Version2.1 2020-12-18T16:52:57Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 30-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1ccc(o1)CN([C@H](c2ccc(cc2)[N+](=O)[O-])C(=O)NC(C)(C)CC(C)(C)C)C(=O)CO C36600495 RHF 6-31G(d) (6D,7F) Cc1ccc(o1)CN([C@H](c2ccc(cc2)[N+](=O)[O-])C(=O)NC(C)(C)CC(C)(C)C)C(=O)CO C01[X(C24H33N3O6)] 192 C1 561 OCC(=O)N([C@H](c1ccc(cc1)[N+](=O)[O-])C(=O)NC(CC(C)(C)C)(C)C)Cc1ccc(o1)C OCC(=O)N([C@H](c1ccc(cc1)[N+](=O)[O-])C(=O)NC(CC(C)(C)C)(C)C)Cc1ccc(o1)C Cc1oc(CN([C@@H](C(=O)NC(C)(C)CC(C)(C)C)c2ccc(cc2)[N+]([O-])=O)C(=O)CO)cc1 InChIKey=LAFIPKGATCKUBR-OAQYLSRUSA-N InChI=1S/C24H33N3O6/c1-16-7-12-19(33-16)13-26(20(29)14-28)21(17-8-10-18(11-9-17)27(31)32)22(30)25-24(5,6)15-23(2,3)4/h7-12,21,28H,13-15H2,1-6H3,(H,25,30)/t21-/m1/s1 InChI=1/C24H33N3O6/c1-16-7-12-19(33-16)13-26(20(29)14-28)21(17-8-10-18(11-9-17)27(31)32)22(30)25-24(5,6)15-23(2,3)4/h7-12,21,28H,13-15H2,1-6H3,(H,25,30)/t21-/m1/s1/f/h25H Cc1ccc(o1)CN([C@H](c2ccc(cc2)[N+](=O)[O-])C(=O)NC(C)(C)CC(C)(C)C)C(=O)CO C01[X(C24H33N3O6)] 192 C01 561 OCC(=O)N([C@H](c1ccc(cc1)[N+](=O)[O-])C(=O)NC(CC(C)(C)C)(C)C)Cc1ccc(o1)C OCC(=O)N([C@H]([C]1[CH][CH][C]([CH][CH]1)[N]([O])[O])[C]([NH]C(CC(C)(C)C)(C)C)=O)CC1=[CH][CH]=C(O1)C Cc1oc(CN([C@H]([C]2[CH][CH][C]([CH][CH]2)N([O])[O])C(=O)NC(C)(C)CC(C)(C)C)C(=O)CO)cc1 InChIKey=LAFIPKGATCKUBR-OAQYLSRUSA-N InChI=1S/C24H33N3O6/c1-16-7-12-19(33-16)13-26(20(29)14-28)21(17-8-10-18(11-9-17)27(31)32)22(30)25-24(5,6)15-23(2,3)4/h7-12,21,28H,13-15H2,1-6H3,(H,25,30)/t21-/m1/s1 InChI=1/C24H33N3O6/c1-16-7-12-19(33-16)13-26(20(29)14-28)21(17-8-10-18(11-9-17)27(31)32)22(30)25-24(5,6)15-23(2,3)4/h7-12,21,28H,13-15H2,1-6H3,(H,25,30)/t21-/m1/s1/f/h25H 3679.5155774187 -1540.4391091 1-A 15586.8239 123 438 561 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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| 10.3520 17.0825 18.8528 25.3585 30.4575 35.8638 44.7752 48.5476 57.0206 63.1414 77.2335 90.5707 101.5383 134.0784 140.1757 148.1230 152.1777 159.3849 174.5023 189.9328 203.2684 214.0655 228.0632 237.7452 259.2470 266.1689 271.6960 286.6954 297.4825 302.0737 306.8228 323.2005 328.0352 333.7115 342.9348 346.0166 370.1522 373.1229 396.2208 408.2502 410.1089 434.1555 438.7878 450.7846 456.0203 468.5762 484.3380 515.1242 516.6201 530.3356 556.0529 571.9223 601.4967 616.8025 641.3161 656.9798 671.4652 692.0547 694.4510 708.2169 744.5823 770.5520 780.3354 791.5904 823.7642 837.7042 852.0701 883.2314 902.7535 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14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 15.99491 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 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 12318.6045 17924.0446 24714.4387 1.00000 -0.00248 -0.00084 0.00248 0.99997 -0.00697 0.00086 0.00696 0.99998 1 0.00703 0.00483 0.00350 