Version2.4 2021-06-07T11:03:18Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 19-Jun-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1cc(ccc1C(=O)C2=C(C(=O)N([C@@H]2c3ccc(cc3)OC)CCN4CCOCC4)[O-])OCC=C C19928957 RHF 6-31G(d) (6D,7F) Cc1cc(ccc1C(=O)C2=C(C(=O)N([C@@H]2c3ccc(cc3)OC)CCN4CCOCC4)[O-])OCC=C C01[X(C28H31N2O6)] 195 C1 602 C=CCOc1ccc(c(c1)C)C(=O)C1=C([O-])C(=O)N([C@@H]1c1ccc(cc1)OC)CCN1CCOCC1 C=CCOc1ccc(c(c1)C)C(=O)C1=C([O-])C(=O)N([C@@H]1c1ccc(cc1)OC)CCN1CCOCC1 COc1ccc(cc1)[C@H]2N(CCN3CCOCC3)C(=O)C(=C2C(=O)c4ccc(OCC=C)cc4C)[O-] InChIKey=QWORQHUWGGTCDD-RUZDIDTESA-M InChI=1S/C28H32N2O6/c1-4-15-36-22-9-10-23(19(2)18-22)26(31)24-25(20-5-7-21(34-3)8-6-20)30(28(33)27(24)32)12-11-29-13-16-35-17-14-29/h4-10,18,25,32H,1,11-17H2,2-3H3/p-1/t25-/m1/s1 InChI=1/C28H32N2O6/c1-4-15-36-22-9-10-23(19(2)18-22)26(31)24-25(20-5-7-21(34-3)8-6-20)30(28(33)27(24)32)12-11-29-13-16-35-17-14-29/h4-10,18,25,32H,1,11-17H2,2-3H3/p-1/t25-/m1/s1/fC28H31N2O6/h32h/q-1 Cc1cc(ccc1C(=O)C2=C(C(=O)N([C@@H]2c3ccc(cc3)OC)CCN4CCOCC4)[O-])OCC=C C01[X(C28H31N2O6)] 195 C01 602 C=CCOc1ccc(c(c1)C)C(=O)C1=C([O-])C(=O)N([C@@H]1c1ccc(cc1)OC)CCN1CCOCC1 C=CCO[C]1[CH][CH][C]([C]([CH]1)C)[C]([C]1[C](=O)C(=O)N([C@@H]1[C]1[CH][CH][C]([CH][CH]1)OC)CCN1CCOCC1)=O CO[C]1[CH][CH][C]([CH][CH]1)[C@@H]2[C](C(=O)[C]3[CH][CH][C]([CH][C]3C)OCC=C)C(=O)C(=O)N2CCN4CCOCC4 InChIKey=FHQVZDLSTJQPHG-RUZDIDTESA-N InChI=1S/C28H31N2O6/c1-4-15-36-22-9-10-23(19(2)18-22)26(31)24-25(20-5-7-21(34-3)8-6-20)30(28(33)27(24)32)12-11-29-13-16-35-17-14-29/h4-10,18,25H,1,11-17H2,2-3H3/t25-/m1/s1 InChI=1/C28H31N2O6/c1-4-15-36-22-9-10-23(19(2)18-22)26(31)24-25(20-5-7-21(34-3)8-6-20)30(28(33)27(24)32)12-11-29-13-16-35-17-14-29/h4-10,18,25H,1,11-17H2,2-3H3/t25-/m1/s1 3832.0671863059 -1636.4038949 1-A 22078.7511 131 471 602 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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| 10.4815 15.0129 17.7541 18.6349 20.4195 27.8736 36.1730 48.9575 55.5025 61.3207 71.1969 72.7430 74.1497 96.3270 108.8783 112.3493 116.7970 129.9946 139.0315 159.7832 172.1482 184.3377 192.9275 233.7301 238.2997 248.2958 267.2139 277.8194 282.8691 295.8187 314.6954 320.6323 330.1329 336.1095 363.0811 377.1780 383.0813 402.4748 416.4312 453.1314 459.0497 466.4008 468.0336 485.1100 514.0290 516.2547 533.7777 534.5068 551.5825 587.2397 593.1626 603.3935 622.1891 638.6291 652.8522 680.3019 696.0376 701.6044 722.1931 757.0167 810.8016 814.6700 822.1788 834.5095 849.1575 853.3847 862.9549 891.4573 894.3125 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3190.8919 3199.2520 3209.4078 3234.5929 3237.6757 3250.0271 3254.6796 3257.6071 3268.9181 3269.0814 3275.0410 3280.9287 3286.3055 3305.3089 3312.8329 3324.7103 3351.3074 3351.5006 3366.9938 3370.1319 3378.5851 3380.5896 3395.6848 3397.4621 3403.7294 5.6011 4.9055 4.7839 3.0169 4.7337 4.5043 5.4607 4.0724 4.9419 6.2394 3.5232 3.8331 3.4749 7.6514 1.5072 1.9725 2.7707 3.4525 5.8682 4.9305 4.5440 4.0805 4.4118 3.0897 3.4559 5.2088 1.8479 1.2868 4.7554 4.8646 3.1779 4.2089 5.0857 3.1130 4.2850 2.9546 