Version2.4 2021-05-29T14:01:28Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 10-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCOc1cc(ccc1OCC=C)[C@@H]2C(=C(C(=O)N2CCOC)[O-])C(=O)c3ccc(cc3)Cl C35275280 RHF 6-31G(d) (6D,7F) CCOc1cc(ccc1OCC=C)[C@@H]2C(=C(C(=O)N2CCOC)[O-])C(=O)c3ccc(cc3)Cl C01[X(C25H25Cl1N1O6)] 168 C1 549 COCCN1[C@H](c2ccc(c(c2)OCC)OCC=C)C(=C(C1=O)[O-])C(=O)c1ccc(cc1)Cl COCCN1[C@H](c2ccc(c(c2)OCC)OCC=C)C(=C(C1=O)[O-])C(=O)c1ccc(cc1)Cl CCOc1cc(ccc1OCC=C)[C@H]2N(CCOC)C(=O)C(=C2C(=O)c3ccc(Cl)cc3)[O-] InChIKey=VJLIHFIVGGNIJL-JOCHJYFZSA-M InChI=1S/C25H26ClNO6/c1-4-13-33-19-11-8-17(15-20(19)32-5-2)22-21(23(28)16-6-9-18(26)10-7-16)24(29)25(30)27(22)12-14-31-3/h4,6-11,15,22,29H,1,5,12-14H2,2-3H3/p-1/t22-/m1/s1 InChI=1/C25H26ClNO6/c1-4-13-33-19-11-8-17(15-20(19)32-5-2)22-21(23(28)16-6-9-18(26)10-7-16)24(29)25(30)27(22)12-14-31-3/h4,6-11,15,22,29H,1,5,12-14H2,2-3H3/p-1/t22-/m1/s1/fC25H25ClNO6/h29h/q-1 CCOc1cc(ccc1OCC=C)[C@@H]2C(=C(C(=O)N2CCOC)[O-])C(=O)c3ccc(cc3)Cl C01[X(C25H25Cl1N1O6)] 168 C01 549 COCCN1[C@H](c2ccc(c(c2)OCC)OCC=C)C(=C(C1=O)[O-])C(=O)c1ccc(cc1)Cl COCCN1[C@H]([C]2[CH][CH][C]([C]([CH]2)OCC)OCC=C)[C]([C](=O)C1=O)[C](=O)[C]1[CH][CH][C]([CH][CH]1)Cl CCO[C]1[CH][C]([CH][CH][C]1OCC=C)[C@@H]2[C](C(=O)[C]3[CH][CH][C](Cl)[CH][CH]3)C(=O)C(=O)N2CCOC InChIKey=OMIJETMSEIDOIZ-JOCHJYFZSA-N InChI=1S/C25H25ClNO6/c1-4-13-33-19-11-8-17(15-20(19)32-5-2)22-21(23(28)16-6-9-18(26)10-7-16)24(29)25(30)27(22)12-14-31-3/h4,6-11,15,22H,1,5,12-14H2,2-3H3/t22-/m1/s1 InChI=1/C25H25ClNO6/c1-4-13-33-19-11-8-17(15-20(19)32-5-2)22-21(23(28)16-6-9-18(26)10-7-16)24(29)25(30)27(22)12-14-31-3/h4,6-11,15,22H,1,5,12-14H2,2-3H3/t22-/m1/s1 3588.4912671641 -1924.3476452 1-A 16667.3310 124 425 549 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86.2709 96.2871 102.5726 109.3804 113.6547 116.2546 125.0132 137.0028 160.2131 196.4140 201.3257 211.3809 238.6598 252.3710 258.3068 267.0399 277.1466 286.4523 304.3999 327.4635 336.8843 349.8810 353.3244 361.3447 381.7327 397.8192 412.1863 451.3011 462.0417 479.6326 480.4138 518.5527 520.5360 553.4486 588.6494 601.1093 618.2710 624.8349 643.3593 671.6104 683.2546 691.2549 709.8322 747.9884 787.4478 794.3675 815.0212 847.1704 852.2957 862.2045 880.2387 896.8586 903.4236 912.2996 919.4199 936.2161 943.0968 959.8547 986.9502 999.5450 1018.9724 1019.6020 1057.7440 1063.9599 1070.2444 1085.0006 1098.8643 1099.4605 1101.9941 1111.2650 1128.6010 1149.5670 1164.4708 1167.1724 1185.7246 1194.4940 1195.8212 1222.4360 1224.3307 1254.0089 1274.4190 1277.7292 1281.4370 1282.9843 1289.2547 1296.4604 1300.4029 1300.9457 1310.4831 1325.1023 1353.5660 1372.5871 1376.7101 1381.5106 1395.9259 1404.7429 1429.7774 1431.7402 1436.9292 1442.1484 1445.4286 1482.3943 1494.2152 1529.4751 1538.2336 1543.4538 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69.7442 