0.14651 0.10069 0.07302 14.89 24.58 27.12 36.49 43.82 51.60 64.42 69.85 82.04 90.85 111.12 130.31 146.09 192.91 201.68 213.12 218.95 229.32 251.07 273.27 292.46 307.99 328.13 342.06 373.00 382.96 390.91 412.49 428.01 434.62 441.45 465.01 471.97 480.14 493.41 497.84 532.57 536.84 570.07 587.38 590.06 624.65 631.32 648.58 656.11 674.18 696.85 741.15 743.30 763.03 800.04 822.87 865.42 887.44 922.71 945.25 966.09 995.71 999.16 1018.97 1071.29 1108.65 1122.73 1138.92 1185.21 1205.27 1225.94 1270.77 1298.86 1307.08 1335.99 1360.66 1364.13 1376.36 1388.93 1392.31 1419.43 1451.16 1468.19 1471.66 1483.58 1510.03 1521.52 1526.30 1541.51 1565.16 1587.73 1593.54 1600.43 1602.98 1608.26 1621.73 1632.17 1644.03 1651.41 1658.00 1681.89 1691.81 1737.31 1791.02 1796.20 1821.36 1857.15 1862.83 1880.20 1889.08 1900.09 1925.40 1936.47 1942.53 1952.90 1966.95 1974.20 1986.25 1995.77 2011.21 2046.36 2054.12 2058.58 2103.20 2137.32 2154.55 2192.71 2206.09 2207.64 2236.88 2242.13 2245.94 2247.79 2261.23 2271.25 2287.05 2294.02 2327.78 2333.75 2344.67 2350.49 2352.38 2352.61 2356.69 2359.55 2362.38 2367.87 2376.92 2389.84 2390.19 2393.61 2399.89 2407.84 2409.39 2419.02 2480.85 2545.92 2548.14 2600.48 2636.56 2683.09 2773.43 2810.26 4582.76 4586.42 4590.41 4599.65 4615.74 4620.43 4621.29 4641.95 4648.01 4653.32 4670.84 4678.58 4688.68 4692.64 4697.58 4702.47 4702.50 4723.28 4731.86 4747.58 4750.66 4768.53 4782.15 4791.38 4799.30 4850.92 4933.42 4941.15 4946.29 4956.89 4974.08 5652.66 5924.34 0.594468 0.626821 0.627765 0.526488 -1539.844641 -1539.812288 -1539.811344 -1539.912622 3.396881D-04 MUNgauss RevisionA2.0 retrievium 18-Dec-2020 DUDE Cc1ccc(o1)CN([C@H](c2ccc(cc2)[N+](=O)[O-])C(=O)NC(C)(C)CC(C)(C)C)C(=O)CO C36600495 RHF 6-31G(d) (6D,10F) C1 459.236936 |X|Y|Z| 93.018951 72.271138 41.366569 65.272254 14 6 7 8 12 1 1 |36.858105| |12.791709|36.858105| |7.322410|14.212949|36.858105| |5.140114|8.560407|13.209719|36.858105| |5.331227|8.718006|8.571224|14.226515|36.858105| |7.880824|14.102184|8.652105|8.650208|14.113710|73.516695| |3.940874|5.323315|5.138325|7.321480|12.752915|13.985883|36.858105| |3.617831|4.524933|4.191075|5.281907|7.697944|11.323911|13.035460|53.358707| |3.621659|4.186706|3.630008|4.145224|5.751365|10.377943|7.645667|17.785304|36.858105| |3.924115|4.516761|3.793302|4.266383|6.091822|11.686475|7.853832|12.764668|17.631088|0.500000| |3.961404|4.286613|3.570439|3.783780|4.915426|9.952996|5.331490|10.264553|12.486288|0.253688|36.858105| |3.909352|3.894051|3.173611|3.211766|4.003585|8.532577|4.158925|6.921049|7.635934|0.205949|13.656844|36.858105| |3.783838|3.539915|2.907376|2.834039|3.348328|7.142311|3.315705|5.282495|5.031306|0.135357|7.869956|13.804607|36.858105| |3.731664|3.506139|2.941932|2.838878|3.256710|6.800340|3.148472|5.057478|4.440788|0.113863|6.886202|8.