6.4206 4.8861 3.4725 3.1418 4.5878 2.4003 2.8972 3.4209 5.0369 4.3080 3.1973 3.1145 4.9210 6.8758 5.7563 2.9931 5.7559 4.1270 2.9989 2.4277 6.0672 2.4093 2.6315 3.3766 4.0964 5.6433 2.1700 2.9133 5.0551 3.7403 3.9037 6.2679 3.0161 2.4715 2.8245 1.3572 3.5992 1.5942 1.8659 2.9144 1.4366 2.2981 1.6340 3.1879 1.8239 1.3720 1.3967 2.4045 1.3568 1.5597 1.6205 2.7907 2.8261 3.3837 2.2554 2.9302 1.2973 1.5215 3.1527 3.6950 2.2527 1.7248 3.0141 1.9676 2.3786 3.6973 2.7777 2.2289 3.2105 1.8997 3.1115 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4576.61 4586.84 4590.98 4603.01 4617.62 4653.86 4658.29 4676.06 4682.76 4686.97 4703.24 4703.48 4712.05 4720.52 4728.26 4755.60 4766.43 4783.52 4821.78 4822.06 4844.35 4848.87 4861.03 4863.91 4885.63 4888.19 4897.21 0.591041 0.623626 0.624570 0.519608 -1635.812854 -1635.780269 -1635.779325 -1635.884286 3.520409D-04 MUNgauss RevisionA2.1 retrievium 07-Jun-2021 DUDE Cc1cc(ccc1C(=O)C2=C(C(=O)N([C@@H]2c3ccc(cc3)OC)CCN4CCOCC4)[O-])OCC=C C19928957 RHF 6-31G(d) (6D,10F) C1 491.218212 |X|Y|Z| 66.604214 67.055802 114.655931 80.003969 26 6 7 8 23 2 1 |36.858105| |12.599775|36.858105| |7.593167|13.785578|36.858105| |5.013919|7.880112|13.687383|36.858105| |4.425934|6.821554|7.950369|13.810680|36.858105| |5.033706|7.964363|6.949262|7.979479|13.671955|36.858105| |7.524752|13.569210|7.920824|6.818926|7.851597|13.823101|36.858105| |6.464923|7.481833|5.000653|4.409815|4.981620|7.538279|12.468155|36.858105| |5.642019|5.995423|4.321640|3.859945|4.284482|5.955868|8.177231|15.682156|73.516695| |5.313015|5.585269|4.091387|3.677190|4.080841|5.616408|7.532394|13.372707|14.371223|36.858105| |4.257835|4.107298|3.201391|2.900527|3.140880|4.006028|4.931644|7.568009|11.432099|13.443158|36.858105| |3.633406|3.493463|2.859329|2.619001|2.790203|3.385720|3.960728|5.097480|7.668139|8.079932|12.363983|36.858105| |3.057421|2.894615|2.442097|2.252731|2.372653|2.790958|3.179273|3.917091|6.248413|5.404426|7.721504|15.844135|73.516695| |3.832235|3.837082|3.172580|2.924250|3.120050|3.765943|4.348354|5.146868|7.252147|8.183685|8.162059|14.082010|14.941915|53.358707| |4.733941|5.151482|4.063334|3.735771|4.100059|5.275657|6.338297|7.303815|9.045499|12.528979|7.902954|8.067650|9.642775|17.733977|36.858105| |5.556968|6.030635|4.744466|4.178688|4.346498|5.318060|6.641149|6.551177|8.289761|8.728664|6.005776|6.165346|8.122566|12.430779|17.483447|0.500000| |3.746609|4.388079|3.773709|3.779336|4.425142|5.576050|5.567531|5.668985|7.568006|7.353212|5.401105|5.532286|7.536005|10.572011|12.438989|0.249712|36.858105| |3.495481|4.206707|3.914085|4.100987|4.739803|5.330995|4.945351|4.449882|6.226198|5.072451|3.952727|4.103056|5.994425|7.494277|7.475931|0.205308|13.712977|36.858105| |2.851975|3.400145|3.312269|3.646880|4.297679|4.518534|3.932054|3.562807|5.271110|3.871833|3.205358|3.303986|5.049182|5.596761|4.973954|0.133659|7.863897|13.768596|36.858105| |2.543825|2.978829|2.854018|3.131280|3.764995|4.084199|3.528493|3.368492|5.129343|3.661770|3.140803|3.202373|4.966328|5.171738|4.391299|0.110961|6.786884|7.944