5.008687|7.604172|12.575615|36.858105| |1.845448|2.102046|3.307280|2.551429|2.889562|3.257596|0.083928|3.991681|2.575330|4.215752|4.410175|5.027154|7.551175|12.608251|7.544601|4.982319|3.791388|36.858105| |3.509676|4.019238|7.197934|8.377321|12.991545|7.158202|0.180045|6.834915|4.506761|6.242943|5.742674|4.750440|3.759028|3.449646|3.796197|4.822215|4.621939|2.759833|36.858105| |2.900899|3.217131|5.494478|5.540718|7.934838|6.093779|0.169618|5.787692|3.689915|5.325143|5.493229|4.381383|3.656500|3.555526|4.098352|5.211606|5.370566|2.860503|15.765611|73.516695| |3.780733|4.329914|7.150613|8.304791|8.377625|5.106561|0.128412|5.668891|4.116991|5.878715|4.271762|3.896585|3.208517|2.905873|3.062132|3.640218|3.473728|2.417085|13.977284|14.798232|53.358707| |5.115115|6.280957|10.170402|12.670294|8.190487|5.050980|0.121793|6.250694|5.023026|7.057701|4.059820|3.882718|3.135698|2.744795|2.813563|3.312229|3.084841|2.294546|8.192420|9.705789|17.927669|36.858105| |3.156557|3.438434|5.213123|5.155783|5.152262|3.728047|0.098287|4.309583|3.148798|4.730663|3.316445|3.087012|2.685877|2.504310|2.629001|3.001422|2.947597|2.156499|7.548621|11.472698|17.806392|7.553907|36.858105| |3.335104|3.585574|5.148937|4.866306|4.475395|3.320156|0.086990|4.021416|3.044510|4.653094|2.943082|2.808262|2.458783|2.269842|2.344387|2.640957|2.574714|1.979609|5.719286|8.567699|12.747685|7.637742|17.643028|0.500000| |2.831347|2.927967|4.414110|4.144297|4.342271|3.376077|0.094130|3.906481|2.793648|4.267618|2.981142|2.689696|2.372574|2.278515|2.452826|2.810774|2.912200|1.982536|6.110850|10.789630|10.309006|5.254312|12.343421|0.247690|36.858105| |3.155701|3.097206|4.593433|4.188895|4.222364|3.340631|0.095307|4.001637|2.907354|4.471756|2.823049|2.524862|2.201740|2.103849|2.271155|2.634102|2.773806|1.830113|5.312515|8.864869|8.554436|5.143975|7.492871|0.193318|12.582218|36.858105| |3.181510|3.014738|4.230789|3.659013|3.481302|2.829339|0.079508|3.544913|2.660668|4.196741|2.422158|2.225486|1.961855|1.862520|1.976063|2.248292|2.329702|1.643239|4.047775|6.621527|6.674826|4.554874|5.833100|0.177803|7.544267|13.682040|36.858105| |3.290338|2.955801|4.053530|3.340584|3.139109|2.646122|0.075208|3.421522|2.597796|4.177775|2.244683|2.063029|1.819718|1.728100|1.832862|2.084263|2.173019|1.530670|3.424950|5.608479|5.337550|3.901111|4.225767|0.126750|5.008771|7.885622|13.759402|36.858105| |3.383391|2.973386|4.173621|3.390798|3.257838|2.822355|0.082378|3.672512|2.751112|4.427826|2.345136|2.115701|1.853017|1.768438|1.898126|2.186287|2.323288|1.557296|3.447186|5.698063|5.054318|3.700284|3.741983|0.106330|4.420603|6.814635|7.933404|13.738335|36.858105| |3.354847|3.052357|4.519640|3.797798|3.838230|3.327560|0.100357|4.187031|3.026169|4.754480|2.701064|2.365816|2.049295|1.969302|2.153273|2.533999|2.761564|1.712134|4.129217|6.941612|5.734181|3.993972|4.085059|0.109333|5.005475|7.891221|6.894753|7.958361|13.760620|36.858105| |3.239436|3.117379|4.768908|4.286568|4.520625|3