Version2.0 2020-07-18T08:24:44Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 21-Jun-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE COc1ccc(cc1OC)[C@H]2CC3=C([C@H](Nc4ccccc4N3)c5ccc(c(c5)[N+](=O)[O-])O)C(=O)C2 C19791207 RHF 6-31G(d) (6D,7F) COc1ccc(cc1OC)[C@H]2CC3=C([C@H](Nc4ccccc4N3)c5ccc(c(c5)[N+](=O)[O-])O)C(=O)C2 C01[X(C27H25N3O6)] 177 C1 590 COc1ccc(cc1OC)[C@@H]1CC(=O)C2=C(C1)Nc1ccccc1N[C@@H]2c1ccc(c(c1)[N+](=O)[O-])O COc1ccc(cc1OC)[C@@H]1CC(=O)C2=C(C1)Nc1ccccc1N[C@@H]2c1ccc(c(c1)[N+](=O)[O-])O COc1ccc(cc1OC)[C@@H]2CC(=O)C3=C(C2)Nc4ccccc4N[C@@H]3c5ccc(O)c(c5)[N+]([O-])=O InChIKey=AWXFXQWURIPOFP-CBZJRKILSA-N InChI=1S/C27H25N3O6/c1-35-24-10-8-15(14-25(24)36-2)17-11-20-26(23(32)13-17)27(29-19-6-4-3-5-18(19)28-20)16-7-9-22(31)21(12-16)30(33)34/h3-10,12,14,17,27-29,31H,11,13H2,1-2H3/t17-,27+/m0/s1 InChI=1/C27H25N3O6/c1-35-24-10-8-15(14-25(24)36-2)17-11-20-26(23(32)13-17)27(29-19-6-4-3-5-18(19)28-20)16-7-9-22(31)21(12-16)30(33)34/h3-10,12,14,17,27-29,31H,11,13H2,1-2H3/t17-,27+/m0/s1 COc1ccc(cc1OC)[C@H]2CC3=C([C@H](Nc4ccccc4N3)c5ccc(c(c5)[N+](=O)[O-])O)C(=O)C2 C01[X(C27H25N3O6)] 177 C01 590 COc1ccc(cc1OC)[C@@H]1CC(=O)C2=C(C1)Nc1ccccc1N[C@@H]2c1ccc(c(c1)[N+](=O)[O-])O CO[C]1[CH][CH][C]([CH][C]1OC)[C@@H]1CC(=O)C2=C(C1)N[C]1[CH][CH][CH][CH][C]1N[C@@H]2[C]1[CH][CH][C]([C]([CH]1)[N]([O])[O])O CO[C]1[CH][CH][C]([CH][C]1OC)[C@@H]2CC(=O)C3=C(C2)N[C]4[CH][CH][CH][CH][C]4N[C@@H]3[C]5[CH][CH][C](O)[C]([CH]5)N([O])[O] InChIKey=AWXFXQWURIPOFP-CBZJRKILSA-N InChI=1S/C27H25N3O6/c1-35-24-10-8-15(14-25(24)36-2)17-11-20-26(23(32)13-17)27(29-19-6-4-3-5-18(19)28-20)16-7-9-22(31)21(12-16)30(33)34/h3-10,12,14,17,27-29,31H,11,13H2,1-2H3/t17-,27+/m0/s1 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275.6098 101.5807 35.1788 37.4799 224.4347 146.1361 83.1195 76.3728 5.3017 61.2127 129.5353 182.2464 21.3375 57.2031 9.6162 191.1498 16.8259 35.4998 1.3233 2.1537 7.5335 22.7555 41.6117 220.7763 248.8742 126.4468 318.5611 470.8277 78.5503 37.4276 69.0496 114.7507 13.9170 28.3684 138.0999 410.5624 316.2062 4.2825 96.3460 4.3680 23.6874 28.6648 24.7218 35.3507 75.5662 12.7502 6.0112 26.4393 64.3965 16.3533 4.4811 19.7877 20.0638 8.4221 28.2008 12.8045 13.1699 6.6196 2.8413 6.4309 45.4376 293.7430 3.7874 2.7823 1.1083 1.8935 4.8025 6.6318 1.4596 0.4051 1.1140 1.1668 1.2504 3.1963 1.6433 1.0144 1.5741 4.6893 0.8345 1.5324 1.2626 1.0607 0.9380 1.7010 0.8171 0.9720 1.3891 0.7850 1.2035 3.0759 1.9288 1.2230 1.6311 1.9173 0.4017 2.2709 2.7495 1.2825 1.8275 0.3884 2.2807 1.1467 1.4270 3.2058 2.4093 1.5339 5.4679 2.1814 1.8761 1.1196 2.0684 2.5414 0.9524 2.2077 1.6803 2.3972 2.0817 1.8350 4.1798 6.1421 7.0666 2.6774 0.4095 8.0625 1.4310 4.7128 26.4350 0.5276 1.0407 2.2701 2.2794 16.9658 13.8456 