893|13.745175|36.858105| |2.632026|3.037842|2.795449|2.979724|3.603557|4.195192|3.733334|3.812906|5.803771|4.294421|3.735019|3.757554|5.740763|5.919381|4.973859|0.116508|7.858785|6.908648|7.954304|13.721345|36.858105| |3.117629|3.580148|3.137411|3.220662|3.861973|4.831108|4.575423|4.970035|7.159416|6.153156|5.095451|5.079365|7.251359|8.325630|7.489064|0.155888|13.735973|8.033140|6.913459|7.937978|13.737429|36.858105| |2.185217|2.526426|2.483347|2.758607|3.252543|3.360156|2.901686|2.756450|4.339542|2.914352|2.578567|2.623645|4.191284|4.093361|3.345277|0.086986|4.575310|5.280773|8.173609|14.016018|7.837342|5.185370|73.516695| |1.965433|2.235132|2.178836|2.393477|2.803996|2.933219|2.568216|2.510678|4.055395|2.641088|2.406550|2.429989|3.949834|3.659039|2.909098|0.074574|3.776780|3.992300|5.266116|8.019119|6.739592|4.523036|24.297024|36.858105| |3.202605|3.200589|2.792969|2.614685|2.737262|3.130215|3.453216|3.770968|5.573741|5.106998|5.115050|7.802590|12.046421|18.005502|7.429845|0.187499|6.138917|5.161554|4.035067|3.659782|3.962622|5.015201|5.278544|2.633528|36.858105| |3.285599|3.136251|2.776296|2.532374|2.548960|2.828621|3.181184|3.361984|5.070472|4.255402|4.243638|5.819799|9.716900|10.531567|5.633317|0.166909|4.529236|4.192210|3.358721|2.975699|3.085903|3.699307|4.459975|2.231052|12.449026|36.858105| |2.687655|2.601296|2.390972|2.227037|2.229935|2.403876|2.614514|2.695470|4.175469|3.241737|3.239044|4.175273|7.410742|6.912986|4.078544|0.119592|3.649426|3.587081|3.054490|2.724682|2.749224|3.122113|4.212440|2.116772|7.680152|13.075806|53.358707| |2.626239|2.508209|2.358161|2.178788|2.128667|2.242101|2.438475|2.448423|3.836513|2.826524|2.773896|3.351859|5.888401|5.344417|3.431463|0.104796|3.088949|3.145212|2.722534|2.401396|2.373360|2.641900|3.786405|1.901835|5.088768|7.856291|17.879163|36.858105| |2.184860|2.119431|2.031932|1.915663|1.878635|1.950613|2.073913|2.070690|3.296254|2.343539|2.311192|2.732361|4.882309|4.233881|2.775986|0.082625|2.616105|2.708985|2.449516|2.193601|2.141471|2.311402|3.547163|1.797086|3.919539|5.075348|10.672673|12.532998|36.858105| |1.985711|1.917011|1.822290|1.723518|1.706928|1.786994|1.898257|1.931252|3.111029|2.194728|2.220765|2.651922|4.898190|3.973369|2.542701|0.073571|2.396576|2.420540|2.215525|2.036619|2.020708|2.174524|3.315904|1.708899|3.658720|4.522779|9.186763|7.896827|13.604063|73.516695| |2.009327|1.953762|1.834091|1.743349|1.752997|1.859984|1.972415|2.039716|3.275271|2.364300|2.430170|2.994084|5.650478|4.481317|2.762336|0.077888|2.617406|2.591842|2.370916|2.210432|2.224998|2.405881|3.571918|1.850158|4.309178|5.072935|10.664841|6.807814|8.195453|24.152385|36.858105| |2.331079|2.240660|2.058010|1.930126|1.947342|2.104613|2.274603|2.396360|3.802480|2.863590|2.991691|3.887803|7.455904|5.881954|3.404707|0.095416|3.090667|2.961966|2.613361|2.423719|2.490947|2.788641|3.816820|1.966306|6.068717|7.845611|17.842268|8.024960|6.810571|14.039653|12.539528|36.858105| |3.788064|3.568275|2.843494|2.588033|2.781822|3.464948|4.159370|6.171261|11.090247|7.879210|15.777073|7.