40.4299 37.4427 14.7950 20.2113 63.2035 47.9999 51.1516 52.3934 23.7413 19.7566 6.3393 7.3274 16.1263 5.0388 12.8117 26.4359 1.0302 7.5412 30.4470 2.3016 0.8935 0.5768 0.6708 1.6535 3.9293 2.4598 1.7497 3.3968 4.8637 1.8223 3.1512 1.1600 0.2078 0.6229 0.7824 1.1798 3.1020 1.3403 1.0053 0.8356 1.3356 1.2603 0.7145 0.7903 1.7091 6.2778 1.5776 3.0772 0.9269 0.9668 1.6213 1.4603 1.3717 0.1716 2.6631 1.7518 2.1989 2.4923 0.9029 2.4453 3.6140 2.0763 0.3596 0.6480 0.7135 0.7748 3.3146 2.6411 1.0790 6.3940 1.0647 3.2610 9.6392 7.0140 1.1477 7.1909 2.3607 7.1039 6.8645 5.1358 2.0863 17.3021 0.6070 2.1535 14.9515 3.7172 1.6912 0.8621 6.8624 2.0476 7.6967 4.3293 3.5068 2.9932 1.4026 2.3115 3.5603 2.3245 0.2951 0.9179 4.0410 5.7395 1.2068 5.2485 3.4383 9.0244 9.1688 12.6134 3.2467 5.1311 3.0450 1.1475 2.2639 2.4288 7.9168 8.6226 0.8662 3.4072 16.7985 3.4636 11.2710 9.0771 5.6872 32.7967 16.9319 5.6818 22.3126 19.0430 4.6839 1.4786 13.0495 11.9743 9.0486 14.3534 6.8406 3.3476 1.1418 4.4825 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1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 1.00783 12.00000 12.00000 12.00000 15.99491 14.00307 12.00000 12.00000 15.99491 12.00000 15.99491 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 34.96885 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 1.00783 15273.7639 20008.6810 24838.2650 0.99887 0.03940 -0.02670 -0.03973 0.99914 -0.01173 0.02621 0.01277 0.99957 1 0.00567 0.00433 0.00349 0.11816 0.09020 0.07266 15.77 23.23 28.55 34.14 43.55 62.53 74.36 75.96 83.90 97.16 104.76 124.12 138.54 147.58 157.37 163.52 167.26 179.87 197.12 230.51 282.60 289.66 304.13 343.38 363.11 371.65 384.21 398.75 412.14 437.96 471.15 484.70 503.40 508.35 519.89 549.23 572.37 593.04 649.32 664.77 690.08 691.21 746.08 748.94 796.29 846.94 864.86 889.55 899.00 925.65 966.30 983.05 994.56 1021.29 1076.19 1132.96 1142.92 1172.63 1218.89 1226.26 1240.52 1266.47 1290.38 1299.83 1312.60 1322.84 1347.01 1356.91 1381.02 1420.00 1438.12 1466.07 1466.98 1521.86 1530.80 1539.84 1561.07 1581.02 1581.88 1585.52 1598.86 1623.81 1653.97 1675.41 1679.30 1705.99 1718.61 1720.52 1758.81 1761.54 1804.24 1833.60 1838.37 1843.70 1845.93 1854.95 1865.32 1870.99 1871.77 1885.49 1906.53 1947.48 1974.85 1980.78 1987.69 2008.43 2021.11 2057.13 2059.95 2067.42 2074.93 2079.65 2132.83 2149.84 2200.57 2213.18 2220.69 2221.47 2229.03 2270.77 2282.32 2298.26 2307.11 2312.54 2339.93 2343.71 2351.74 2366.94 2367.87 2384.63 2395.09 2401.09 2415.83 2421.58 2453.60 2534.58 2577.96 2585.01 2594.36 2609.00 2712.10 2797.59 2811.90 4527.00 4555.27 4578.31 4599.72 4619.55 4622.97 4645.07 4648.68 4656.58 4666.27 4674.02 4709.30 4729.58 4734.03 4740.01 4783.71 4826.69 4857.56 4864.68 4868.14 4883.05 4889.82 4891.92 4896.16 4897.14 0.492508 