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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 10491.5528 36688.6662 41024.7211 0.99996 -0.00847 -0.00177 0.00846 0.99995 -0.00508 0.00181 0.00506 0.99999 1 0.00826 0.00236 0.00211 0.17202 0.04919 0.04399 17.20 18.96 28.99 48.87 58.04 59.96 90.12 99.93 103.58 124.49 132.11 162.50 191.80 199.01 225.20 241.71 253.23 260.93 294.41 307.13 324.80 361.29 406.03 426.46 452.20 458.13 477.51 483.34 502.69 507.83 565.97 595.23 604.47 619.85 650.31 665.92 680.88 692.03 716.20 732.19 749.76 752.33 772.72 805.91 835.09 865.50 880.37 886.41 902.31 925.78 949.39 956.68 965.60 972.75 1004.14 1026.17 1055.32 1071.85 1081.33 1139.29 1150.18 1157.02 1158.31 1190.58 1214.45 1218.81 1239.95 1257.84 1292.07 1309.04 1333.98 1342.28 1363.71 1382.46 1386.76 1402.60 1419.02 1444.92 1475.11 1512.90 1513.87 1516.39 1517.23 1560.15 1581.88 1605.49 1653.39 1671.12 1681.61 1690.83 1721.89 1723.69 1743.59 1756.62 1771.25 1775.17 1789.49 1795.75 1831.25 1839.20 1845.54 1861.81 1862.31 1877.60 1892.03 1916.68 1920.58 1929.93 1936.56 1953.01 1971.90 1992.69 2019.01 2020.37 2045.92 2053.73 2060.01 2077.46 2085.50 2117.62 2128.31 2138.40 2152.69 2183.16 2192.93 2234.47 2262.41 2296.11 2300.89 2318.97 2333.42 2343.92 2348.35 2360.45 2376.07 2376.54 2388.52 2389.12 2396.22 2418.01 2430.39 2460.86 2470.00 2553.93 2573.94 2581.28 2592.91 2606.74 2609.14 2637.17 2686.04 2793.38 4605.77 4608.76 4610.59 4616.75 4625.54 4673.82 4696.38 4697.60 4733.15 4743.00 4789.26 4790.34 4813.62 4827.08 4840.44 4856.07 4878.83 4881.02 4884.91 4899.62 4903.08 4930.93 5472.13 5578.60 5742.47 0.523326 0.552253 0.553197 0.459520 -1648.846846 -1648.817919 -1648.816975 -1648.910652 3.141942D-04 MUNgauss RevisionA2.0 retrievium 18-Jul-2020 DUDE COc1ccc(cc1OC)[C@H]2CC3=C([C@H](Nc4ccccc4N3)c5ccc(c(c5)[N+](=O)[O-])O)C(=O)C2 C19791207 RHF 6-31G(d) (6D,10F) C1 487.174336 |X|Y|Z| 134.051106 63.997210 43.244431 71.854485 27 6 7 25 2 |36.858105| |13.633517|73.516695| |8.040642|25.164231|36.858105| |6.739170|14.016247|13.840333|36.858105| |4.513230|9.217349|7.902120|13.655647|36.858105| |3.781011|8.159469|6.785896|7.903454|13.840675|36.858105| |3.990598|9.407034|7.915995|6.921482|7.998030|13.603465|36.858105| |5.247767|14.507056|13.532750|7.944105|6.868529|7.851529|13.825899|36.858105| |4.792016|13.126869|8.171833|5.303880|4.627664|5.170982|7.895389|14.161915|73.516695| |3.548914|8.520359|5.248126|3.995291|3.805183|4.508042|6.741444|8.030015|24.235699|36.858105| |2.913695|5.973916|4.402727|4.985797|7.504145|12.533538|7.549456|5.006492|6.861017|3.688116|36.858105| |2.691641|5.598608|4.009007|4.207387|5.615061|8.995118|7.490345|4.858973|7.003659|3.997680|17.530873|0.500000| |2.656274|5.272325|3.726082|4.286519|6.039198|7.523598|5.330145|4.012880|5.751997|3.095556|12.457333|0.249627