973689|11.731510|7.495927|5.282382|0.122256|4.096016|3.190923|2.705635|2.702987|3.189276|4.076062|4.064369|2.181034|3.986246|3.476292|3.783848|2.431777|2.068058|3.583857|2.194713|2.650284|73.516695| |3.939442|5.266412|8.173629|13.988693|7.846541|5.191158|4.588060|3.355049|5.408921|2.925525|2.411331|2.231423|3.488505|3.367662|3.016360|0.093041|3.089602|3.431108|3.201911|2.767990|2.578095|2.699641|4.496904|2.207378|2.283703|2.247939|2.763614|2.021901|1.810163|2.889420|1.626735|1.770790|3.888266|73.516695| |3.110640|3.972661|5.257495|7.998593|6.724780|4.510615|3.776016|2.910806|4.752546|2.593147|2.174770|2.032647|3.208535|3.058949|2.692531|0.080746|2.869555|3.239237|3.199232|2.811221|2.559616|2.585569|4.713825|2.315635|2.102131|2.041546|2.551716|1.857167|1.691806|2.716567|1.534666|1.651160|3.531238|24.227356|36.858105| |2.667467|3.198190|4.093049|5.243680|4.424131|3.350180|2.975284|2.404290|3.984991|2.187766|1.883078|1.785500|2.861492|2.666589|2.277434|0.068352|2.392430|2.685238|2.675894|2.376455|2.166092|2.175341|4.071224|2.027869|1.866733|1.843351|2.344951|1.733222|1.600727|2.569942|1.437173|1.527100|3.089136|14.460956|12.699105|36.858105| |2.310488|2.700115|3.302982|4.038244|3.616975|2.863362|2.557390|2.128573|3.593236|1.940570|1.697141|1.607563|2.599327|2.370528|1.994184|0.058929|2.093823|2.309016|2.331702|2.126360|1.954816|1.944656|3.706088|1.882788|1.662616|1.637851|2.097554|1.548237|1.443487|2.339123|1.309295|1.382960|2.817184|9.766417|7.634281|14.460035|36.858105| |17.557075|8.834013|5.912405|4.292449|3.951823|4.582162|6.665590|6.463233|9.474586|6.085157|4.922915|4.323685|6.350153|6.288223|5.614221|0.191824|4.101342|3.739625|2.968997|2.631498|2.744375|3.323956|3.973268|2.003437|3.789903|3.983851|4.259156|3.029943|2.449545|3.942416|2.252793|2.672823|7.478876|6.151981|2.821752|2.446878|2.126807|0.500000| |17.579472|8.883303|5.898556|4.303231|3.983640|4.642559|6.772006|6.718828|11.820238|5.213308|4.387261|3.565598|5.395399|4.862395|4.270465|0.129469|3.416887|3.106105|2.593580|2.378252|2.506028|2.962502|3.660184|1.882344|2.949945|2.975753|3.340843|2.375800|2.002302|3.289257|1.884317|2.181681|7.293274|6.149998|2.818672|2.435624|2.154427|0.303730|0.500000| |17.560737|8.842606|7.320434|4.771502|3.974339|4.191248|5.553376|4.738929|7.701183|4.110327|3.469194|3.095800|4.778776|4.455429|3.867593|0.126433|3.200512|3.098500|2.590529|2.302414|2.339831|2.698742|3.578933|1.812965|2.862464|3.023738|3.463709|2.558743|2.147060|3.449051|1.932642|2.210525|5.615393|7.089381|3.098817|2.732549|2.363098|0.300682|0.300101|0.500000| |7.009946|8.897537|17.712968|8.980781|5.674774|4.991477|5.622990|4.067118|6.483938|3.479977|2.846195|2.597278|4.021310|3.885731|3.491066|0.113628|3.213972|3.359627|2.898013|2.509559|2.444221|2.708778|3.953088|1.965340|2.577273|2.637134|3.139858|2.327538|2.014436|3.198481|1.787375|1.989574|4.565209|13.537807|4.887389|4.124552|3.329647|0.152994|0.151668|0.224527|0.500000| |3.542920|4.928408|5.632160|8.866006|17.751975|8.925156|5.628573|4.087224|6.467193|3.499444|2.792973|2.523936|3.874255