Version2.1 2020-12-18T18:34:34Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 11-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE c1cc(cc(c1)F)NC(=O)C(=O)NC[C@@H](c2ccco2)[NH+]3CCN(CC3)c4ccc(cc4)F C38597891 RHF 6-31G(d) (6D,7F) c1cc(cc(c1)F)NC(=O)C(=O)NC[C@@H](c2ccco2)[NH+]3CCN(CC3)c4ccc(cc4)F C01[X(C24H25F2N4O3)] 168 C1 545 Fc1ccc(cc1)N1CC[NH+](CC1)[C@H](c1ccco1)CNC(=O)C(=O)Nc1cccc(c1)F Fc1ccc(cc1)N1CC[NH+](CC1)[C@H](c1ccco1)CNC(=O)C(=O)Nc1cccc(c1)F Fc1ccc(cc1)N2CC[NH+](CC2)[C@@H](CNC(=O)C(=O)Nc3cccc(F)c3)c4occc4 InChIKey=MWDCBSBCLPLQFH-NRFANRHFSA-O InChI=1S/C24H24F2N4O3/c25-17-6-8-20(9-7-17)29-10-12-30(13-11-29)21(22-5-2-14-33-22)16-27-23(31)24(32)28-19-4-1-3-18(26)15-19/h1-9,14-15,21H,10-13,16H2,(H,27,31)(H,28,32)/p+1/t21-/m0/s1 InChI=1/C24H24F2N4O3/c25-17-6-8-20(9-7-17)29-10-12-30(13-11-29)21(22-5-2-14-33-22)16-27-23(31)24(32)28-19-4-1-3-18(26)15-19/h1-9,14-15,21H,10-13,16H2,(H,27,31)(H,28,32)/p+1/t21-/m0/s1/fC24H25F2N4O3/h27-28,30H/q+1 c1cc(cc(c1)F)NC(=O)C(=O)NC[C@@H](c2ccco2)[NH+]3CCN(CC3)c4ccc(cc4)F C01[X(C24H25F2N4O3)] 168 C01 545 Fc1ccc(cc1)N1CC[NH+](CC1)[C@H](c1ccco1)CNC(=O)C(=O)Nc1cccc(c1)F F[C]1[CH][CH][C]([CH][CH]1)[N@@]1CC[NH](CC1)[C@H](C1=[CH][CH]=CO1)C[NH][C]([O])[C]([NH][C]1[CH][CH][CH][C]([CH]1)F)=O [O][C](NC[C@H]([NH]1CCN(CC1)[C]2[CH][CH][C](F)[CH][CH]2)c3occc3)C(=O)N[C]4[CH][CH][CH][C](F)[CH]4 InChIKey=QMODEEIEZLDPDA-NRFANRHFSA-N InChI=1S/C24H25F2N4O3/c25-17-6-8-20(9-7-17)29-10-12-30(13-11-29)21(22-5-2-14-33-22)16-27-23(31)24(32)28-19-4-1-3-18(26)15-19/h1-9,14-15,21,30H,10-13,16H2,(H,27,31)(H,28,32)/t21-/m0/s1 InChI=1/C24H25F2N4O3/c25-17-6-8-20(9-7-17)29-10-12-30(13-11-29)21(22-5-2-14-33-22)16-27-23(31)24(32)28-19-4-1-3-18(26)15-19/h1-9,14-15,21,30H,10-13,16H2,(H,27,31)(H,28,32)/t21-/m0/s1/f/h27-28H 3219.6672697522 -1564.4595381 1-A 23406.0895 119 426 545 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94.9308 109.6188 134.8064 159.7303 184.5151 207.6626 219.9928 248.2690 263.8220 265.9390 274.1129 286.8384 299.0883 306.5307 338.8623 356.7731 364.9746 431.1002 463.2700 471.5906 474.8398 480.7289 494.0409 500.1092 505.0695 524.5410 542.9357 565.4993 574.5705 586.5005 605.1749 620.0992 639.5404 654.2092 655.1581 684.8737 699.4220 713.8994 723.4206 757.0403 757.6507 788.1750 802.7655 804.2190 826.8760 879.0844 880.2009 881.7218 902.1312 905.7240 917.0727 921.5753 933.2386 956.9073 965.9225 972.0819 983.1390 996.1045 998.5940 1006.3540 1017.4591 1029.2939 1036.7168 1040.7547 1065.3637 1078.0646 1091.4558 1098.7792 1105.6775 1108.0486 1111.3289 1116.6238 1130.9307 1134.3260 1156.9952 1164.1529 1173.8956 1184.6665 1197.5248 1197.7990 1211.8609 1230.4888 1258.9141 1270.9086 1275.3078 1279.1794 1284.6789 1314.2127 1318.5922 1328.9080 1342.2461 1353.8623 1364.2938 1384.1535 1402.0812 1411.3916 1421.4934 1427.2190 1434.1249 1437.1538 1443.7744 1453.1340 1460.2329 1482.0252 1492.0504 1520.4959 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3.1368 12.6529 3.6308 10.5439 11.5831 12.5967 10.9879 5.5947 9.6249 1.6440 1.6696 1.6016 1.7978 0.9089 7.3454 