025642|13.773368|36.858105| |3.775854|3.776855|3.243075|3.200708|3.677629|7.427934|3.555504|5.965744|4.963637|0.119543|7.902615|6.890748|7.894221|13.796630|36.858105| |3.892014|4.204360|3.615547|3.767464|4.592912|9.006525|4.655436|8.694109|7.396515|0.160241|13.712879|7.957075|6.850740|7.989961|13.761155|36.858105| |3.281836|2.984055|2.566534|2.429617|2.682625|5.503227|2.562064|3.958613|3.315220|0.087196|4.510838|5.139938|7.780354|13.076846|7.780537|5.126952|53.358707| |3.053610|2.723477|2.341948|2.209201|2.432396|4.998391|2.335115|3.536789|2.988500|0.080717|3.892044|4.685306|7.086965|8.383253|5.424475|4.091944|21.709260|73.516695| |3.060752|2.821113|2.490529|2.352166|2.538100|5.090996|2.405536|3.696869|2.974662|0.077394|3.893317|4.100743|5.422948|8.380913|7.077631|4.675550|21.722178|16.017886|73.516695| |2.816592|3.144060|2.841081|3.223935|4.109401|7.145547|5.467118|10.579855|12.268707|0.255464|7.227032|5.792476|4.164854|3.661691|3.930430|5.211832|3.916415|4.729699|4.623970|36.858105| |2.600757|2.939054|2.723530|3.154761|3.961264|6.596578|5.518552|9.302707|8.111099|0.207798|5.145065|4.386386|3.355013|2.997223|3.191340|4.042080|3.330179|4.076496|3.988102|15.826534|73.516695| |2.541796|2.733774|2.468931|2.709625|3.304073|5.933200|4.025871|7.318186|7.682504|0.172478|6.578149|5.851595|4.412667|3.857007|4.022702|5.030061|4.151295|5.044635|4.859369|14.232651|14.972046|53.358707| |2.127468|2.262513|2.085150|2.275089|2.676544|4.744414|3.196289|5.380016|4.890218|0.120177|4.373346|4.155886|3.451030|3.095448|3.169165|3.694250|3.527323|4.378754|4.199065|7.606938|11.641696|17.545512|36.858105| 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|2.406288|2.847771|2.972044|3.618000|3.848774|5.738636|4.486645|7.186758|3.993170|0.094560|3.541802|2.815895|2.494963|2.601127|3.127954|3.831190|3.039389|3.539230|3.962013|3.776509|6.578023|4.549534|2.945597|2.511646|3.274521|2.580041|2.639788|3.066791|2.212178|2.613888|8.064896|12.968803|13.730048|73.516695| |17.553611|8.931369|5.797749|4.477350|4.820954|12.425037|3.761256|4.651760|3.536172|0.110520|3.784198|3.909661|3.742919|3.510048|3.416058|3.537459|4.222163|5.292252|5.036323|2.802764|4.642914|3.442904|2.129073|2.077446|1.942649|1.982914|1.875948|2.059189|1.767519|1.670681|2.819238|4.545628|2.567028|3.964900|0.500000| |17.557065|8.939078|5.796806|4.483910|4.835264|12.461476|3.770348|5.007092|3.805594|0.111611|4.469810|4.499316|4.558662|4.624622|4.598205|4.524030|5.474051|6.518360|6.578745|2.929686|4.690340|3.669031|2.233855|2.111560|2.034760|2.113659|2.046181|2.313410|1.928218|1.805708|3.098040|5.070297|2.773201|4.346340|0.301664|0.500000| |17.599664|8.985638|6.839447|4.616665|4.425202|10.199518|3.354441|4.195769|3.031576|0.089506|3.282644|3.236767|3.214837|3.251987|3.299939|3.316801|4.063126|4.974916|5.080253|2.441037|4.054