|36.858105| |2.197134|4.280095|2.891235|3.223851|4.169044|4.892933|3.915251|3.105844|4.696204|2.609282|7.489986|0.190931|12.541137|36.858105| |2.050726|3.971161|2.652229|2.939418|3.739640|4.337881|3.542534|2.844568|4.358112|2.443390|6.564451|0.174368|7.604812|14.117428|36.858105| |1.765620|3.374047|2.191768|2.388971|2.894040|3.230357|2.783864|2.328807|3.674415|2.081753|4.331578|0.120039|4.830106|7.454987|12.580869|36.858105| |1.733259|3.283331|2.122172|2.329936|2.805917|3.057803|2.625009|2.225623|3.511804|1.974135|3.980994|0.107601|4.230120|5.805719|9.186618|17.652402|0.500000| |1.663840|3.143057|2.017586|2.204561|2.623013|2.838947|2.466648|2.111362|3.354419|1.887571|3.611855|0.098108|4.305968|6.454509|7.678364|12.989310|0.260985|53.358707| |1.623073|3.077430|1.964491|2.117795|2.485703|2.710586|2.407170|2.070783|3.322638|1.884238|3.376231|0.093838|4.150191|6.066773|6.008256|7.678389|0.159492|18.518407|36.858105| |1.456379|2.746113|1.726429|1.838854|2.107398|2.273508|2.068848|1.814923|2.960198|1.688444|2.724377|0.076558|3.206419|4.225679|4.240604|5.336840|0.123200|10.664236|13.689625|36.858105| |1.404988|2.649605|1.652569|1.742002|1.967917|2.119483|1.962711|1.740124|2.867266|1.642364|2.477769|0.070172|2.911060|3.633628|3.470790|3.992955|0.094617|7.003997|7.863579|13.787241|36.858105| |1.492335|2.829183|1.769025|1.856894|2.096449|2.271924|2.115374|1.871898|3.083891|1.768170|2.639739|0.075054|3.176825|3.883058|3.484306|3.721319|0.087264|6.180567|6.812354|7.971701|13.761911|36.858105| |1.672951|3.196179|2.028377|2.145005|2.467329|2.709634|2.484234|2.158377|3.504104|2.000134|3.222700|0.091314|4.092087|5.178775|4.292214|4.308770|0.097744|7.029237|7.920108|6.947181|7.980740|13.792310|36.858105| |1.762450|3.370064|2.169728|2.335094|2.761536|3.054185|2.707637|2.304753|3.674681|2.082143|3.825082|0.106609|5.058064|7.511492|6.074218|6.139562|0.130075|10.702587|13.683455|7.965251|6.847217|7.884895|13.699012|36.858105| |2.024201|3.906605|2.575981|2.821611|3.465205|3.907283|3.320710|2.744837|4.259506|2.381894|5.161694|0.138676|8.003759|13.941608|7.825431|6.188995|0.133355|9.046351|7.744302|5.140230|4.550074|5.186744|7.970097|13.539050|53.358707| |1.642019|3.160854|2.030684|2.154200|2.545264|2.893010|2.611141|2.197169|3.544401|2.055545|3.755943|0.111264|3.925067|5.409237|7.465807|12.459826|0.251958|10.343368|6.246478|5.069937|3.938579|3.614471|3.989897|5.143796|6.594728|36.858105| |1.648367|3.208714|2.058536|2.142017|2.507126|2.916916|2.715709|2.272009|3.710539|2.195375|3.749794|0.117151|3.908016|5.195887|6.162017|7.384936|0.156038|7.760681|5.725552|4.861679|4.088272|3.923695|4.365767|5.295682|6.689152|13.576441|36.858105| |1.521584|2.960531|1.871956|1.916124|2.190356|2.526138|2.427715|2.072996|3.459307|2.077619|3.093144|0.097137|3.121