0.2060 577.7474 148.2689 89.2175 2.4220 2.7495 1.3204 6.6362 0.9229 0.4902 0.8240 1.8078 3.9476 2.8262 0.3779 1.5398 1.1683 0.8205 0.2791 0.8572 0.4767 2.8372 0.5955 0.6714 3.6005 0.6318 1.8898 3.5340 0.8331 1.0116 0.9261 0.9219 0.4507 3.6364 1.8819 0.2102 0.4312 0.1375 0.2715 0.7661 0.6168 2.4991 4.3126 3.8074 0.4186 0.7247 0.1897 4.5740 0.9677 1.9743 0.7125 7.2394 1.6315 0.5303 1.5655 1.4879 22.0947 1.8788 4.8941 1.4649 2.8216 1.4678 2.6667 8.1498 21.4282 2.6066 2.3230 2.3163 1.0956 13.4148 3.9934 0.7712 1.9358 1.6950 1.2036 0.9612 4.0032 2.6565 4.6325 2.1454 0.9482 39.7328 0.1059 0.8474 4.0432 1.0384 10.4858 11.6762 13.9009 2.9049 2.7159 7.5701 1.3540 6.7451 6.3427 2.8710 6.0571 4.7861 3.6938 11.9553 3.3692 3.4321 5.6702 2.2434 6.0777 14.5629 3.8220 6.6577 3.4861 8.6608 2.9331 4.8906 77.8018 1.5869 3.8213 3.5017 2.0431 10.4131 28.1915 3.4690 1.1521 3.3265 0.6523 18.6627 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1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 18.99840 14.00307 12.00000 15.99491 12.00000 15.99491 14.00307 12.00000 12.00000 1.00783 12.00000 12.00000 12.00000 12.00000 15.99491 14.00307 1.00783 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 18.99840 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 13757.1045 31259.6994 43696.7007 0.99983 -0.01808 -0.00199 0.01809 0.99983 0.00199 0.00195 -0.00203 1.00000 1 0.00630 0.00277 0.00198 0.13119 0.05773 0.04130 17.31 22.19 26.18 35.92 52.50 76.81 77.79 87.47 95.45 112.89 120.00 136.58 157.72 193.96 229.82 265.48 298.78 316.52 357.20 379.58 382.63 394.39 412.70 430.32 441.03 487.55 513.32 525.12 620.26 666.54 678.51 683.19 691.66 710.81 719.55 726.68 754.70 781.16 813.63 826.68 843.84 870.71 892.18 920.16 941.26 942.63 985.38 1006.31 1027.14 1040.84 1089.21 1090.09 1134.01 1155.00 1157.09 1189.69 1264.81 1266.41 1268.60 1297.97 1303.13 1319.46 1325.94 1342.72 1376.78 1389.75 1398.61 1414.52 1433.17 1436.75 1447.92 1463.90 1480.92 1491.60 1497.41 1532.82 1551.09 1570.36 1580.90 1590.82 1594.23 1598.95 1606.57 1627.16 1632.04 1664.66 1674.96 1688.97 1704.47 1722.97 1723.37 1743.60 1770.40 1811.30 1828.55 1834.88 1840.45 1848.37 1890.86 1897.16 1912.00 1931.19 1947.91 1962.91 1991.49 2017.28 2030.68 2045.21 2053.45 2063.39 2067.74 2077.27 2090.74 2100.95 2132.30 2146.73 2187.65 2220.88 2223.57 2237.60 2252.49 2254.27 2285.69 2329.37 2335.96 2347.37 2352.05 2372.38 2373.25 2380.17 2391.05 2411.01 2442.20 2444.82 2486.76 2554.21 2573.98 2609.21 2611.20 2618.74 2619.38 2733.44 2839.08 4528.72 4541.75 4708.32 4710.10 4742.82 4745.77 4755.90 4759.11 4805.05 4809.30 4835.11 4845.55 4852.53 4876.15 4879.18 4901.86 4905.75 4911.80 4946.98 4977.71 4986.46 5025.32 5058.11 5508.02 5542.27 0.507600 0.534353 0.535297 0.444576 -1563.951938 -1563.925185 -1563.924241 -1564.014962 3.042797D-04 MUNgauss RevisionA2.0 retrievium 18-Dec-2020 DUDE c1cc(cc(c1)F)NC(=O)C(=O)NC[C@@H](c2ccco2)[NH+]3CCN(CC3)c4ccc(cc4)F C38597891 RHF 6-31G(d) (6D,10F) C1 455.189472 |X|Y|Z| 83.722501 125.955454 23.061297 62.418640 29 6 7 8 24 4 1 |36.858105| |13.781761|36.858105| |7.942195|13.702011|36.858105| |6.848669|7.899959|13.737494|36.858105| |8.056528|6.964531|8.044037|13.803930|36.858105| |13.757880|7.917387|6.846255|7.851449|13.837456|36.858105| |5.330379|4.693084|5.338246|8.229012|14.389226|8.189442|97.533100| |5.197641|7.974378|13.463931|7.748305|5.161726|4.540256|8.981983|53.358707| |3.918322|5.192163|7.692626|6.351713|4.357993|3.686705|8.228382|19.457241|36.858105| |3.573432|4.396353|6.399608|6.491550|4.452583|3.574703|8.868084|11.344035|15.901600|73.516695| |3.150295|4.027566|5.045473|4.224566|3.247509|2.908592|6.353757|10.846488|12.373888|14.360757|36.858105| |3.114991|4.020632|4.647522|3.728991|2.981721|2.780984|5.780184|9.589647|7.885692|9.805991|15.686523|73.516695| |2.643832|3.208490|3.926264|3.568952|2.835878|2.519011|5.771867|7.298691|7.951090|12.838990|14.352359|15.041893|53.358707| |2.244242|2.655443|3.078290|2.818065|2.340930|2.132073|4.835084|5.367157|5.030402|8.317415|7.757265|11.890907|17.872275|36.858105| |2.082941|2.440383|2.751192|2.509340|2.126815|1.967655|4.402793|4.677103|4.108234|6.727167|5.900959|10.379871|10.309695|12.344452|36.858105| |2.130496|2.490731|2.837147|2.614236|2.207266|2.026563|4.583811|4.797298|4.260265|7.107588|5.834853|9.778607|10.044111|8.902070|17.638711|0.500000| |1.792699|2.051306|2.272106|2.116894|1.836692|1.710140|3.863539|3.700823|3.152817|5.358298|4.093012|7.211278|6.879201|7.559332|12.773390|0.253044|36.858105| |1.637339|1.846131|2.029270|1.918352|1.687337|1.574507|3.587156|3.222725|2.700980|4.683342|3.310987|5.794621|5.369975|5.122497|7.347943|0.193374|14.200460|36.858105| |1.485035|1.656990|1.803955|1.716440|1.527492|1.432626|3.268493|2.819212|2.330027|4.068878|2.785430|4.898209|4.435895|4.166334|5.147573|0.130104|8.575740|13.243538|36.858105| |1.520651|1.703920|1.854218|1.753734|1.556064|1.461245|3.316217|2.916877|2.414088|4.183885|2.930368|5.186640|4.691620|4.620712|5.339241|0.124681|8.775801|8.603932|14.229738|36.858105| |1.698619|1.931476|2.120672|1.980072|1.732097|1.620773|3.654108|3.416007|2.872069|4.895126|3.656985|6.503684|6.022342|6.635675|7.849997|0.161051|14.108393|8.623335|8.618106|14.144164|73.516695| |2.165671|2.564713|2.806882|2.477515|2.115680|1.999372|4.311275|4.803344|3.951925|6.124590|5.702137|12.045004|8.056297|7.542360|12.498852|0.254032|7.595561|5.412414|4.183272|4.382978|10.581646|53.358707| |2.441516|2.962868|3.267170|2.803579|2.354780|2.224338|4.722880|5.830931|4.775244|7.017668|7.492865|18.476757|9.347788|7.618264|9.337486|0.217150|5.735154|4.328009|3.484294|3.672640|8.580560|25.481787|0.500000| |1.986388|2.320254|2.476300|2.192805|1.907875|1.827830|3.903851|4.113866|3.270278|5.131938|4.425959|9.409806|6.159022|5.859789|7.449003|0.155069|6.453276|4.757167|4.111459|4.630553|11.135921|17.255940|0.259933|36.858105| |2.022667|2.360001|2.439683|2.126086|1.873809|1.830454|3.802061|3.984992|3.007402|4.648720|3.864203|8.617445|4.985204|4.216105|4.920198|0.116288|4.323906|3.565216|3.182286|3.453117|7.473756|10.490702|0.202066|12.525566|36.858105| |1.936107|2.233726|2.290340|2.011859|1.790245|1.756805|3.647678|3.669257|2.742684|4.292103|3.396336|7.327942|4.394263|3.594010|4.421691|0.111950|3.991518|3.511786|3.082693|3.173170|6.540300|9.074980|0.168156|7.856247|13.151009|53.358707| |2.097658|2.444365|2.534552|2.215370|1.951919|1.903059|3.959151|4.112572|3.086383|4.788065|3.845034|8.319992|4.895877|3.853004|4.948372|0.133934|4.169214|3.707475|3.086762|3.068488|6.368789|10.460179|0.199880|6.649916|7.954882|17.915892|36.858105| |2.065472|2.411033|2.588524|2.301854|1.998801|1.907527|4.090267|4.278811|3.392333|5.349277|4.424353|9.083177|6.021485|4.990412|7.587709|0.210162|5.957095|5.111567|3.897623|3.785293|8.162441|17.306145|0.258306|7.753910|6.656939|10.667888|12.516763|36.858105| |1.846653|2.099573|2.101454|1.849703|1.673871|1.667216|3.413988|3.274461|2.384324|3.757994|2.821011|5.976109|3.604237|2.854414|3.320164|0.086424|3.079328|2.809977|2.552644|2.616199|5.190436|6.079891|0.119633|5.103200|7.826711|18.052739|7.840295|5.097079|36.858105| |1.630297|1.822863|1.825845|1.634991|1.494964|1.488825|3.082488|2.796099|2.051192|3.297288|2.380752|4.865914|3.114628|2.485509|2.885873|0.075683|2.806993|2.651173|2.474050|2.508139|4.799691|4.957074|0.094989|4.161202|5.515528|10.690848|5.551529|4.163907|13.737392|36.858105| |1.541724|1.702549|1.683546|1.514162|1.400810|1.407560|2.895626|2.532737|1.835720|2.968198|2.079538|4.199067|2.706354|2.121654|2.393958|0.063518|2.331731|2.226536|2.107757|2.134639|4.027585|3.956184|0.077691|3.238359|4.104196|6.996780|4.121858|3.239911|7.909952|13.759701|36.858105| |1.621270|1.786551|1.739457|1.552960|1.444398|1.466389|2.969169|2.595707|1.848876|2.970207|2.067442|4.204133|2.642941|2.032314|2.244312|0.059859|2.138973|2.021540|1.902981|1.937875|3.693284|3.702287|0.074896|2.977402|3.818118|6.190139|3.823814|2.976419|6.919700|8.017668|13.821191|36.858105| |1.831454|2.041420|1.968820|1.730238|1.601480|1.633987|3.257473|2.957261|2.075952|3.285291|2.328503|4.840752|2.912934|2.211433|2.421061|0.064509|2.243475|2.081690|1.931538|1.979666|3.848230|4.084889|0.084911|3.253156|4.351876|6.937142|4.344766|3.248847|7.906495|6.866852|7.896118|13.810356|36.858105| |1.982278|2.255101|2.204412|1.915114|1.744604|1.762730|3.526927|3.397086|2.401220|3.745668|2.773822|5.944557|3.439070|2.631934|2.932934|0.077356|2.657329|2.417069|2.202835|2.267567|4.505371|5.214601|0.109064|4.191288|6.157281|10.477593|6.129680|4.182061|13.705539|7.948538|6.865434|8.016057|13.768079|36.858105| |1.512466|1.644735|1.590462|1.431102|1.344794|1.373024|2.777415|2.338094|1.658794|2.687151|1.823186|3.651301|2.337744|1.783611|1.941794|0.052119|1.864034|1.778028|1.690347|1.717697|3.237415|3.115317|0.063294|2.473665|3.034818|4.704236|3.038635|2.473147|4.673523|5.318222|8.181438|14.397512|8.184704|5.319715|97.533100| |17.733608|8.953950|5.653042|4.940643|5.698732|8.936006|9.629537|5.742113|3.296688|5.342731|2.781314|5.002635|3.215171|2.050848|1.927004|0.054472|1.675447|1.537191|1.402329|1.436037|2.835890|2.756930|0.062977|1.882937|1.944680|2.547743|2.010384|1