631|3.036802|1.904145|1.826614|1.773622|1.794106|1.738612|1.930817|1.642846|1.568862|2.662510|4.300612|2.512567|3.954838|0.300685|0.300613|0.500000| |6.325021|8.836336|17.798140|8.436510|5.843178|10.466832|4.031851|4.659004|3.024696|0.086948|3.020419|2.744757|2.583360|2.646668|2.887580|3.110498|3.236113|3.882992|4.161566|2.453841|4.205218|2.961020|1.870825|1.777554|1.807697|1.722547|1.678437|1.868068|1.550412|1.552161|3.031574|4.669767|3.098698|4.762443|0.141352|0.141175|0.189715|0.500000| |4.032436|5.837621|8.436452|17.786426|8.831524|10.461840|6.323942|6.392105|3.633278|0.101816|3.272285|2.790884|2.486323|2.506525|2.829181|3.296492|2.966297|3.536427|3.791576|2.967544|5.276676|3.418941|2.152120|2.024129|2.148869|1.912453|1.849620|2.056887|1.658129|1.737340|4.221797|5.990913|4.818036|6.742531|0.100190|0.100275|0.104998|0.193077|0.500000| |3.774120|4.837356|4.492495|5.814257|8.957422|12.482981|17.602399|12.547674|7.449897|0.252728|5.011915|4.179256|3.275523|2.997693|3.247601|4.119411|3.342693|4.055988|4.043169|5.732835|10.952333|5.607364|3.297673|3.190677|3.159758|2.700391|2.434297|2.640845|2.113798|2.213830|5.910345|8.103958|5.053627|6.608857|0.104876|0.099286|0.088882|0.100457|0.141569|0.500000| |3.368519|4.446478|4.649197|6.913485|9.068170|10.250444|17.669099|12.358754|5.691518|0.156112|4.230031|3.406777|2.817770|2.723635|3.077982|3.892628|3.096519|3.701681|3.855647|4.680957|8.896169|4.855709|2.962335|2.761610|3.011701|2.469363|2.311401|2.549759|1.993855|2.163299|7.287030|8.949827|7.783916|8.847930|0.089147|0.088943|0.082640|0.105633|0.191706|0.306962|0.500000| |3.656525|3.637136|2.985381|3.042371|3.799318|8.003534|4.049237|6.419044|7.160487|0.221700|8.893779|17.715537|8.987471|5.693042|4.961108|5.651803|5.679443|7.180239|6.057998|6.002101|8.327871|8.121798|4.330787|4.150494|3.374728|3.965661|3.406688|3.702980|3.106744|2.738867|3.810320|6.807735|2.965405|4.636149|0.105970|0.112085|0.084523|0.071972|0.073945|0.119435|0.092535|0.500000| |3.479163|3.160673|2.619377|2.525802|2.926458|6.199099|2.889327|4.437978|4.108873|0.115002|5.610356|8.894925|17.787854|8.927244|5.637036|4.945982|9.768033|14.157561|8.823605|3.596269|5.330973|5.237091|3.165533|2.970660|2.595154|3.268904|3.086190|3.429946|3.074920|2.480768|2.880474|5.284559|2.378722|3.900121|0.098556|0.114266|0.083660|0.065650|0.062103|0.080853|0.069308|0.215515|0.500000| |3.464154|3.466916|3.085709|3.021465|3.332735|6.527872|3.177905|5.186947|4.042527|0.098598|5.629205|4.966724|5.638879|8.945737|17.786695|8.899493|9.779178|8.829783|14.151718|3.336704|4.974434|4.643724|2.803689|2.402220|2.562694|2.831056|3.035192|3.922897|2.833389|2.597030|3.775861|7.147508|3.174258|5.492531|0.085771|0.115544|0.087068|0.078085|0.075505|0.079849|0.078624|0.107756|0.124341|0.500000| |3.619012|4.099779|3.718042|4.029001|4.810