550|3.818193|4.316274|4.957829|0.117171|5.686716|4.279748|4.024180|3.593801|3.426911|3.601675|4.004508|5.034863|7.850081|13.895466|36.858105| |1.410293|2.720548|1.703933|1.746557|1.975640|2.234369|2.146939|1.864824|3.128889|1.868288|2.674738|0.081914|2.657192|3.172887|3.668124|4.364415|0.110991|5.069458|3.640863|3.554612|3.147152|2.905521|2.963889|3.278509|4.139977|6.716081|7.903815|13.634834|36.858105| |1.407193|2.693333|1.689668|1.754776|1.996505|2.227190|2.097506|1.825020|3.030893|1.782303|2.683206|0.080056|2.668034|3.229208|3.912194|4.998152|0.134673|5.644872|3.778274|3.645652|3.084643|2.778568|2.843782|3.250530|4.127505|7.882852|6.946259|7.993194|13.646479|36.858105| |1.508595|2.881888|1.827214|1.928212|2.234214|2.489029|2.280847|1.960825|3.201639|1.858103|3.090765|0.090525|3.124537|3.964165|5.165904|7.592532|0.208581|7.706451|4.687961|4.246364|3.388113|3.032017|3.188458|3.854163|4.927182|13.886702|8.044461|6.909456|7.826224|13.619614|36.858105| |1.299769|2.468308|1.532534|1.589215|1.783877|1.955968|1.852186|1.639238|2.741500|1.605425|2.292833|0.067327|2.261676|2.648899|3.139206|3.860133|0.110105|4.586770|3.061670|3.034939|2.624381|2.357702|2.374639|2.657292|3.403371|5.138000|4.551842|5.113350|7.697548|13.195386|7.835359|53.358707| |1.285271|2.423971|1.503219|1.571446|1.763985|1.909082|1.789184|1.591156|2.647864|1.534737|2.228153|0.064240|2.203408|2.572591|3.075524|3.821949|0.114677|4.596804|2.970965|2.932106|2.504140|2.236637|2.256429|2.548215|3.285651|4.712315|3.934617|4.095217|5.388199|8.396856|7.132023|21.820608|73.516695| |1.230297|2.337306|1.440510|1.480000|1.642957|1.799777|1.729502|1.544516|2.610913|1.539312|2.073562|0.061246|2.034863|2.333115|2.684974|3.161846|0.088619|3.850234|2.655750|2.674301|2.389345|2.170562|2.164980|2.362802|3.031413|4.061573|3.885932|4.608802|6.945283|8.357517|5.409374|21.448931|16.073470|73.516695| |1.317250|2.538189|1.572629|1.594921|1.776007|1.995067|1.952066|1.721745|2.931327|1.764055|2.321206|0.070999|2.288456|2.637888|2.945293|3.348847|0.087009|4.053503|2.972643|2.981514|2.752790|2.571176|2.575153|2.746425|3.488106|4.579390|5.310946|8.210867|14.365100|7.852354|5.173640|8.850016|8.233085|12.994243|73.516695| |2.195127|4.268116|2.883656|3.223857|4.180573|4.892070|3.895584|3.091753|4.671159|2.597048|7.535655|0.191826|6.600832|7.779786|12.917040|7.623740|0.212102|6.972523|4.140833|3.237660|2.747962|2.749074|3.242320|4.141009|6.905373|5.833601|4.896513|3.786567|3.387932|3.671648|4.680928|4.165988|5.409269|4.681324|4.949329|36.858105| |2.010575|3.869138|2.554661|2.812544|3.479363|3.920008|3.296611|2.716835|4.206458|2.356693|5.291611|0.142135|4.660165|5.384280|8.157537|6.995978|0.228398|6.381917|3.711180|3.028460|2.556201|2.494297|2.837418|3.525302|5.447221|5.895776|4.653212|3.761