.949428|1.811849|1.605356|1.532733|1.626121|1.840330|1.966844|3.437933|0.500000| |8.927208|17.708485|8.885471|5.626861|4.998641|5.639386|8.347262|10.007802|4.859332|7.047544|4.082570|7.697293|4.350944|2.699103|2.512002|0.070477|2.103363|1.882428|1.689219|1.743446|3.528273|3.698899|0.088187|2.482962|2.585653|3.320994|2.659195|2.558943|2.311652|1.981106|1.851575|1.963311|2.279924|2.530545|4.047743|0.216120|0.500000| |4.948437|5.612692|8.826399|17.826168|8.970050|5.634859|16.883681|9.460225|6.865576|14.748197|4.423636|6.608001|5.296971|3.006554|2.634396|0.076867|2.222848|2.016307|1.799031|1.834104|3.682472|3.440237|0.078747|2.215763|2.105477|2.706877|2.193462|2.329906|1.809497|1.607385|1.480790|1.504829|1.663551|1.847407|3.114618|0.107468|0.123387|0.500000| |8.833702|5.620517|4.941503|5.624282|8.956027|17.755534|16.716397|4.921396|3.062075|5.359410|2.500407|4.276338|3.009974|1.905921|1.772755|0.050659|1.561215|1.448853|1.327251|1.350999|2.641575|2.447767|0.054955|1.658568|1.665062|2.186706|1.729181|1.728085|1.536774|1.384363|1.317706|1.374030|1.521221|1.624399|2.915640|0.212675|0.123667|0.124600|0.500000| |4.903216|7.600847|9.246992|5.734846|4.301958|4.061197|7.651130|26.003055|9.649123|10.893822|7.933579|15.173828|6.989047|3.972638|3.550128|0.099316|2.785863|2.405374|2.103218|2.186766|4.582865|5.229936|0.133749|3.317735|3.307189|4.105772|3.381260|3.411822|2.692862|2.255577|2.035375|2.102754|2.436736|2.838712|4.226469|0.116153|0.233009|0.142231|0.092051|0.500000| |2.624639|3.129554|3.918502|3.747171|2.956097|2.563437|6.127177|6.951238|7.871447|15.550244|9.638775|10.924387|25.944469|8.962252|5.890287|0.169066|4.408537|3.630256|3.058024|3.191648|6.983175|6.259709|0.141130|3.693880|3.074991|3.774041|3.069712|3.700863|2.330941|2.049814|1.804503|1.765473|1.929828|2.237719|3.551298|0.064586|0.084262|0.118484|0.062629|0.128167|0.500000| |2.069085|2.399557|2.779615|2.625814|2.208542|1.998496|4.646155|4.658728|4.335088|7.684427|5.807291|8.766740|12.695015|17.660565|8.934544|0.203567|7.452519|5.322457|4.484873|5.022774|12.392160|7.590985|0.149390|4.717780|3.515496|4.187735|3.248798|4.124951|2.509562|2.241706|1.936359|1.847522|1.982400|2.313216|3.687464|0.052594|0.066822|0.079011|0.050051|0.093439|0.234608|0.500000| |2.228600|2.639970|3.001574|2.708628|2.271438|2.095829|4.665475|5.205536|4.650133|7.468722|7.007224|11.973764|12.437033|17.608887|8.742057|0.175030|6.424929|4.450590|3.869898|4.529891|11.720720|9.724041|0.206410|6.568853|4.652963|5.061479|3.783260|4.607302|2.965592|2.565179|2.189900|2.105181|2.301565|2.748170|4.147569|0.056987|0.075570|0.078881|0.052131|0.109898|0.187731|0.304718|0.500000| |1.635152|1.836881|2.019123|1.918444|1.691981|1.577415|3.606863|3.182586|2.654985|4.631087|3.183706|5.542004|5.065873|4.491303|6.350845|0.192560|8.814819|17.785756|8.455975|5.857361|10.439932|6.715153|0.112740|4.137615|3.276505|4.574123|3.698323|5.128528|2.727222|2.583398|2.184363|1.987662|2.043668|2.360158|3.946612|0.042629|0.051842|0.056063|0.040375|0.065667|0.096655|0.127242|0.106747|0.500000| |