163|8.679085|4.951980|9.603020|6.780978|0.144089|8.898324|5.650602|4.948493|5.691710|8.998384|17.817803|5.681784|6.058630|7.185192|4.974257|7.121178|6.316610|3.522862|2.911234|3.308574|3.254309|3.348593|4.367079|2.865963|2.906443|7.321645|13.689253|5.238140|8.470721|0.090080|0.112648|0.087634|0.088994|0.099984|0.115626|0.118586|0.124034|0.107544|0.216280|0.500000| |2.642203|2.804936|2.510451|2.710801|3.281343|6.023125|3.838252|7.085879|7.436652|0.161173|7.829159|6.877420|5.248755|4.645087|4.880772|6.112821|4.836260|5.762832|5.604293|9.612351|10.948561|26.148936|9.019364|5.891821|6.128048|7.675216|6.412237|7.613312|4.739110|4.612341|5.036678|10.937673|3.609279|5.934095|0.072225|0.079467|0.064346|0.061575|0.069286|0.105716|0.093697|0.177207|0.122366|0.112021|0.149665|0.500000| |2.102513|2.246313|2.073648|2.276683|2.690674|4.739023|3.271136|5.051374|4.483719|0.123850|3.695136|3.640447|2.982464|2.605286|2.614656|3.029799|3.017628|3.826470|3.583378|6.737751|13.688873|9.654837|8.779987|17.628031|6.900303|5.542397|3.916829|3.518971|3.234476|3.503459|3.483587|6.505213|2.870539|4.630264|0.059835|0.059776|0.052211|0.051592|0.059960|0.100270|0.084810|0.113860|0.078380|0.064535|0.080423|0.146095|0.500000| |1.825275|1.915206|1.780518|1.922267|2.210051|3.923932|2.580700|3.989257|3.431175|0.092159|3.085324|3.105102|2.694541|2.401793|2.385000|2.660043|2.860008|3.661217|3.421101|4.664704|8.491671|7.640482|8.794583|17.550847|7.005438|6.928315|4.554526|3.671192|3.814286|4.180442|2.876570|5.565617|2.435860|4.097024|0.051637|0.052383|0.045956|0.044971|0.051016|0.076277|0.067912|0.093991|0.072155|0.059874|0.070729|0.128302|0.301275|0.500000| |2.100594|2.175665|1.973260|2.104613|2.467825|4.518450|2.855088|4.448676|4.124229|0.113988|3.786427|4.050125|3.405635|2.880798|2.771912|3.094017|3.357408|4.341903|3.909326|5.564300|9.285893|9.561089|8.765947|17.548228|5.510341|7.175213|4.536867|3.875328|3.942387|3.729413|3.049509|5.821450|2.502905|4.113181|0.060091|0.060824|0.052144|0.049398|0.054766|0.085726|0.072557|0.130058|0.092098|0.067697|0.079193|0.159606|0.300726|0.300911|0.500000| |1.993251|2.170709|2.065705|2.304962|2.650643|4.494129|3.202809|5.499081|4.331106|0.101598|3.823438|3.331667|2.868328|2.762723|3.011940|3.563948|3.198616|3.871363|3.957540|5.973851|9.986224|9.663807|8.746443|5.514259|17.613513|6.470865|6.110033|5.897987|4.098076|6.399754|4.662112|10.652853|3.763920|6.736634|0.054203|0.057770|0.050224|0.051800|0.062102|0.087211|0.086454|0.090621|0.071788|0.077138|0.102389|0.173445|0.142716|0.140899|0.122838|0.500000| |1.767737|1.892816|1.798347|1.977095|2.246052|3.863097|2.659090|4.275303|3.437461|0.086165|3.079662|2.868560|2.518412|2.372392|2.479323|2.813778|2.820577|3.504259|3.467944|4.665690|8.394592|7.596180|8.807823|6.776704|17.557092|6.883666|5.658422|4.561023|4.086649