804|3.555629|4.047330|5.254228|4.687665|6.224450|5.165884|5.172128|15.844819|73.516695| |2.650204|5.242701|3.702716|4.278563|6.055384|7.474676|5.259033|3.972227|5.694234|3.068622|12.486512|0.249300|7.680467|6.564149|7.376095|4.871932|0.133586|5.210576|3.339738|2.699790|2.387233|2.454199|2.906047|3.529166|6.095801|4.076674|3.769349|3.100672|2.779207|2.903449|3.444167|3.409353|4.411506|3.958783|4.233772|12.568891|14.399549|36.858105| |17.647082|17.024851|5.894295|4.911053|3.616705|3.175219|3.414258|4.408322|7.765008|3.342538|2.535317|0.066282|2.331347|1.968764|1.848237|1.612772|0.043992|2.076617|1.495016|1.353389|1.312275|1.392228|1.547664|1.616882|2.495088|1.514284|1.525989|1.421397|1.322938|1.316040|1.400232|1.662690|2.145149|2.066273|2.211726|1.966249|3.234400|2.325214|0.500000| |17.552777|16.443142|7.065699|6.742755|4.583922|3.738611|3.805396|4.763266|7.531267|3.247751|2.911826|0.073941|2.621261|2.184773|2.068677|1.783893|0.049113|2.277025|1.614246|1.446411|1.385440|1.459913|1.632478|1.735725|2.709912|1.652204|1.641902|1.513542|1.411838|1.419254|1.526411|1.791714|2.325574|2.209988|2.339598|2.249669|3.694301|2.734774|0.299942|0.500000| |17.550617|16.440451|7.044103|6.735728|4.574994|3.728490|3.792688|4.744431|7.502423|3.230438|2.905978|0.073713|2.736190|2.250215|2.072330|1.783001|0.048472|2.312195|1.664592|1.492109|1.443580|1.540152|1.731504|1.818260|2.851666|1.643893|1.647715|1.512899|1.397989|1.396438|1.503436|1.752041|2.265738|2.161261|2.315209|2.185054|3.530997|2.617926|0.299989|0.298925|0.500000| |7.505394|12.555003|8.946921|17.760751|8.940458|5.653405|4.980769|5.640040|7.597275|3.331409|4.080840|0.096668|3.706066|2.898682|2.668622|2.215821|0.060641|2.824337|1.988117|1.740201|1.650444|1.750273|2.002039|2.170478|3.515555|1.989014|1.958838|1.759653|1.619069|1.637202|1.798345|2.036138|2.646813|2.478771|2.636984|2.902251|4.583676|3.709328|0.146507|0.225216|0.225943|0.500000| |3.929610|7.462723|5.655026|8.955144|17.715567|8.912990|5.653231|4.950068|6.524632|3.140056|6.889859|0.139536|6.208810|4.390668|3.964507|3.060693|0.083570|3.814285|2.609046|2.194077|2.027110|2.141649|2.520377|2.868066|4.922706|2.611093|2.511591|2.171356|1.971564|2.020825|2.293655|2.464304|3.213593|2.942489|3.130079|4.428198|6.520699|6.302829|0.089324|0.113767|0.113608|0.218445|0.500000| |3.332567|7.600158|5.636686|4.980012|5.686276|8.922880|17.754001|8.972056|12.638583|7.557555|7.075865|0.234571|5.064746|3.940033|3.607095|2.860244|0.073958|3.408876|2.468005|2.128799|2.026174|2.188318|2.566855|2.780448|4.579211|2.762477|2.952548|2.664490|2.325470|2.233465|2.400927|2.659632|3.316105|3.257765|3.767470|3.913647|5.932808|4.988187|0.082116|0.088405|0.088111|0.108045|0.124346|0.500000| |3.248792|7.536557|4.766680|3.813061|3.764945|4.585045|6.745388|7.062