.714766|0.111265|4.418111|3.126197|4.781571|3.027621|2.620371|2.258989|2.175470|2.396291|2.846340|3.105631|1.874206|5.388369|9.215703|7.506283|4.705634|5.481848|0.137392|7.536982|13.708551|7.970064|6.887826|7.927705|13.735063|36.858105| |2.624831|2.911042|4.356787|4.072736|4.187625|3.252574|0.085003|3.768549|2.724740|4.174066|3.109287|2.990463|2.707484|2.552558|2.632391|2.888900|2.779962|2.240202|5.767591|9.861581|10.316138|5.315249|12.412756|0.255633|7.516215|4.903716|4.168802|3.232445|2.904641|3.119202|3.935842|36.858105| |2.449508|2.692483|3.876271|3.457427|3.417513|2.749017|0.071906|3.299357|2.432315|3.805675|2.650016|2.611089|2.410530|2.269181|2.299723|2.470704|2.370406|2.036570|4.303948|7.303042|7.485922|4.475288|8.058070|0.222539|5.777258|4.177331|3.851796|3.033392|2.667281|2.765996|3.345616|15.799768|73.516695| |2.400485|2.683420|4.130514|3.831937|4.221336|3.409583|0.089407|3.824236|2.675424|4.088986|3.422317|3.263160|3.013303|2.907610|3.028786|3.280599|3.136297|2.541719|5.919216|11.400375|8.714174|4.515410|7.744059|0.161587|6.005222|4.146061|3.443766|2.789149|2.605370|2.869508|3.599778|14.217592|15.082083|53.358707| |2.061932|2.294812|3.458830|3.050711|3.307261|2.841978|0.074854|3.274850|2.296110|3.588675|2.968579|2.917405|2.828485|2.788185|2.841547|2.929135|2.778194|2.534051|4.186907|8.096431|5.925032|3.445861|4.985347|0.117605|4.271904|3.207737|2.793768|2.335815|2.190450|2.371103|2.855592|7.827839|12.193820|17.914439|36.858105| |1.953888|2.191897|3.356064|2.910586|3.250911|2.929944|0.076964|3.339865|2.291801|3.590647|3.235530|3.212934|3.246353|3.309441|3.347746|3.305869|3.059499|3.044982|3.944129|7.860256|5.153720|3.096157|3.926650|0.093753|3.471234|2.761502|2.403138|2.069105|1.988289|2.174999|2.574211|5.196503|8.090472|10.680091|12.584753|36.858105| |1.914807|2.118001|3.289745|2.861385|3.312919|3.067730|0.082960|3.416496|2.288376|3.574079|3.405985|3.217467|3.229516|3.441553|3.691668|3.670296|3.546307|3.128287|4.077667|8.806051|5.022203|2.964624|3.767343|0.088113|3.553137|2.844576|2.419961|2.094795|2.046731|2.282534|2.723844|4.595405|6.907620|9.226380|8.081689|13.656306|73.516695| |1.812008|2.006376|3.132812|2.659752|3.108378|3.041400|0.082651|3.399714|2.239536|3.526111|3.548596|3.363003|3.534989|4.017752|4.371329|4.051433|3.856250|3.749591|3.600463|7.652611|4.303764|2.646968|3.087571|0.074049|2.936154|2.469347|2.126127|1.884223|1.870538|2.089543|2.435609|3.536053|5.467680|6.398221|5.226967|8.117757|24.303363|36.858105| |17.548316|8.853681|7.578755|4.452285|3.460589|3.075703|0.079148|4.811523|4.582519|8.364336|2.572436|2.567552|2.194262|1.941095|1.946072|2.190846|2.084888|1.702522|3.000768|4.509076|4.462616|4.295835|2.853434|0.085299|2.570008|2.842411|2.949887|3.080706|3.094445|2.972986|2.854866|2.424964|4.110406|3.001525|1.923188|1.815684|3.140427|1.671120|0.500000| |17.550176|8.765537|9.344047|5.941929|4.438787|3.731977|0.097471|5.654118|5.231720|8.534638|2.946079|2.817292|2.351730|2.099