0.523324 0.524269 0.424323 -1923.855137 -1923.824321 -1923.823377 -1923.923322 3.352172D-04 MUNgauss RevisionA2.1 retrievium 29-May-2021 DUDE CCOc1cc(ccc1OCC=C)[C@@H]2C(=C(C(=O)N2CCOC)[O-])C(=O)c3ccc(cc3)Cl C35275280 RHF 6-31G(d) (6D,10F) C1 470.137041 |X|Y|Z| 90.490204 73.576331 55.364381 71.700698 18 6 7 17 1 |36.858105| |12.565459|36.858105| |8.097823|13.592360|73.516695| |5.237360|8.000194|25.009047|36.858105| |4.406267|6.713953|13.989269|13.780125|36.858105| |3.337950|4.506218|9.181708|7.853723|13.664266|36.858105| |2.986134|3.802791|8.206950|6.867103|8.003464|13.806724|36.858105| |3.206375|3.993475|9.397585|7.948790|6.930828|7.914815|13.710118|36.858105| |4.090985|5.251534|14.489900|13.618672|7.933429|6.796334|7.903918|13.787621|36.858105| |4.135537|4.782005|13.040784|8.136609|5.275253|4.580107|5.173767|7.848685|14.024062|73.516695| |3.219208|3.542708|8.487685|5.247019|3.988542|3.780767|4.514524|6.728239|8.012623|24.247264|36.858105| |3.120538|3.212453|7.324655|4.087323|3.203991|2.976038|3.350642|4.425777|5.252249|14.477688|12.698302|36.858105| |2.697950|2.723775|5.901983|3.291159|2.699406|2.556791|2.865358|3.618170|4.036906|9.755581|7.635909|14.460483|36.858105| |2.841094|3.670938|6.830096|4.983247|7.506986|12.433902|7.491470|4.983532|4.394581|5.951391|2.909805|2.403076|2.124541|36.858105| |3.031897|3.976250|6.975721|4.839780|7.457617|8.992105|5.617631|4.209646|4.006138|5.580836|2.688857|2.273693|2.014452|17.573660|0.500000| |2.439774|3.015749|5.586280|3.902081|5.131807|7.384366|6.122947|4.290242|3.673586|5.197480|2.637231|2.200069|1.992550|12.512438|0.241173|36.858105| |2.106317|2.527936|4.706257|3.201405|3.957643|5.386327|5.051651|3.707377|3.128176|4.568866|2.393250|2.017934|1.843288|7.895044|0.167288|13.457448|36.858105| |2.138707|2.574636|4.810204|3.270774|4.068245|5.489880|5.044877|3.724324|3.171094|4.623062|2.414553|2.039048|1.839723|8.070553|0.173026|8.091693|12.369191|36.858105| |1.928013|2.270722|4.231929|2.801868|3.335071|4.203208|4.044256|3.190073|2.756209|4.137372|2.200876|1.886889|1.713575|5.426276|0.128227|5.407968|7.716832|15.830996|73.516695| |2.496044|3.105350|5.816344|4.073920|5.443627|7.739673|6.167507|4.360583|3.783627|5.325632|2.691230|2.247780|1.991498|13.045642|0.255953|8.192289|8.167482|14.099876|14.955377|53.358707| |2.543509|3.136243|5.846536|3.961446|5.047222|6.105051|5.068748|3.980210|3.631561|5.238490|2.640703|2.239722|1.965530|7.438047|0.189206|5.111121|5.121090|7.823382|12.093347|18.021293|36.858105| |2.392097|2.880629|5.115051|3.269468|4.049141|4.444529|3.697740|3.078489|2.934189|4.402951|2.226996|1.947261|1.730969|5.533828|0.163228|4.214121|4.253690|5.925655|10.092647|10.469711|12.537782|36.858105| |2.665541|3.262359|5.534997|3.461783|4.413510|4.521760|3.558103|3.000382|2.964161|4.447647|2.202088|1.940157