1.377764|1.523471|1.648991|1.580305|1.419327|1.334797|3.055632|2.541318|2.078660|3.656271|2.423772|4.258703|3.788902|3.397574|4.039657|0.106348|5.846125|8.451531|17.813991|8.828273|10.442957|4.677474|0.081679|3.396958|2.762814|3.716558|2.731141|3.329078|2.324794|2.297231|1.986254|1.789441|1.796806|2.018520|3.610506|0.036268|0.043034|0.045956|0.034538|0.052495|0.073792|0.101357|0.088455|0.193554|0.500000| |1.444099|1.608416|1.739051|1.649453|1.473882|1.389307|3.150079|2.708740|2.218956|3.854626|2.646937|4.700212|4.161178|3.967789|4.274669|0.101387|6.034346|5.817353|8.617030|17.839238|16.488174|5.039749|0.089105|4.076320|3.171659|3.919501|2.724283|3.215564|2.437083|2.362528|2.039109|1.856110|1.885637|2.133503|3.730722|0.038021|0.045725|0.047778|0.035817|0.056415|0.079501|0.119864|0.112614|0.123148|0.195089|0.500000| |1.793964|2.061956|2.195289|1.979647|1.741350|1.667781|3.603376|3.562829|2.838564|4.580075|3.679288|7.387117|5.305655|5.090499|6.782172|0.145115|7.207550|5.506410|4.905596|5.570198|12.940286|12.368315|0.181785|17.679633|8.862490|9.695279|5.885571|7.092172|4.833842|4.250187|3.270379|2.906569|3.058209|3.814477|5.464156|0.047416|0.060692|0.055871|0.042371|0.078282|0.091751|0.122345|0.151327|0.128241|0.110658|0.133336|0.500000| |2.013692|2.356311|2.532536|2.246698|1.947111|1.857598|3.985887|4.227394|3.400450|5.347414|4.652191|9.688857|6.594739|6.563591|6.964811|0.141632|6.082457|4.377414|3.946606|4.704918|11.805131|12.308991|0.223911|17.656755|8.813213|7.692357|4.962975|5.630802|4.173499|3.504611|2.852234|2.677139|2.928209|3.646520|5.110345|0.052836|0.069742|0.063297|0.046750|0.094116|0.109240|0.145993|0.236643|0.103885|0.090530|0.118926|0.300576|0.500000| |1.869350|2.150337|2.202505|1.939755|1.729794|1.698488|3.532363|3.521016|2.642520|4.152437|3.284160|7.038627|4.305328|3.649821|4.085505|0.097160|3.831218|3.238257|3.023589|3.344555|7.003522|7.634930|0.146755|8.988206|17.615438|12.506440|5.727589|4.974602|7.323730|5.710435|4.325889|3.966944|4.376536|5.824783|7.115630|0.050294|0.065237|0.053322|0.043232|0.080231|0.075532|0.087661|0.113952|0.081916|0.073897|0.088017|0.216298|0.213178|0.500000| |2.252710|2.673095|2.737548|2.331700|2.042492|2.007173|4.090879|4.537663|3.338574|5.021126|4.309715|10.258492|5.250104|4.215300|4.586411|0.110811|3.830855|3.160264|2.813978|3.047198|6.598855|9.405830|0.213738|8.853796|17.441720|12.190144|7.045168|5.785454|6.712449|4.679624|3.734498|3.689724|4.442805|6.351335|6.695162|0.060160|0.082959|0.063398|0.050344|0.108019|0.089176|0.096028|0.131243|0.081800|0.068438|0.078491|0.173659|0.214805|0.301958|0.500000| |1.973514|2.262165|2.325422|2.059952|1.838835|1.801121|3.756420|3.674949|2.736616|4.327998|3.264914|6.761429|4.209551|3.260651|4.119382|0.116025|3.654741|3.432995|2.889759|2.799051|5.593798|7.625313|0.145406|4.979420|5.725214|12.502535|17.614293|8.977449|7.323891|5.771450|4.355356|3.970747|4.354095|5.767892|7.121874|0.052876|0.067888|0.056612|0.045806|0.082595|0.075405|0.078869|0.087779|0.098140|0.072653|0.069393|0.132086|0.109170|0.128037|0.