323|16.442139|17.554972|3.868337|0.119454|3.125405|2.673353|2.560325|2.180411|0.057690|2.647419|1.921874|1.718222|1.656936|1.767318|1.994454|2.100745|3.262840|2.174474|2.320267|2.205586|1.991142|1.899783|1.974724|2.327889|2.899948|2.915234|3.339764|2.782369|4.532272|3.298430|0.084511|0.085514|0.081797|0.088478|0.087058|0.226366|0.500000| |3.345237|7.776111|4.412989|3.419431|3.193012|3.612916|4.912987|5.892346|17.028819|17.647767|3.050668|0.090772|2.640736|2.278935|2.149712|1.867688|0.049428|2.326951|1.712195|1.552380|1.519214|1.631330|1.822624|1.878261|2.875839|1.855938|1.980041|1.898422|1.724015|1.642274|1.696721|2.032210|2.538698|2.563276|2.926005|2.269013|3.715747|2.620748|0.090779|0.084560|0.084112|0.082105|0.075193|0.147212|0.299944|0.500000| |3.227500|7.491508|4.734865|3.789725|3.745230|4.567490|6.729632|7.022893|16.438264|17.550597|3.863419|0.119330|3.329043|2.800897|2.572024|2.182864|0.056726|2.706436|2.012098|1.799733|1.762984|1.920193|2.189311|2.256933|3.525846|2.162788|2.348552|2.216567|1.962592|1.853000|1.931493|2.249983|2.793154|2.816028|3.287530|2.666871|4.246613|3.101391|0.084005|0.081700|0.084466|0.087962|0.086633|0.227541|0.298897|0.300046|0.500000| |2.690971|5.407712|3.793703|4.192653|5.524071|6.913151|5.475249|4.175043|6.065819|3.289435|8.876591|0.218036|17.550191|8.906433|5.723164|4.082080|0.098608|5.179021|3.904959|3.103560|2.921962|3.306087|4.344805|5.010634|10.536053|3.512623|3.669639|3.006686|2.530389|2.481676|2.827970|2.872598|3.621038|3.421158|3.934476|4.932276|6.694940|5.564873|0.065974|0.072132|0.077651|0.100082|0.148026|0.147450|0.089858|0.077736|0.101488|0.500000| |2.770852|5.355277|3.768940|4.594358|6.608340|6.879581|4.758654|3.816439|5.433916|2.838416|8.809657|0.174616|17.527119|8.963743|6.293769|4.341964|0.110423|5.536746|3.849016|3.021227|2.744912|2.966984|3.737790|4.548968|9.202983|3.448991|3.324289|2.715203|2.374656|2.422585|2.837578|2.853094|3.683777|3.355876|3.671176|5.747260|7.589160|6.833275|0.066882|0.076561|0.080738|0.113885|0.213178|0.119331|0.078729|0.068211|0.083186|0.303823|0.500000| |1.545706|2.899853|1.841770|2.003823|2.345301|2.504122|2.204773|1.915792|3.071709|1.729753|3.090393|0.084203|3.540884|4.853338|5.761468|9.384785|0.240680|25.972564|9.611212|7.672444|4.941075|4.113075|4.348431|5.867200|6.745204|6.809745|5.008177|3.919046|3.684573|4.269017|5.840415|4.867918|6.547189|5.266621|5.275786|4.360971|7.561747|3.333363|0.039577|0.043319|0.043753|0.052858|0.069580|0.062110|0.049584|0.043862|0.050290|0.088233|0.094745|0.500000| |1.377014|2.584331|1.616140|1.720970|1.960342|2.098718|1.914728|1.691512|2.769154|1.578723|2.492832|0.069872|2.849043|3.662329|3.854853|5.068413|0.123898|9.813262|8.955743|17.700893|8.938192|5.661202|4.989151|5.665887|5.661895|4.961720|4.499751|3.871