|1.724892|5.660549|0.193248|4.216007|3.936483|4.865463|7.768533|8.706496|7.975911|13.595713|73.516695| |2.401903|2.827761|4.694549|2.830667|3.433577|3.449758|2.841099|2.469667|2.461592|3.804599|1.908129|1.714239|1.543056|4.174360|0.138651|3.444542|3.295124|3.868595|6.484330|6.172788|5.205504|8.141188|24.400027|36.858105| |1.871504|2.194951|4.074336|2.703363|3.195992|4.087311|4.040647|3.162259|2.691773|4.049721|2.166067|1.851524|1.715813|5.278044|0.122455|7.882302|15.769618|7.969481|11.712997|7.497343|3.989568|3.493689|5.751542|2.837027|73.516695| |2.432832|2.965518|5.426804|3.690732|4.607069|5.856056|5.143893|3.947955|3.487096|5.054545|2.568965|2.165639|1.989911|7.291544|0.176180|13.370796|7.570565|5.088756|6.949043|6.989527|3.760511|3.282279|6.064470|2.932190|10.988003|36.858105| |2.157494|2.549939|4.686335|3.103391|3.642218|4.429299|4.250106|3.452822|3.038073|4.555962|2.380176|2.030247|1.897911|5.098278|0.126030|8.068521|6.404593|4.301467|6.222948|5.550981|3.132283|2.783896|5.049369|2.516272|11.022219|15.688271|73.516695| |2.819836|3.495104|6.165777|4.089317|5.124410|5.673540|4.662253|3.836951|3.647919|5.321967|2.620110|2.235989|2.049136|6.259924|0.175989|7.520747|4.932442|3.941540|5.628790|5.859760|3.415700|3.075013|5.991314|2.933565|7.421816|12.483964|14.614892|36.858105| |2.918041|3.530497|6.329486|4.094028|4.664775|4.832674|4.326827|3.853368|3.759973|5.640359|2.781280|2.385103|2.210490|4.651986|0.127581|5.216842|3.849216|3.195915|4.735863|4.704248|2.879245|2.585747|4.966972|2.470642|6.085559|7.575946|11.748741|13.699412|36.858105| |3.215224|3.789208|6.484285|3.912908|4.236463|4.007192|3.571131|3.364124|3.489550|5.454549|2.656476|2.345963|2.186610|3.780021|0.108704|3.928374|3.070119|2.681519|4.077621|3.990506|2.557019|2.354800|4.606163|2.338320|4.922385|5.012775|8.056692|7.882978|13.776636|36.858105| |3.434267|4.047326|6.436488|3.735358|4.154884|3.771943|3.218393|3.004993|3.182544|5.000469|2.412405|2.164871|2.004712|3.698592|0.112863|3.684214|2.908605|2.610518|3.993558|3.940399|2.576938|2.444724|4.938479|2.548888|4.630642|4.431488|6.915656|6.865280|7.992065|13.767032|36.858105| |3.270545|3.978499|6.233681|3.707614|4.432640|4.098600|3.326257|2.979146|3.095771|4.752654|2.295478|2.044620|1.876581|4.331746|0.141098|4.248996|3.282173|2.955769|4.465526|4.518634|2.923211|2.831700|5.913161|3.057363|5.122010|4.974196|7.353900|7.878829|6.881654|7.913656|13.806862|36.858105| |2.967195|3.695337|6.121981|3.880764|4.960012|5.024740|3.930659|3.318882|3.295808|4.894232|2.383348|2.077057|1.897222|5.843293|0.192788|6.063434|4.299186|3.698637|5.381599|5.658946|3.442534|3.264801|6.741708|3.368518|6.478325|7.460423|9.846429|13.729704|7.983146|6.881832|7.990615|13.727824|36.858105| |3.523157|3.790157|5.808698|3.147849|3.292155|2.924676|2.579347|2.503302|2.717913|4.