143225|0.500000| |2.364081|2.804558|2.880428|2.457184|2.150626|2.109860|4.299581|4.735224|3.448841|5.201837|4.270436|9.707239|5.126769|3.821931|4.597679|0.126622|3.707612|3.259748|2.739578|2.753740|5.747906|9.345176|0.209990|5.752428|7.038272|12.206664|17.433944|8.869806|6.739821|4.711944|3.755670|3.702945|4.445966|6.339716|6.715588|0.062875|0.086329|0.066698|0.052808|0.111473|0.088814|0.088357|0.104710|0.090493|0.067701|0.068740|0.134048|0.128833|0.143319|0.206884|0.302006|0.500000| |2.167626|2.535372|2.759042|2.466732|2.127338|2.013280|4.354013|4.568249|3.660700|5.807680|4.671122|9.162878|6.332990|4.884016|7.149328|0.237811|5.390435|4.844946|3.622449|3.427216|7.235229|12.369557|0.223722|5.635261|4.983545|7.689909|8.829693|17.615914|4.174831|3.508338|2.855392|2.679164|2.928994|3.646228|5.114181|0.056386|0.073891|0.069758|0.050488|0.099530|0.109847|0.113582|0.119101|0.143849|0.087383|0.081089|0.144260|0.126585|0.109331|0.130197|0.212319|0.217122|0.500000| |1.852266|2.125671|2.274444|2.061415|1.811577|1.728845|3.753008|3.672249|2.922703|4.743599|3.685566|7.230053|5.233423|4.503739|6.932754|0.189064|6.577041|6.127201|4.571832|4.257914|8.817481|12.399886|0.181268|7.061473|5.833481|9.569445|8.821574|17.642154|4.790523|4.222476|3.253984|2.891695|3.040011|3.785594|5.441158|0.048784|0.062111|0.058307|0.043887|0.079901|0.092194|0.109012|0.115851|0.172344|0.108019|0.098337|0.213711|0.144215|0.130712|0.133671|0.216208|0.173458|0.299552|0.500000| |1.548027|1.726670|1.748650|1.580495|1.442746|1.426345|2.993388|2.682028|1.997230|3.242280|2.329798|4.686263|3.112312|2.529436|2.994612|0.078235|3.012995|2.898159|2.732754|2.744571|5.160073|5.049051|0.093512|4.277864|5.245872|9.921283|5.292493|4.285040|8.953792|17.734680|8.915301|5.678495|4.950211|5.658603|9.611584|0.042127|0.051594|0.043504|0.036883|0.059444|0.057059|0.063996|0.072044|0.078193|0.070783|0.071561|0.128760|0.098918|0.151675|0.118572|0.154156|0.119465|0.099034|0.128032|0.500000| |1.419279|1.554393|1.540452|1.398568|1.300365|1.305186|2.705259|2.299964|1.674984|2.735090|1.881670|3.740689|2.475190|1.944368|2.186003|0.058221|2.168342|2.103282|2.019992|2.034106|3.769756|3.516213|0.068561|2.860523|3.452340|5.666808|3.468686|2.863071|5.620123|8.853826|17.747454|8.962513|5.642772|4.950714|16.727276|0.039221|0.046586|0.038116|0.034100|0.050846|0.046236|0.049890|0.055538|0.057456|0.053525|0.054356|0.081856|0.070923|0.101805|0.087175|0.102643|0.087671|0.071009|0.081534|0.212681|0.500000| |1.887350|2.089344|1.982069|1.736726|1.620621|1.671480|3.286030|2.936766|2.030271|3.210922|2.235511|4.624064|2.769488|2.069646|2.222382|0.059575|2.046784|1.899282|1.765826|1.811987|3.519487|3.677928|0.077779|2.878157|3.717253|5.610357|3.706860|2.873611|5.617207|4.951440|5.643508|8.960178|17.747088|8.856081|16.744295|0.053249|0.065329|0.046010|0.043353|0.067356|0.051310|0.051716|0.059844|0.051913|0.045765|0.048143|0.074556|0.073623|0.103304|0.109352|0.102595|0.109232|0.073625|0.074155|0.107521|0.124628|0.500000| 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