|3.820175|3.561347|0.102192|4.026065|4.425110|4.349623|3.914288|3.635305|3.686994|6.224849|3.017354|2.514577|2.324340|2.821195|1.977049|1.772850|2.876953|1.664684|1.827303|4.455608|12.412647|7.418607|4.696420|3.910824|0.090091|0.090767|0.090441|0.124284|0.500000| |4.097205|5.656962|4.991646|5.677946|8.947872|17.719211|8.980315|7.028209|10.316969|5.575295|4.081995|3.429302|5.036926|5.118948|5.149635|0.133599|5.910748|5.366629|4.782348|4.632493|4.984204|5.661974|6.674491|3.325368|3.111108|2.725221|3.174387|2.142043|1.881665|3.097308|1.833627|2.070330|6.324191|7.447365|3.911219|2.991930|2.627221|0.107679|0.109144|0.096214|0.108181|0.217468|0.500000| |3.808203|4.581853|4.383969|4.481127|4.826804|5.131571|4.986862|4.268744|5.984290|4.740761|3.706662|3.869065|5.712517|7.077972|6.950532|0.228087|8.924925|17.694964|8.969575|5.659750|4.968907|5.683717|7.604151|3.337292|5.055405|4.473079|5.207754|3.468062|2.932751|4.533492|2.670655|3.048277|5.359738|6.703110|3.455354|2.882638|2.431111|0.114170|0.090842|0.095274|0.105697|0.121281|0.132737|0.500000| |2.650351|3.141836|3.185274|3.573387|4.067739|3.993199|3.477300|3.083781|4.660939|3.263332|2.754675|2.842243|4.437636|4.714492|4.057614|0.114161|5.604882|8.870826|17.722835|8.967331|5.663955|4.973473|13.439630|4.869256|3.503285|3.065213|3.917146|2.639873|2.421460|3.855448|2.283693|2.460510|4.214744|5.815148|3.356148|2.850929|2.470837|0.075877|0.066634|0.068338|0.078917|0.117340|0.113500|0.215072|0.500000| |2.361704|2.678762|2.474277|2.630758|3.148846|3.620798|3.251167|3.398768|5.381567|3.755762|3.426140|3.412443|5.372527|5.092932|4.079659|0.096550|5.630622|4.973375|5.640481|8.858074|17.748912|8.960216|12.447021|7.469988|3.434048|2.725536|3.355322|2.140221|1.957117|3.330774|2.068417|2.291522|5.392439|4.108198|2.315828|1.985159|1.818844|0.067928|0.063507|0.058716|0.060760|0.089379|0.120127|0.107842|0.124171|0.500000| |3.064976|3.410241|2.924960|2.938687|3.468137|4.403628|4.368758|5.211451|7.755923|6.726380|6.078843|5.794160|8.205487|8.487195|6.982026|0.140990|8.953860|5.689508|4.973869|5.655488|8.953959|17.726372|7.442272|3.921962|4.818272|3.560482|4.052449|2.510817|2.195863|3.732750|2.337540|2.734182|8.690708|4.393226|2.351888|1.999116|1.805859|0.091057|0.083098|0.073163|0.070724|0.091277|0.143678|0.124673|0.107888|0.217753|0.500000| |2.005903|2.297266|2.228275|2.462863|2.941961|3.113287|2.681607|2.635156|4.304225|2.721149|2.470894|2.431730|3.930137|3.600438|2.905888|0.073856|3.731926|3.803838|4.773035|7.042344|6.751871|4.593372|16.446092|17.546482|2.521516|2.141007|2.727174|1.805908|1.693311|2.868611|1.741556|1.865919|4.016681|4.004604|2.367789|2.052118|1.915361|0.056306|0.053834|0.051128|0.055433|0.088849|0.100841|0.088440|0.119974|0.225061|0.113596|0.500000| |1.905731|2.131155|2.050576|2.207527|2.547419|2.712690|2.441791|2.446556|3.960572|2.631964|2.453238|2.523925|4.152748|3.773196|2.907460|0.073545|3.728419|3.799952|4.767647|7.038466|6.749942|4.589139|16.445508|17.545311|2.749215|2.295060|2.980855|1.941898|1.841961|3.146784|1.940950|2.061485|3.960899|3.606