480377|2.181981|2.026816|1.899430|2.827725|0.085724|2.762820|2.300815|2.128485|3.345942|3.186009|2.164572|2.093911|4.217287|2.238099|3.737138|3.146298|5.121260|4.204362|4.761195|7.009861|10.847372|7.017875|4.759202|448.794386| |17.576407|8.865691|12.966893|4.922902|4.035786|3.151811|2.900481|3.179500|4.069250|7.633807|3.364330|3.330375|2.918939|2.667494|0.077704|2.349304|2.029332|2.029000|3.253294|3.174248|2.333951|2.175850|4.246478|2.161303|3.233464|2.388014|3.813894|2.779333|2.973411|3.340952|3.472731|3.168901|2.858215|29.278324|0.500000| |17.565869|8.858415|12.986583|4.847528|4.015877|3.118923|2.849389|3.103863|3.959323|7.370899|3.271190|3.252151|2.775676|2.656019|0.077771|2.273145|1.997873|2.059433|3.338093|3.264374|2.497092|2.348477|4.579309|2.324126|3.167043|2.230603|3.539815|2.513601|2.571696|2.759386|2.896853|2.808026|2.617619|23.562422|0.300994|0.500000| |17.542027|8.863806|10.260317|4.241893|3.849407|3.008077|2.663260|2.780288|3.388802|5.976928|2.724723|2.652383|2.348167|2.663519|0.080362|2.311828|2.004828|2.031562|3.271073|3.201799|2.398851|2.313955|4.657591|2.415713|3.183549|2.317041|3.666890|2.703531|2.770712|3.101443|3.440774|3.311943|2.923520|29.699521|0.300221|0.300095|0.500000| |8.843464|17.552469|16.540453|7.232415|6.858051|4.675838|3.844881|3.901255|4.891831|7.677896|3.291885|2.953579|2.565280|3.896469|0.119527|3.263033|2.664887|2.642855|4.091764|4.307334|3.080443|2.845693|5.812405|2.853222|4.106635|3.311466|5.010629|4.120465|4.224828|4.732850|5.249311|5.034518|4.452526|38.373937|0.212181|0.173330|0.212266|0.500000| |8.859151|17.528506|16.521010|6.976760|6.746429|4.563121|3.721880|3.756544|4.692501|7.394205|3.198773|2.894209|2.463366|3.857718|0.119725|3.065838|2.593240|2.709217|4.261550|4.536972|3.484908|3.267527|6.768026|3.264840|3.970981|2.924672|4.431294|3.376099|3.259059|3.403130|3.716117|3.876131|3.678255|27.623982|0.173537|0.212119|0.212992|0.301275|0.500000| |4.708112|7.500814|12.606265|8.946572|17.756772|8.958881|5.691324|4.985086|5.644585|7.578612|3.330024|2.806307|2.407889|7.046244|0.233346|4.837996|3.740955|3.864225|5.687060|7.023936|4.930951|4.272358|8.977596|3.918949|5.406536|4.402207|6.164333|5.155661|4.525473|4.293725|4.536810|5.128522|5.566373|28.870599|0.115107|0.116154|0.118654|0.224620|0.232475|0.500000| |2.557908|3.141759|6.512740|4.950625|5.670861|8.950793|17.735170|8.926716|5.642308|7.434554|3.918629|2.995633|2.634405|6.948196|0.140531|6.587670|5.961198|5.767511|8.168373|8.626862|4.924428|3.596354|5.949163|2.714578|8.523496|5.322963|8.134152|4.389416|4.014504|3.253343|2.919842|3.035660|3.640888|18.896573|0.069413|0.068211|0.064498|0.088826|0.086228|0.124803|0.500000| |2.807128|3.331121|7.577199|5.643576|4.984683|5.656164|8.959459|17.749052|8.923209|12.527875|7.498999|4.727618|3.938667|4.080737|0.096730|3.738