111|2.154395|2.494273|2.419942|1.810077|3.823735|5.573298|5.756619|5.753196|3.551248|0.105359|3.232823|3.754238|3.841497|4.045917|4.174568|4.068939|3.860703|2.843210|4.682651|3.481626|2.163141|2.021519|3.542380|1.864814|0.301139|0.500000| |17.598334|8.842909|9.358245|5.033747|4.002590|3.735029|0.097069|6.288185|6.345445|12.081484|2.974508|2.884570|2.404678|2.129323|2.168235|2.498720|2.395124|1.837060|3.267101|4.907308|4.576529|4.272826|2.817974|0.080775|2.595095|2.900292|2.881799|3.026592|3.226277|3.255282|3.076500|2.375655|3.922176|3.017905|1.921481|1.845878|3.252479|1.752219|0.301163|0.300574|0.500000| |8.817697|17.605973|12.544830|7.296335|4.854795|3.923323|0.094164|5.904982|5.778359|9.149670|3.299862|3.423104|2.831317|2.409121|2.370301|2.682037|2.445674|2.067830|4.080119|5.763384|6.387057|7.247730|3.785383|0.113352|3.100413|3.212604|3.171268|3.033674|2.943048|2.975345|3.105173|3.214752|5.362917|3.930601|2.460216|2.309183|3.897062|2.047788|0.213116|0.209041|0.173299|0.500000| |8.861700|17.674156|12.593137|5.804962|4.318758|3.942618|0.094273|6.663357|7.415253|13.999045|3.345441|3.541843|2.920107|2.453979|2.390959|2.692934|2.427686|2.106501|3.436511|5.054494|4.891906|4.804169|2.939573|0.084431|2.534998|2.640903|2.576331|2.539006|2.562293|2.625421|2.666742|2.584027|4.300439|3.301397|2.122355|2.058133|3.524999|1.903418|0.212652|0.172977|0.213487|0.303748|0.500000| |3.785131|4.322993|8.104766|5.225683|5.783711|9.014036|0.214947|26.028722|9.716686|14.272843|6.937545|5.976370|4.389573|3.799268|4.031964|5.136430|4.484340|2.973947|4.076236|6.474640|4.681482|3.703664|2.731169|0.071170|2.525824|2.588463|2.318960|2.263783|2.442899|2.763889|2.865239|2.440651|3.846989|3.401883|2.188258|2.259906|4.136909|2.358809|0.088035|0.099220|0.114820|0.101563|0.118825|0.500000| |3.307857|4.286428|7.787702|5.706823|6.205274|7.085562|0.142374|9.530337|6.238081|9.000733|8.920478|17.711635|8.984828|5.654337|5.000642|5.646384|4.066888|4.103984|4.664390|7.216291|5.494861|4.293214|3.148241|0.081307|2.683271|2.547995|2.280057|2.121917|2.162131|2.384536|2.615835|3.007019|4.725166|4.315306|2.811970|2.997610|5.193483|2.961746|0.080516|0.086814|0.089979|0.113070|0.119913|0.171641|0.500000| |2.338829|2.816827|4.512252|3.381932|3.691808|4.100779|0.096498|5.275680|3.514904|5.683961|5.623558|8.949543|17.697274|8.889142|5.668168|4.926311|3.540425|6.986329|3.285586|5.602451|3.986915|2.926995|2.497652|0.064610|2.190660|2.036224|1.842672|1.714049|1.731373|1.887294|2.063309|2.548743|4.118122|3.804028|2.676436|3.047506|5.225073|3.177554|0.059487|0.062229|0.063967|0.077030|0.080142|0.106159|0.217409|0.500000| |1.950587|2.169684|3.520945|2.812244|3.408297|4.066782|0.112776|4.577164|2.772255|4.408934|5.658293|4.999425|5.679603|8.964398|17.696875|8.947211|7.149138|7.023439|3.323784|6.547606|3.718750|2.490685|2.414046|0.059918|2.303478|2.133789|1.861412|1.731575|1.796046|2.035376|2.255633|2.436816|3.815496|3.830437|2.694842|3.201247|6.466964|4.496