841|2.094715|1.851010|1.720179|0.054499|0.050898|0.048756|0.051657|0.074437|0.084842|0.088295|0.119788|0.225054|0.113350|0.299391|0.500000| |1.801471|2.036712|2.014004|2.220664|2.558749|2.609689|2.295408|2.222859|3.627877|2.311787|2.121314|2.144423|3.524093|3.207364|2.529063|0.066039|3.169262|3.409835|4.409736|5.871002|4.905487|3.620289|17.012263|17.620095|2.336890|2.024908|2.652349|1.774314|1.697275|2.871767|1.735163|1.818538|3.452229|3.714085|2.222286|1.977556|1.854961|0.050773|0.047935|0.046639|0.050993|0.077181|0.080551|0.082122|0.120893|0.146016|0.089150|0.299975|0.299992|0.500000| |3.044419|3.163004|2.832542|2.718576|2.875094|3.235763|3.437099|3.588393|5.276449|4.651649|4.358061|5.817954|8.976773|12.513113|7.047965|0.183064|7.023452|6.405696|4.953206|4.333748|4.513922|5.538253|6.117682|2.961779|17.593607|8.879400|9.563483|4.895146|3.938408|6.357946|4.163290|5.358482|6.161645|4.243772|2.223096|1.967332|1.743976|0.097429|0.077044|0.076248|0.072196|0.074230|0.089865|0.170875|0.117897|0.105131|0.136945|0.077225|0.085777|0.072563|0.500000| |2.779288|2.760858|2.433066|2.302015|2.422677|2.755077|2.991670|3.325435|5.087113|4.397252|4.739789|7.454407|13.586112|12.687091|5.652353|0.138721|5.023677|4.244402|3.552880|3.384392|3.742777|4.576560|5.002643|2.564558|17.631552|8.815198|9.433776|4.575556|3.738488|6.568044|4.604049|6.610319|6.885280|3.618130|1.896542|1.698412|1.529504|0.089443|0.072808|0.069642|0.062786|0.062716|0.077428|0.112283|0.086505|0.093396|0.127742|0.068104|0.075902|0.063368|0.302461|0.500000| |3.330052|3.053134|2.662407|2.392673|2.394996|2.676107|3.069452|3.344262|5.148968|4.225603|4.475245|6.247998|11.138607|9.667946|5.102524|0.147582|3.951851|3.555903|2.905817|2.639014|2.785756|3.345207|4.003276|2.038953|8.848735|17.465988|12.237143|6.618567|4.493733|7.527198|4.689216|7.311936|6.663488|3.775237|1.919225|1.739950|1.556235|0.113824|0.085455|0.085124|0.070795|0.060451|0.071568|0.103801|0.073838|0.069679|0.092620|0.054977|0.058305|0.051585|0.173937|0.210366|0.500000| |3.780413|3.602298|3.196096|2.862008|2.824407|3.104813|3.542532|3.599438|5.328672|4.436972|4.140555|5.183910|8.152857|9.599446|6.049840|0.203281|4.748641|4.585194|3.553171|3.036978|3.078930|3.687564|4.531619|2.232338|8.921120|17.564028|12.541603|7.652607|4.850997|7.222304|4.241615|5.730693|5.988674|4.490419|2.256221|2.029216|1.781434|0.130072|0.091799|0.097143|0.084656|0.070512|0.081029|0.144959|0.091024|0.074517|0.096329|0.059686|0.062753|0.056432|0.215303|0.174176|0.302490|0.500000| |2.661449|2.470322|2.306089|2.099676|2.034565|2.149290|2.371008|2.404923|3.812236|2.754361|2.749684|3.288248|5.870633|5.028390|3.226620|0.098438|2.826661|2.817175|2.438526|2.178627|2.180194|2.441441|3.447541|1.750429|4.512317|6.954680|12.241181|17.399563|8.881601|12.466340|5.884766|7.099885|4.347406|3.464465|1.777068|1.664740|1.492993|0.085884|0.067356|0.072690|0.063853|0.052228|0.056796|0.085708|0.065432|0.055106|0.065518|0.046612|0.049570|0.045432|0.115138|0.114918|0.190620|0.189028|0.500000| |2.854143|2.751915|2.621698|2.412519|2.326169