|6.365877|3.375911|6.974722|2.881449|5.082703|0.048807|0.050886|0.044834|0.045530|0.053368|0.074965|0.072021|0.081117|0.065193|0.063684|0.078376|0.132903|0.164588|0.204270|0.139993|0.300262|0.500000| |1.987526|2.178411|2.073300|2.337814|2.716957|4.562791|3.392250|5.533316|4.383244|0.108855|3.572717|3.197919|2.685163|2.499681|2.655589|3.150960|2.900899|3.573530|3.548679|6.611520|13.620528|9.267292|8.825361|7.163179|17.630914|5.428326|4.411461|4.092106|3.319742|4.405777|4.351309|8.722802|3.605581|6.056319|0.054915|0.056622|0.049905|0.051767|0.063123|0.096931|0.092402|0.091401|0.068360|0.067265|0.088878|0.146677|0.213841|0.180676|0.143510|0.303114|0.301220|0.500000| |2.094247|2.142160|1.940848|2.042528|2.364457|4.374342|2.653685|4.337719|4.000022|0.101877|4.179644|4.473211|4.035214|3.532553|3.374061|3.624478|4.116422|5.250160|4.775362|4.963670|7.344065|10.202912|8.976559|7.096342|5.478715|17.505854|8.862433|6.557537|7.517423|5.492887|3.121173|6.363936|2.521332|4.299924|0.058488|0.062408|0.052269|0.048887|0.053063|0.075434|0.067336|0.128384|0.107013|0.082326|0.091081|0.219758|0.145383|0.168899|0.219473|0.137578|0.140342|0.123994|0.500000| |1.802725|1.865279|1.727778|1.837802|2.092134|3.767948|2.372210|3.793797|3.278518|0.084110|3.222416|3.267336|2.973335|2.718688|2.686008|2.901111|3.272241|4.168488|3.923990|4.177856|6.760726|7.763356|8.959609|7.544149|6.566869|17.540548|8.931909|5.464789|7.090866|7.087290|2.826139|5.762209|2.366428|4.117914|0.050258|0.052852|0.045585|0.043891|0.048593|0.067452|0.061970|0.093716|0.079319|0.067887|0.076392|0.149996|0.148299|0.224950|0.193806|0.153253|0.197411|0.139783|0.306014|0.500000| |2.333302|2.399435|2.179446|2.281516|2.618996|4.849892|2.856955|4.925188|4.353689|0.102082|5.269970|5.041073|4.905582|4.999428|5.216745|5.378796|5.594561|6.514967|6.676992|4.635649|6.510325|8.447557|5.411922|3.966272|4.426677|6.693451|8.725350|17.509515|6.971263|5.494718|3.751728|8.229631|2.955637|5.218819|0.062771|0.071607|0.058337|0.054877|0.059028|0.076520|0.072168|0.121926|0.117704|0.128016|0.134072|0.242772|0.096551|0.097539|0.110499|0.134607|0.108681|0.103068|0.192867|0.138150|0.500000| |1.999486|2.073213|1.937148|2.039464|2.275314|4.097853|2.473360|4.152924|3.373710|0.080423|3.776751|3.501438|3.455273|3.676800|3.997926|4.066377|4.460785|5.232432|5.686860|3.628422|5.464168|6.107617|4.406672|3.310978|4.141595|5.406882|8.810135|17.542603|7.045964|7.015761|3.347569|7.437257|2.789632|5.199085|0.053417|0.060474|0.050994|0.049499|0.053892|0.065520|0.064564|0.087591|0.086071|0.107637|0.111202|0.149726|0.081789|0.085994|0.088787|0.133396|0.107277|0.095521|0.137930|0.123560|0.303422|0.500000| |2.215053|2.360460|2.201944|2.381701|2.730950|4.824947|3.101592|5.531374|4.564196|0.102737|4.845534|4.145028|3.745318|3.827089|4.342998|4.998989|4.328832|5.