005|0.049144|0.054283|0.054443|0.058467|0.058736|0.094759|0.108303|0.124449|0.500000| |2.427834|2.600790|4.405897|3.541947|4.570976|6.302182|0.232144|6.625098|3.630364|5.589144|6.571749|4.531529|3.940023|4.276512|5.901732|8.787934|17.533571|3.344008|4.172330|8.152256|4.389055|2.959675|2.733102|0.067468|2.729700|2.691089|2.285921|2.174864|2.368517|2.828073|3.084724|2.523817|3.875027|3.759479|2.445740|2.628809|5.281730|3.162672|0.059278|0.068961|0.069699|0.067452|0.068389|0.138955|0.106518|0.089792|0.155148|0.500000| |2.449368|2.652092|4.504795|3.904670|5.351404|6.351281|0.218583|5.983811|3.446754|5.161602|6.630301|4.564824|3.961166|4.289380|5.910407|8.834929|17.587586|3.344385|5.601567|12.731049|5.467178|3.405827|3.405796|0.080639|3.438376|3.232862|2.634092|2.419498|2.587897|3.146983|3.667519|3.160834|4.686251|4.897894|3.088921|3.334132|7.031522|4.112271|0.059879|0.071046|0.068224|0.070745|0.068206|0.114763|0.107243|0.090222|0.154713|0.301091|0.500000| |2.081209|2.248961|3.699507|3.023814|3.815717|4.657020|0.147345|4.962761|2.914546|4.557407|5.549886|4.190393|4.001532|4.815320|7.408259|8.874560|17.586294|3.869923|3.805376|7.935819|4.079745|2.664274|2.639559|0.064508|2.640535|2.496013|2.121392|1.982524|2.107002|2.471360|2.756581|2.551940|3.920907|3.956728|2.658114|2.984143|6.286695|4.018311|0.051781|0.059164|0.058591|0.059914|0.059481|0.101625|0.096070|0.090979|0.232962|0.302960|0.301913|0.500000| |1.790797|2.030716|3.162357|2.383639|2.651950|3.022542|0.078197|3.844473|2.502136|4.178539|3.963338|4.551215|6.535348|8.846293|6.018089|4.333547|3.401757|17.535335|2.486245|4.514909|2.997826|2.130048|1.966504|0.050688|1.816434|1.699954|1.540270|1.448187|1.478522|1.616776|1.747967|2.019278|3.293566|3.057752|2.227862|2.603759|4.724456|3.093159|0.046078|0.048416|0.049893|0.055072|0.057208|0.081253|0.106910|0.180620|0.158170|0.086511|0.082851|0.096066|0.500000| |1.723342|1.934075|3.027022|2.356117|2.684755|3.007007|0.079662|3.641257|2.344185|3.840288|3.950286|4.183612|5.578438|8.831550|7.209392|4.722505|3.825891|17.577422|2.623979|4.950429|3.121721|2.146129|2.077452|0.052748|1.941739|1.788260|1.601168|1.491196|1.519920|1.675785|1.836561|2.166785|3.501436|3.375059|2.499624|3.037741|5.719161|4.012430|0.044243|0.047334|0.047716|0.052909|0.053430|0.075355|0.096300|0.140583|0.221801|0.092739|0.093626|0.113839|0.301948|0.500000| |1.810583|2.074858|3.222112|2.493146|2.773030|3.011097|0.076743|3.713026|2.456986|4.028585|3.945339|4.647153|6.878332|8.836984|5.761722|4.222923|3.298976|17.552858|2.687709|4.910954|3.271675|2.285165|2.167091|0.055524|1.968616|1.800605|1.625954|1.506904|1.518562|1.656446|1.818693|2.293613|3.743008|3.550829|2.656287|3.235593|5.703592|3.810632|0.046702|0.049294|0.049611|0.057427|0.057849|0.075593|0.109976|0.199530|0.148175|0.081115|0.083783|0.092382|0.302354|0.301588|0.500000| |5.808243|6.279360|8.934826|8.834871|6.210655|4.284338|0.108705|5.551606|4.564839|6.691949|3.428774|3.248105|2.688415|2