|2.421439|2.631819|2.573518|3.989315|2.931065|2.783233|3.269272|5.544024|5.352544|3.621085|0.115172|3.276393|3.446142|2.943272|2.527176|2.454891|2.729915|3.967570|1.964268|4.905508|7.223113|12.482436|17.556402|8.911856|10.160403|5.058057|5.744709|4.298160|3.989663|2.044936|1.907492|1.686146|0.091398|0.070263|0.077896|0.072264|0.059680|0.063417|0.109734|0.080209|0.060782|0.070899|0.051802|0.055083|0.050938|0.136978|0.116650|0.162778|0.235387|0.300683|0.500000| |2.100052|2.024988|1.963883|1.846921|1.790607|1.839464|1.954649|1.933978|3.103263|2.149671|2.110917|2.435678|4.335346|3.715485|2.497966|0.074969|2.352367|2.450572|2.232926|2.000319|1.943906|2.085257|3.265460|1.659615|3.288981|4.170216|7.687171|8.832006|17.587575|16.910003|5.885644|5.064800|3.392785|3.137278|1.647722|1.576037|1.424344|0.064805|0.053457|0.058158|0.054753|0.046974|0.049006|0.074199|0.061952|0.049570|0.055146|0.043624|0.046934|0.043830|0.091558|0.086762|0.106581|0.115580|0.216982|0.210821|0.500000| |2.123710|2.102978|2.034978|1.947082|1.921643|1.982072|2.075611|2.052027|3.252763|2.316441|2.254802|2.649336|4.673932|4.175211|2.781194|0.082450|2.706359|2.870464|2.639454|2.346809|2.253012|2.394978|3.818088|1.918448|3.895448|4.717989|9.568314|8.888263|17.492454|16.550804|7.264548|5.906638|3.570017|3.284441|1.743294|1.649352|1.485380|0.065503|0.053929|0.057759|0.055718|0.050759|0.053345|0.086270|0.073365|0.056964|0.062345|0.049704|0.054630|0.050481|0.114303|0.102835|0.111637|0.127070|0.173997|0.217920|0.300053|0.500000| |1.849218|1.791531|1.680644|1.600357|1.613094|1.713224|1.813815|1.891125|3.073466|2.177548|2.272712|2.773621|5.353241|4.012239|2.480978|0.069088|2.353881|2.304920|2.132230|2.022107|2.053933|2.207550|3.298324|1.732819|3.698855|4.168875|7.684373|5.065637|5.888407|16.907212|17.593963|8.838929|3.711724|2.661283|1.417332|1.331315|1.220832|0.057185|0.048697|0.049454|0.045547|0.042700|0.047148|0.065224|0.056988|0.053755|0.060360|0.045496|0.050718|0.045303|0.097969|0.112890|0.112540|0.098052|0.132094|0.110723|0.132283|0.147302|0.500000| |1.953066|1.932460|1.826633|1.758045|1.780748|1.881765|1.968046|2.019450|3.230325|2.336441|2.370102|2.898685|5.375016|4.422760|2.765125|0.077466|2.706328|2.723821|2.535699|2.367500|2.355408|2.505315|3.849209|1.986408|4.297034|4.711626|9.549917|5.900398|7.261511|16.544991|17.495011|8.879370|3.785527|2.923450|1.564566|1.463734|1.333395|0.060327|0.050761|0.052032|0.049189|0.047313|0.051836|0.077328|0.068212|0.060737|0.066784|0.051366|0.058196|0.051836|0.121794|0.127621|0.115604|0.111858|0.134596|0.132100|0.147266|0.216036|0.300073|0.500000| |2.288776|2.222889|2.024952|1.914160|1.960299|2.143211|2.303941|2.469815|3.922080|3.002415|3.204797|4.312295|8.571898|6.411640|3.562429|0.096057|3.274317|3.055932|2.711566|2.568461|2.693083|3.029575|4.022426|2.090615|6.788193|7.198294|12.427665|5.740355|5.055310|10.162502|8.917099|17.599834|5.039050|3.101638|1.635837|1.502979|1.365076|0.072563|0.060084|0.059532|0.053797|0.051294|0.059352|0.084873|0.069815|0.069280|0.083574|0.055071|0.061668|0.053303|0.162265