041421|5.383313|5.217176|7.475141|9.210056|6.176762|4.136203|5.914892|6.531333|8.671806|17.579933|5.501472|6.819590|4.632458|11.407228|3.585384|6.561654|0.059175|0.066424|0.055641|0.055284|0.062783|0.081594|0.080421|0.103640|0.090199|0.111112|0.140476|0.232862|0.103250|0.102771|0.106230|0.210516|0.138057|0.131732|0.156030|0.137529|0.300346|0.302810|0.500000| |1.660036|1.683115|1.562073|1.626892|1.812167|3.307564|1.975522|3.119875|2.621686|0.067334|2.767593|2.860688|2.822144|2.698644|2.618003|2.651516|3.423172|4.407529|4.170412|3.003700|4.794244|5.177447|4.511138|3.904153|3.869740|7.085776|8.719208|5.515413|17.533035|6.946976|2.347977|4.777200|2.018194|3.602339|0.045894|0.049303|0.042520|0.040213|0.043036|0.055025|0.051720|0.078686|0.076824|0.068104|0.069545|0.112248|0.089131|0.111036|0.110165|0.104664|0.113123|0.088931|0.189160|0.215681|0.141362|0.142661|0.122178|0.500000| |1.709790|1.733176|1.613780|1.674241|1.851702|3.379262|1.993829|3.186303|2.631646|0.066270|2.873878|2.901156|2.944454|2.962859|2.934091|2.892650|3.814353|4.790641|4.758719|2.897878|4.545107|4.895097|3.917128|3.227930|3.519842|5.538864|8.749204|6.988459|17.545498|7.056948|2.446466|5.067321|2.107039|3.834581|0.046625|0.051286|0.043961|0.041662|0.044304|0.054450|0.052227|0.076608|0.078498|0.078130|0.076497|0.111699|0.076960|0.088292|0.089750|0.101971|0.098894|0.081692|0.148099|0.144256|0.172680|0.212792|0.141873|0.301712|0.500000| |1.900285|1.905538|1.741269|1.795448|2.017410|3.754909|2.172754|3.485585|3.015282|0.076727|3.378111|3.604609|3.689857|3.524540|3.311823|3.253273|4.441459|5.708821|5.278449|3.331564|5.086371|5.867746|4.576010|3.834809|3.686769|6.996867|8.714419|6.951671|17.539194|5.524089|2.581456|5.274275|2.168033|3.827847|0.052359|0.057419|0.048298|0.044603|0.046896|0.060143|0.055854|0.096421|0.100202|0.084564|0.082455|0.137592|0.088951|0.101274|0.112803|0.102273|0.100031|0.086168|0.226874|0.170802|0.208892|0.173290|0.140846|0.301491|0.301763|0.500000| |1.731880|1.836182|1.749440|1.895115|2.115657|3.675222|2.410533|3.957942|3.122984|0.075960|3.050252|2.806553|2.584391|2.559001|2.732815|3.000398|3.092826|3.774415|3.887653|3.790527|6.208697|6.330351|5.768374|4.159568|7.074744|6.472322|8.672596|6.935501|5.520378|17.623959|3.263815|7.168168|2.806493|5.256850|0.047014|0.050705|0.044279|0.044677|0.051141|0.065378|0.065017|0.075322|0.066166|0.072166|0.084812|0.129884|0.101314|0.116049|0.100849|0.241667|0.213134|0.144329|0.134144|0.167127|0.140072|0.174911|0.203762|0.140259|0.143816|0.122388|0.500000| |1.630939|1.697446|1.611634|1.711347|1.886224|3.335684|2.082012|3.354887|2.663125|0.065886|2.739591|2.604121|2.508535|2.533346|2.654183|2.768639|3.165458|3.888984|4.022111|3.045928|4.922249|5.037196|4.277485|3.351946|4.461184|5.437780|8.801673|6.893855|7.190558|17.539183|2.700420|5.759955|2