590|3.391381|3.381605|5.305869|5.111648|3.460471|2.732480|4.660861|2.203900|5.326664|3.500365|5.682196|3.324136|3.396308|2.985372|2.649164|2.600734|2.871083|18.081518|0.078454|0.076460|0.068322|0.090337|0.087179|0.108115|0.217233|0.500000| |2.928574|3.234561|7.446831|4.728302|3.780016|3.723430|4.583280|6.754018|7.017522|16.478854|17.541021|8.910994|7.228227|2.898174|0.073563|2.711137|2.459004|2.422031|3.907827|3.607731|2.531904|2.136766|3.753077|1.837182|3.994597|2.692953|4.505745|2.723175|2.949247|2.778950|2.460788|2.315472|2.420286|17.687800|0.086000|0.080692|0.070081|0.086461|0.080946|0.087785|0.113666|0.229294|0.500000| |2.926365|3.251474|7.593879|4.840022|3.862674|3.795257|4.660540|6.874735|7.194570|16.580760|17.502758|8.940468|6.109166|2.946169|0.074705|2.649132|2.454209|2.528552|4.140965|3.826785|2.801539|2.328529|4.011850|1.944335|3.946979|2.516381|4.141224|2.504064|2.589817|2.436010|2.237667|2.172361|2.287354|16.158979|0.082646|0.083677|0.069843|0.083486|0.084396|0.089507|0.114780|0.228064|0.301038|0.500000| |3.355538|3.364187|7.646529|4.057646|3.162677|2.869119|3.132214|4.008524|4.909771|13.130121|8.713124|17.683726|9.150352|2.335171|0.062168|2.106016|1.934017|1.979829|3.272134|2.996270|2.235842|1.962577|3.490969|1.739766|3.143479|2.055371|3.400718|2.136000|2.250456|2.236808|2.105491|2.004305|2.020304|16.017087|0.098367|0.100590|0.078496|0.083556|0.084773|0.078192|0.077330|0.113987|0.172599|0.203327|0.500000| |2.485527|2.546935|5.449724|3.124450|2.618395|2.533902|2.883660|3.619509|3.860679|8.809250|6.913839|9.086492|17.689117|2.118139|0.055361|2.021933|1.875280|1.848093|3.056179|2.692879|1.924543|1.690724|2.986842|1.504383|3.125874|2.039194|3.497462|2.084135|2.270412|2.226065|2.010141|1.872078|1.903863|15.170292|0.074712|0.069729|0.060780|0.067995|0.064101|0.064677|0.074794|0.112542|0.215928|0.156428|0.173396|0.500000| |2.555359|2.512220|5.291444|2.879411|2.401783|2.263558|2.484334|3.032200|3.376082|7.812708|5.478956|9.103818|17.710668|1.916191|0.050955|1.800080|1.674224|1.676103|2.794602|2.460609|1.797699|1.604475|2.850185|1.447651|2.784145|1.799145|3.060144|1.858970|1.997560|1.997837|1.853498|1.736764|1.741291|14.332456|0.076952|0.073812|0.062430|0.065552|0.063509|0.060601|0.063913|0.089883|0.142725|0.131127|0.217997|0.289165|0.500000| |2.915646|3.689977|6.999382|4.828503|6.231597|6.990252|5.575269|4.515029|4.275774|6.039401|2.959958|2.489486|2.145618|7.122236|0.187930|4.672966|4.359038|5.799052|8.921391|12.560340|17.593048|8.911285|13.124125|4.845554|6.156246|3.609510|5.321017|3.430854|2.956734|2.666427|2.693392|3.018566|3.470003|18.269689|0.073267|0.080070|0.075240|0.098047|0.116319|0.166325|0.139080|0.105481|0.077236|0.087308|0.069710|0.057737|0.054314|0.500000| |2.305044|2.767421|5.251400|3.513342|4.190502|5.039788|4.671217|3.793246