|0.239613|0.187708|0.143781|0.143820|0.127783|0.110673|0.131987|0.211316|0.217173|0.500000| |2.341188|2.201189|2.009795|1.863582|1.866480|2.021096|2.211984|2.353373|3.777802|2.791833|2.976955|3.829899|7.562394|5.502651|3.204680|0.090176|2.829201|2.676782|2.355312|2.196803|2.276627|2.564044|3.472517|1.803723|5.207827|6.962220|12.272283|7.129900|5.903467|12.491746|8.884355|17.413556|4.771989|3.040210|1.585116|1.470629|1.335721|0.074935|0.061371|0.061968|0.054347|0.048427|0.054969|0.076783|0.061637|0.058633|0.070944|0.048031|0.052284|0.046455|0.123252|0.155355|0.214478|0.147070|0.210367|0.144180|0.132378|0.134960|0.216851|0.173908|0.301650|0.500000| |2.961053|3.770520|4.749813|7.024756|6.746764|4.570451|3.717590|2.905458|4.843383|2.545449|2.145592|1.978702|3.128189|2.936654|2.578570|0.075664|2.757471|3.029206|3.023719|2.747432|2.540874|2.548812|4.643796|2.324443|1.997673|1.919416|2.392737|1.726540|1.576452|2.556730|1.453049|1.565017|3.520199|16.486586|17.543720|8.909294|7.228112|0.074135|0.076458|0.080829|0.119940|0.225409|0.113043|0.087045|0.086450|0.064715|0.065083|0.067154|0.058156|0.061991|0.058331|0.050505|0.050489|0.058232|0.046069|0.052223|0.042542|0.045005|0.037489|0.041123|0.043357|0.041848|0.500000| |2.997740|3.834804|4.836151|7.178875|6.884272|4.654390|3.784982|2.938184|4.707114|2.677522|2.233533|2.113455|3.326366|3.228406|2.856231|0.085425|3.150505|3.697331|3.763522|3.231379|2.848652|2.826387|5.442113|2.607021|2.237592|2.149360|2.697023|1.949893|1.780556|2.848418|1.615765|1.735214|3.588273|16.581296|17.511316|8.941980|6.094285|0.077420|0.075007|0.081565|0.121543|0.227483|0.114721|0.109414|0.112825|0.070707|0.069997|0.073386|0.064676|0.069501|0.066798|0.055889|0.055429|0.065959|0.051250|0.059831|0.047890|0.051449|0.041278|0.046107|0.047877|0.045859|0.301097|0.500000| |2.681780|3.151488|4.046947|4.888607|4.005499|3.133351|2.867061|2.332185|3.835406|2.153355|1.860544|1.784674|2.868284|2.681657|2.273084|0.069161|2.364676|2.678896|2.642252|2.311280|2.099673|2.122365|3.942817|1.952244|1.898454|1.900720|2.433974|1.821170|1.684521|2.682505|1.487893|1.575321|3.040460|13.064738|8.709431|17.679759|9.154833|0.068986|0.067130|0.077525|0.117646|0.113504|0.077355|0.081574|0.078912|0.053208|0.054085|0.054271|0.049884|0.052894|0.055645|0.047799|0.049684|0.058560|0.048550|0.056157|0.046348|0.048247|0.038151|0.042053|0.042754|0.042129|0.172475|0.203913|0.500000| |2.106966|2.402765|2.887103|3.375690|3.031308|2.483363|2.264369|1.919184|3.251847|1.768721|1.564409|1.493023|2.431809|2.194572|1.821778|0.053838|1.900737|2.089517|2.111160|1.932124|1.779848|1.769659|3.388334|1.732138|1.552462|1.540829|1.990485|1.479623|1.390041|2.254724|1.255687|1.317637|2.607104|7.816111|5.478189|9.102674|17.710523|0.054297|0.054732|0.060372|0.082361|0.089390|0.063780|0.061245|0.062329|0.046218|0.045843|0.048660|0.044245|0.047688|0.045146|0.039839|0.040754|0.046425|0.039718|0.044691|0.038313|0.039717|0.032590|0.035498|0.036015|0.035411|0.142711|0.130942|0.218129|0.500000| 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