126|3.615763|3.856613|4.486429|4.474422|5.741469|5.092584|5.400708|3.062713|5.262089|2.534640|0.035640|0.038177|0.039061|0.045477|0.056859|0.054615|0.044835|0.040496|0.046364|0.075607|0.075403|0.233247|0.500000| |1.302455|2.446154|1.512551|1.586210|1.771321|1.894500|1.771401|1.587777|2.637978|1.513566|2.178141|0.061741|2.500768|3.021895|2.937851|3.373207|0.082649|5.685543|5.619293|8.936738|17.725790|8.896767|5.658419|4.939366|4.928236|3.410738|3.525171|3.251994|2.945816|2.883911|3.073588|3.428959|4.280554|4.137384|4.701979|2.409500|4.055393|2.115328|0.033964|0.035698|0.037120|0.041955|0.050568|0.050779|0.042410|0.039171|0.044949|0.069774|0.066079|0.116658|0.215898|0.500000| |1.434087|2.714410|1.681970|1.749935|1.947547|2.099677|1.984505|1.778308|2.959961|1.701768|2.383575|0.067965|2.817645|3.286268|2.953029|3.088083|0.074227|4.920493|4.921330|5.653197|8.889720|17.727701|8.938330|5.627519|5.735940|3.048666|3.339818|3.037130|2.611845|2.469237|2.629206|2.903539|3.592252|3.547720|4.218924|2.411172|3.917824|2.200587|0.037364|0.038799|0.041161|0.045955|0.054871|0.057069|0.046954|0.043932|0.051464|0.082811|0.073614|0.093008|0.124184|0.213332|0.500000| |1.758154|3.375972|2.142844|2.249374|2.569580|2.830891|2.626694|2.289745|3.724886|2.125786|3.291937|0.093514|4.220105|4.930647|3.924908|3.716377|0.086268|5.696964|5.643186|4.988217|5.663936|8.939623|17.689356|8.934803|10.055604|3.464160|3.847275|3.258669|2.687180|2.550634|2.813774|2.932992|3.637288|3.533048|4.227732|3.069934|4.730683|2.861769|0.045177|0.047230|0.050779|0.058060|0.072008|0.075403|0.058178|0.053742|0.065423|0.132130|0.106620|0.099298|0.108101|0.124248|0.215957|0.500000| |2.124153|4.107855|2.709883|2.959735|3.597198|4.018104|3.450705|2.878996|4.460133|2.475694|5.008312|0.133273|8.022966|9.567757|5.842198|4.694059|0.107492|6.797562|5.817504|4.340501|4.119802|4.958476|7.697854|9.463890|26.098914|3.908489|4.073613|3.239421|2.692611|2.648181|3.061920|3.030706|3.820415|3.581149|4.134839|4.296327|6.128716|4.100775|0.053352|0.057403|0.061672|0.075133|0.103012|0.096118|0.068042|0.060960|0.075619|0.256707|0.194756|0.110869|0.099093|0.093182|0.117230|0.235281|0.500000| |1.752169|3.435792|2.222407|2.309014|2.725305|3.228413|3.004129|2.476239|4.019755|2.382552|4.227280|0.135022|4.580925|6.250829|6.644798|6.821425|0.140369|7.625105|6.108257|4.924383|4.307234|4.411222|5.251202|6.419411|8.329964|8.871135|17.744396|9.052160|5.653392|4.992435|5.694191|4.930826|5.744742|5.688059|7.655035|4.968605|7.806125|3.985572|0.044900|0.048124|0.048861|0.058156|0.075222|0.091515|0.069302|0.059179|0.071965|0.122711|0.104321|0.129659|0.119225|0.100278|0.103357|0.130311|0.139445|0.500000| |1.506282|2.944633|1.852145|1.871976|2.116517|2.451029|2.408101|2.068894|3.496949|2.129110|2.936008|0.093396