.398404|2.474131|2.888026|2.774482|2.041019|6.238510|8.166246|12.352956|17.562412|6.842097|0.214477|5.288300|5.784023|5.484693|4.769193|4.408993|4.561146|5.175823|4.670976|7.315650|5.283626|3.044116|2.712357|4.669164|2.353951|0.135592|0.201394|0.129542|0.199984|0.129773|0.093719|0.098591|0.070254|0.061867|0.075391|0.084968|0.067336|0.053148|0.053489|0.056288|0.500000| |4.747774|6.180034|8.936711|8.837956|6.224448|4.298444|0.102602|5.500881|4.524905|6.626135|3.715394|3.768510|3.121696|2.690498|2.678637|3.049977|2.775616|2.282129|6.200865|8.089167|12.334782|17.547260|6.605677|0.200175|4.492254|4.222885|3.935603|3.400307|3.158061|3.298475|3.781185|5.320893|8.433615|6.048207|3.506477|3.129765|5.140955|2.580405|0.116654|0.139668|0.108755|0.224146|0.137004|0.093085|0.118691|0.083124|0.065877|0.073470|0.083404|0.067769|0.058934|0.058839|0.064139|0.300423|0.500000| |2.522160|2.590175|3.796360|3.421641|3.514066|2.844405|0.079089|3.367973|2.430274|3.786769|2.583518|2.378738|2.144189|2.073025|2.208294|2.469177|2.548419|1.837553|4.625750|8.336791|7.608283|4.274934|8.947966|0.216974|17.546822|8.895948|7.029374|4.693889|3.975363|4.238060|5.726901|7.208444|11.042601|7.631957|4.271668|3.358672|6.018720|2.773796|0.064940|0.079067|0.064298|0.076785|0.063263|0.061445|0.065972|0.055650|0.058243|0.066445|0.081975|0.065513|0.046884|0.050235|0.051048|0.121045|0.107717|0.500000| |2.621418|2.732355|4.224410|3.958218|4.431477|3.551497|0.101336|3.977289|2.755494|4.195139|3.186682|2.804895|2.486283|2.433995|2.677285|3.092060|3.292162|2.106862|6.504435|13.306404|9.243314|4.632008|8.805763|0.174521|17.633607|8.893088|5.624093|4.194514|3.971807|4.743963|7.215457|6.747572|8.965671|8.695354|4.521648|3.781495|7.256787|3.331755|0.065740|0.081721|0.068066|0.078818|0.066622|0.071931|0.075916|0.062912|0.070413|0.084254|0.111528|0.083152|0.053205|0.057858|0.057703|0.123963|0.110364|0.303053|0.500000| |2.955864|2.851781|3.923017|3.359410|3.161672|2.579497|0.071345|3.247856|2.456681|3.908621|2.262005|2.117388|1.888315|1.789466|1.876777|2.102563|2.147651|1.593166|3.683210|6.050270|6.242068|4.290838|5.859407|0.194559|7.005049|8.902130|17.687100|8.935074|5.646752|4.961013|5.655464|4.402352|7.621464|4.765158|2.880584|2.424411|4.257921|2.084818|0.077825|0.096808|0.073622|0.085303|0.068425|0.059305|0.060490|0.049720|0.049176|0.058039|0.066838|0.054808|0.041454|0.043092|0.044146|0.140382|0.108354|0.207674|0.142221|0.500000| |3.117189|2.766967|3.683398|2.950885|2.737576|2.345666|0.066064|3.085932|2.372211|3.884043|2.021215|1.885549|1.678866|1.592245|1.673148|1.879012|1.941475|1.423354|2.930623|4.812589|4.564130|3.426420|3.623603|0.111432|4.089392|5.625312|8.926505|17.710387|8.906490|5.652082|4.959199|2.897884|4.980308|3.405195|2.141487|1.900234|3.388235|1.722894|0.083627|0.104702|0.079441|0.079464|0.066885|0.057258|0.054140|0.044311|0.044016|0.054031|0.059251|0.049599|0.037574|0.038492|0.039067|0.115312|0.085971|0.111198|0.096568|0.216023|0.500000