.362286|4.437844|0.044219|0.048166|0.042015|0.041546|0.046007|0.056373|0.055765|0.069154|0.065212|0.071417|0.076943|0.109061|0.081363|0.094030|0.086581|0.138316|0.131826|0.099662|0.124168|0.145317|0.141432|0.209474|0.166951|0.176733|0.219733|0.144602|0.303264|0.500000| |1.592670|1.659240|1.570271|1.675158|1.861154|3.288316|2.085406|3.321151|2.681565|0.067518|2.663211|2.578212|2.425700|2.357435|2.417352|2.570063|2.917425|3.651290|3.633380|3.218215|5.336329|5.423441|5.199053|4.181443|5.476749|6.900773|8.733917|5.499118|6.878017|17.531958|2.613200|5.449227|2.276964|4.163742|0.043709|0.046621|0.040870|0.040347|0.045017|0.057646|0.055878|0.070749|0.063930|0.063622|0.070502|0.110629|0.097595|0.124784|0.104801|0.152204|0.182936|0.117689|0.144199|0.218203|0.122391|0.141809|0.139787|0.204642|0.170550|0.140099|0.301715|0.302013|0.500000| |2.578032|3.154801|3.312847|4.337052|4.825270|6.645505|6.535523|9.193122|4.611655|0.113819|3.650341|2.925454|2.496616|2.488744|2.877758|3.592736|2.876926|3.414309|3.656095|4.371404|8.326154|4.813422|3.076524|2.739879|3.392457|2.564411|2.477706|2.754351|2.084879|2.412173|8.946163|11.298728|17.498821|16.484498|0.067674|0.070674|0.065259|0.080700|0.128935|0.147207|0.242378|0.077968|0.061502|0.075851|0.116009|0.093086|0.082496|0.068910|0.069633|0.102612|0.081027|0.104698|0.067409|0.064508|0.074730|0.070622|0.090021|0.053920|0.055231|0.056949|0.075005|0.062389|0.061599|0.500000| |3.066880|3.916835|4.279581|5.890571|6.189819|8.096063|7.048823|9.733269|4.659291|0.114332|3.994516|3.118692|2.709720|2.789916|3.349989|4.219398|3.208481|3.736061|4.132401|3.916724|6.851248|4.441694|2.754059|2.440804|2.881435|2.391558|2.362632|2.715806|2.029711|2.250513|8.881481|10.805866|17.534661|16.508704|0.077514|0.084241|0.077709|0.102402|0.176857|0.142149|0.233994|0.080297|0.065749|0.089852|0.144244|0.090168|0.071727|0.061154|0.063898|0.087556|0.069598|0.084715|0.064311|0.059602|0.075665|0.070763|0.087543|0.051889|0.054343|0.056271|0.068409|0.059286|0.056933|0.300699|0.500000| |2.255182|2.663385|2.839927|3.453290|3.532359|5.246184|4.001035|5.962152|3.400984|0.083207|3.042982|2.490151|2.234668|2.325671|2.747087|3.260716|2.765445|3.246501|3.623553|3.240406|5.770639|3.935754|2.606480|2.272999|2.902106|2.305746|2.354603|2.679081|2.005516|2.360014|5.961468|9.554499|9.927180|35.777974|0.058158|0.062992|0.058639|0.072294|0.103884|0.093737|0.126950|0.064740|0.055263|0.076093|0.109161|0.079733|0.065700|0.058611|0.058357|0.091453|0.071882|0.084465|0.060226|0.058349|0.071316|0.071779|0.087377|0.051510|0.054578|0.054182|0.073692|0.063072|0.059500|0.231719|0.226820|0.500000| 1538.449619 -10964.680753 4412.259818 -205.983702 -5219.955017 3679.515842 -1540.439175 2.001293 4038000000000050 44B792406E2336F8 4438878BE51613BD 4124C18000000000 BBE79CA100000000 4232C3B380820003