|2.957441|3.489582|3.739674|4.040498|0.096630|4.842407|3.786677|3.632031|3.423777|3.377674|3.524495|3.724750|4.710865|5.596311|8.915229|17.748036|8.991303|5.688831|4.973376|5.653071|6.049173|7.070869|13.536501|3.322404|5.753629|2.849213|0.039251|0.041359|0.041569|0.047637|0.057629|0.074328|0.062554|0.054294|0.063736|0.081325|0.071300|0.092294|0.095313|0.087055|0.085305|0.090895|0.086731|0.216862|0.500000| |1.482370|2.807937|1.774769|1.889074|2.183963|2.387122|2.166166|1.879900|3.059506|1.756663|2.925194|0.083408|2.951619|3.675566|4.811289|7.039722|0.229955|7.464821|4.290649|3.911172|3.109674|2.766496|2.894935|3.497125|4.534433|8.951456|5.678265|4.976724|5.626968|8.973385|17.778703|10.010422|14.569660|8.929528|7.455708|4.560345|9.585515|3.360229|0.038202|0.041923|0.041063|0.049365|0.063050|0.062410|0.051774|0.044689|0.050288|0.073404|0.076347|0.167420|0.118142|0.079274|0.067059|0.071340|0.078944|0.124393|0.107973|0.500000| |1.261301|2.417825|1.491432|1.515623|1.680101|1.868458|1.823597|1.621078|2.762449|1.653247|2.154569|0.065084|2.116240|2.420311|2.718458|3.110011|0.083006|3.791175|2.731578|2.758348|2.534802|2.345768|2.336360|2.497861|3.186162|4.125859|4.445567|6.084072|10.132886|7.665448|4.923178|10.477097|9.292495|18.537360|35.515770|2.612950|4.942008|2.241858|0.033150|0.035128|0.034604|0.039356|0.046453|0.054541|0.048926|0.043027|0.047768|0.056540|0.053654|0.078462|0.079531|0.068385|0.060361|0.059978|0.059182|0.101631|0.153831|0.115992|0.500000| |2.754193|5.302332|3.726632|4.561687|6.593371|6.804280|4.684041|3.763053|5.362989|2.807855|8.820057|0.174436|6.874672|5.771777|6.207581|4.402956|0.125369|4.975666|3.157419|2.572977|2.276941|2.331109|2.737873|3.305181|5.657841|3.573217|3.242488|2.706724|2.472066|2.614708|3.099804|3.137829|4.128352|3.650105|3.806178|9.035578|12.075890|17.513574|0.066480|0.080226|0.076364|0.113550|0.217625|0.117550|0.082255|0.067551|0.078013|0.140286|0.200582|0.089707|0.067547|0.056323|0.058265|0.074890|0.107518|0.094344|0.069303|0.086316|0.056549|0.500000| |2.666435|5.317230|3.719841|4.148326|5.494429|6.741487|5.267790|4.053394|5.896965|3.205453|8.758488|0.214252|5.534863|4.906455|5.576729|4.145456|0.116498|4.465035|2.894774|2.413069|2.154917|2.201510|2.549862|3.009193|4.952920|3.715875|3.481012|2.976190|2.722444|2.838215|3.276383|3.386901|4.377357|3.968635|4.204866|9.006304|13.571161|17.601479|0.065357|0.077280|0.071596|0.099703|0.150131|0.141284|0.098719|0.076029|0.087740|0.123724|0.139376|0.081653|0.063761|0.053749|0.055460|0.069934|0.093973|0.099734|0.076451|0.089109|0.062251|0.303340|0.500000| 1647.217141 -11280.048089 4492.170817 -218.764888 -5359.425018 3710.054755 -1649.370263 2.001307 40B440000000000A 4562E5F0DD72882A 44E2E5F0DD72882A 4256E51B72400003 B14A22391F5F0C00 443EED7CD16E4878