| |3.263440|2.794100|3.849002|3.014421|2.881765|2.574322|0.075244|3.432426|2.590582|4.261925|2.156419|1.959051|1.726507|1.649789|1.764240|2.017115|2.141571|1.462283|2.956507|4.915361|4.257832|3.192388|3.107874|0.088707|3.537773|4.921424|5.641828|8.901220|17.714665|8.907135|5.638437|2.502990|4.143543|3.097405|1.951076|1.792265|3.276022|1.704623|0.084305|0.110052|0.088344|0.075837|0.067904|0.064378|0.055721|0.045019|0.046537|0.061318|0.065212|0.054304|0.038825|0.039657|0.039547|0.104059|0.077397|0.090496|0.090421|0.124172|0.214497|0.500000| |3.218193|2.913354|4.366282|3.565638|3.687784|3.367624|0.104813|4.286524|3.040329|4.822388|2.718071|2.351002|2.037280|1.971757|2.176386|2.577116|2.867230|1.712680|3.806425|6.522114|5.023252|3.541469|3.468660|0.091819|4.086436|5.629217|4.962789|5.651807|8.916234|17.710604|8.921665|2.756121|4.355363|3.548879|2.190649|2.052479|3.867829|2.028097|0.078860|0.105685|0.089738|0.077115|0.070677|0.079895|0.065326|0.051880|0.057408|0.083590|0.089949|0.071224|0.045147|0.046689|0.045652|0.108724|0.082280|0.097766|0.112790|0.107652|0.124142|0.214653|0.500000| |3.043256|3.015188|4.786670|4.373305|4.998715|4.202504|0.130968|4.758802|3.226767|4.872169|3.412305|2.857068|2.451715|2.391448|2.695192|3.271527|3.698563|2.036758|6.179136|11.453150|7.620331|4.530476|5.273772|0.124696|7.001262|8.924987|5.658874|4.959168|5.643962|8.917168|17.710382|3.953171|5.817219|5.191446|3.006579|2.769784|5.357330|2.710261|0.073976|0.097639|0.081624|0.082489|0.072550|0.085798|0.077571|0.061268|0.070599|0.101310|0.126433|0.089990|0.052420|0.055722|0.054443|0.129129|0.101362|0.146104|0.219532|0.124233|0.107621|0.124091|0.215570|0.500000| |2.455431|2.738170|4.339513|4.102713|4.816952|3.897024|0.103540|4.196235|2.854341|4.307419|3.919593|3.583453|3.258245|3.192310|3.437008|3.823642|3.715225|2.725946|7.282501|16.161330|9.328262|4.605079|7.347330|0.147417|6.222408|4.351038|3.464541|2.834812|2.714795|3.079770|3.944340|9.387867|10.844030|25.947260|9.026638|7.395207|13.614444|5.306933|0.061853|0.072853|0.063693|0.080177|0.068561|0.075875|0.094326|0.081757|0.088454|0.088908|0.122599|0.094517|0.066408|0.074296|0.076377|0.109007|0.119850|0.150352|0.204210|0.094488|0.069639|0.065647|0.078495|0.121343|0.500000| |1.905010|2.079730|3.101203|2.696910|2.911582|2.544104|0.068362|2.961526|2.076894|3.277271|2.625727|2.545787|2.477824|2.481890|2.562183|2.636670|2.574066|2.289982|3.645038|7.177023|5.145893|3.035107|4.473798|0.107450|4.164365|3.129560|2.745091|2.294981|2.144936|2.311711|2.774673|6.558684|10.921449|12.373427|17.545088|8.923963|13.007477|4.822558|0.049622|0.055801|0.049556|0.061536|0.053501|0.055452|0.068057|0.065186|0.068824|0.063494|0.079720|0.069399|0.056435|0.063638|0.066136|0.076699|0.084579|0.121232|0.123938|0.079137|0.058650|0.053148|0.059301|0.080823|0.199171|0.500000| |2.049457|2.295348|3.391719|2.943958|3.082377|2.643035|0.068779|3.121609|2.231020|3.516710|2.749600|2.779385|2.710416|2.618605|2.600903|2.