|3.383817|4.996014|2.591576|2.204048|1.941666|5.660485|0.139505|4.392224|4.713804|7.343404|13.264163|12.622344|17.588638|8.975518|10.260718|4.282533|6.845687|3.327413|5.105364|2.974060|2.573989|2.291635|2.279638|2.530373|2.932790|15.611610|0.059354|0.063655|0.060227|0.074816|0.083952|0.110473|0.132165|0.095025|0.069042|0.077932|0.061012|0.052898|0.049383|0.301500|0.500000| |2.310138|2.723277|4.843542|3.020786|3.572980|3.775204|3.270309|2.833932|2.742151|4.207990|2.145576|1.900138|1.688251|4.322185|0.125489|3.428751|3.481830|4.638216|8.366566|7.636736|8.871877|17.445798|16.562624|7.154097|5.279735|2.780182|4.288374|2.643432|2.286530|2.116475|2.197006|2.496974|2.792527|15.464153|0.058140|0.064061|0.062176|0.073269|0.086309|0.103887|0.088067|0.070865|0.056637|0.062782|0.053701|0.045525|0.043729|0.210130|0.221954|0.500000| |2.136059|2.528915|4.489211|2.855793|3.479565|3.914593|3.361989|2.791595|2.618550|3.972926|2.041425|1.793490|1.612974|5.055193|0.145359|4.209671|4.523436|6.457673|11.883305|9.689336|8.893194|17.543684|16.503083|7.435971|6.750799|3.268232|5.011685|2.976742|2.486394|2.246772|2.322381|2.694801|3.140956|15.954995|0.054667|0.058001|0.057750|0.070403|0.077967|0.100846|0.093973|0.070089|0.055076|0.059187|0.049866|0.044082|0.041621|0.174560|0.211579|0.300373|0.500000| |2.290533|2.639658|4.407747|2.616756|3.070576|3.051546|2.587701|2.298078|2.304214|3.617500|1.827951|1.658090|1.493311|3.521904|0.111808|2.947316|2.872200|3.394807|5.891806|5.309106|4.685424|7.214572|16.466594|17.473503|4.481195|2.540390|3.946271|2.535905|2.190354|2.091631|2.261975|2.641319|2.846928|16.300653|0.057123|0.062572|0.064077|0.072543|0.084859|0.095422|0.068818|0.057551|0.048580|0.052037|0.047063|0.040269|0.039112|0.123701|0.112840|0.211761|0.181064|0.500000| |2.154906|2.509657|4.218575|2.563296|3.088747|3.207031|2.692857|2.322561|2.275248|3.527991|1.791614|1.609627|1.460800|3.999781|0.129232|3.483692|3.444069|4.016214|6.871024|6.021240|4.782748|7.224119|16.482822|17.504857|5.357872|2.961121|4.572634|2.890674|2.413448|2.260188|2.445180|2.937406|3.293945|17.144681|0.054682|0.057741|0.060141|0.071192|0.078396|0.095557|0.073059|0.058209|0.048381|0.050745|0.045062|0.039817|0.038078|0.117660|0.112943|0.171061|0.221713|0.299671|0.500000| |2.552279|2.996332|4.819604|2.846541|3.439541|3.333819|2.721491|2.396554|2.432659|3.782811|1.881186|1.701258|1.534516|3.941125|0.135161|3.292962|3.048792|3.405802|5.598611|5.421039|4.340617|5.856654|16.899779|17.598394|4.699278|2.904766|4.426984|3.016518|2.549926|2.461538|2.753955|3.363777|3.593781|19.608951|0.063376|0.067792|0.072574|0.085079|0.096857|0.112691|0.071336|0.059201|0.050340|0.052647|0.048054|0.041507|0.040092|0.117826|0.100083|0.146319|0.148864|0.299777|0.299761|0.500000| 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