658631|2.483912|2.410085|3.752370|6.871218|5.534575|3.377715|4.657158|0.116408|3.843451|2.974549|2.674567|2.249992|2.087504|2.218729|2.623367|7.360061|13.511641|12.552033|17.624324|8.899296|10.276849|4.266296|0.053625|0.059337|0.052666|0.069343|0.059295|0.058003|0.075975|0.072857|0.068090|0.061655|0.075306|0.065851|0.059442|0.065273|0.071146|0.083174|0.099097|0.108459|0.107618|0.077968|0.058043|0.051962|0.056824|0.075154|0.180784|0.302326|0.500000| |1.773048|1.975621|2.975375|2.517059|2.756037|2.536005|0.066965|2.962596|2.049645|3.259782|2.803540|2.829862|2.932129|3.020204|2.998338|2.884955|2.681910|2.897862|3.221214|6.283635|4.271137|2.663690|3.276864|0.080905|2.958538|2.415473|2.147323|1.871414|1.796468|1.942846|2.257694|4.221903|7.017506|7.698626|8.892069|17.485203|16.531794|7.106934|0.046195|0.050675|0.046683|0.057768|0.052059|0.056368|0.073814|0.078136|0.081121|0.064915|0.079540|0.073936|0.069350|0.081144|0.086993|0.065960|0.075572|0.081252|0.088113|0.060608|0.048249|0.045384|0.051169|0.066774|0.145853|0.214522|0.215354|0.500000| |2.076755|2.377334|3.680744|3.194233|3.579704|3.232290|0.082691|3.669759|2.513743|3.913755|3.683311|3.787127|3.877379|3.861875|3.771558|3.678222|3.239859|3.488254|4.225623|8.121724|5.442540|3.333155|3.918314|0.094285|3.329120|2.706951|2.364060|2.051988|1.982055|2.168977|2.548687|5.002103|7.730070|9.704002|8.876518|17.497461|16.542988|7.403368|0.053394|0.059098|0.054430|0.069652|0.062336|0.068665|0.097685|0.101346|0.097066|0.076932|0.096298|0.086404|0.081569|0.094091|0.104938|0.079262|0.094985|0.087379|0.099039|0.065883|0.052378|0.049772|0.057083|0.076147|0.192193|0.174128|0.213070|0.300255|0.500000| |1.663242|1.835842|2.820323|2.349710|2.674923|2.628651|0.071207|3.025201|2.020636|3.225371|3.045014|2.974642|3.206530|3.641816|3.790184|3.417223|3.233838|3.613388|3.022228|6.176767|3.726350|2.351107|2.710116|0.066472|2.577095|2.194561|1.926133|1.719330|1.699592|1.873754|2.151383|3.127420|5.009942|5.448531|4.702959|7.212394|16.468152|17.499027|0.042978|0.047308|0.044703|0.052189|0.048786|0.058841|0.073861|0.082462|0.109891|0.075861|0.093402|0.094513|0.083501|0.109040|0.104890|0.058670|0.064565|0.068892|0.079511|0.052919|0.044085|0.043330|0.050565|0.065456|0.118669|0.124066|0.111740|0.210461|0.180575|0.500000| |1.921518|2.158638|3.420243|2.900090|3.442105|3.440866|0.091595|3.795930|2.468081|3.860604|4.242193|4.078329|4.415723|5.181349|5.582932|4.925797|4.358560|4.670092|3.873947|8.075106|4.514765|2.812852|3.108298|0.074740|2.878356|2.456263|2.116564|1.886945|1.883520|2.108850|2.445442|3.485083|5.352050|6.190450|4.788132|7.189079|16.475099|17.527368|0.048964|0.054490|0.051725|0.060907|0.057162|0.073172|0.096711|0.107478|0.154346|0.097092|0.125124|0.124172|0.102569|0.136846|0.131538|0.068431|0.076357|0.074204|0.089557|0.057356|0.047896|0.047776|0.057109|0.075715|0.143995|0.116890|0.112869|0.169834|0.219919|0.299076|0.500000| 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