Version2.1 2020-12-17T00:33:49Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 03-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCOc1ccc(cc1)C2=NN=C3[C@@H]2[C@H](C(=C(O3)N)C#N)c4ccc(cc4)[NH+](CC)CC C09245775 RHF 6-31G(d) (6D,7F) CCCOc1ccc(cc1)C2=NN=C3[C@@H]2[C@H](C(=C(O3)N)C#N)c4ccc(cc4)[NH+](CC)CC C01[X(C26H30N5O2)] 183 C1 555 CCCOc1ccc(cc1)C1=NN=C2[C@@H]1[C@@H](c1ccc(cc1)[NH+](CC)CC)C(=C(O2)N)C#N CCCOc1ccc(cc1)C1=NN=C2[C@@H]1[C@@H](c1ccc(cc1)[NH+](CC)CC)C(=C(O2)N)C#N CCCOc1ccc(cc1)C2=NN=C3OC(=C(C#N)[C@@H]([C@H]23)c4ccc(cc4)[NH+](CC)CC)N InChIKey=VSMRZNISFBLHLM-XZOQPEGZSA-O InChI=1S/C26H29N5O2/c1-4-15-32-20-13-9-18(10-14-20)24-23-22(21(16-27)25(28)33-26(23)30-29-24)17-7-11-19(12-8-17)31(5-2)6-3/h7-14,22-23H,4-6,15,28H2,1-3H3/p+1/t22-,23+/m0/s1 InChI=1/C26H29N5O2/c1-4-15-32-20-13-9-18(10-14-20)24-23-22(21(16-27)25(28)33-26(23)30-29-24)17-7-11-19(12-8-17)31(5-2)6-3/h7-14,22-23H,4-6,15,28H2,1-3H3/p+1/t22-,23+/m0/s1/fC26H30N5O2/h31H/q+1 CCCOc1ccc(cc1)C2=NN=C3[C@@H]2[C@H](C(=C(O3)N)C#N)c4ccc(cc4)[NH+](CC)CC C01[X(C26H30N5O2)] 183 C01 555 CCCOc1ccc(cc1)C1=NN=C2[C@@H]1[C@@H](c1ccc(cc1)[NH+](CC)CC)C(=C(O2)N)C#N CCCO[C]1[CH][CH][C]([CH][CH]1)C1=NN=C2[C@@H]1[C@@H]([C]1[CH][CH][C]([CH][CH]1)[NH](CC)CC)[C]([C]([NH2])O2)C#N CCCO[C]1[CH][CH][C]([CH][CH]1)C2=NN=C3O[C](N)[C](C#N)[C@H]([C]4[CH][CH][C]([CH][CH]4)[NH](CC)CC)[C@H]23 InChIKey=GCBZPIMHFDEKTP-XZOQPEGZSA-N InChI=1S/C26H30N5O2/c1-4-15-32-20-13-9-18(10-14-20)24-23-22(21(16-27)25(28)33-26(23)30-29-24)17-7-11-19(12-8-17)31(5-2)6-3/h7-14,22-23,31H,4-6,15,28H2,1-3H3/t22-,23+/m0/s1 InChI=1/C26H30N5O2/c1-4-15-32-20-13-9-18(10-14-20)24-23-22(21(16-27)25(28)33-26(23)30-29-24)17-7-11-19(12-8-17)31(5-2)6-3/h7-14,22-23,31H,4-6,15,28H2,1-3H3/t22-,23+/m0/s1 3324.8339241441 -1423.748101 1-A 17964.8665 118 437 555 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0.08126 0.06330 16.87 25.59 35.79 45.68 57.66 79.80 89.22 100.49 106.84 112.47 133.23 136.65 145.98 182.73 192.05 204.22 233.74 242.31 249.54 280.04 302.78 314.15 359.95 364.04 377.97 407.31 435.09 441.39 451.73 466.27 486.00 537.73 546.93 589.09 604.82 642.96 656.55 660.30 676.18 682.92 695.24 736.98 749.49 762.10 811.67 816.87 850.98 862.95 901.83 909.37 946.18 991.89 999.22 1012.25 1047.43 1076.54 1113.86 1141.43 1156.40 1175.21 1192.92 1228.43 1236.65 1242.77 1300.53 1307.29 1316.46 1332.77 1343.83 1359.16 1373.74 1375.34 1419.27 1421.32 1425.69 1442.97 1455.46 1544.12 1562.95 1579.29 1582.87 1592.20 1593.81 1594.98 1599.11 1605.50 1607.94 1642.38 1653.31 1666.02 1682.28 1733.25 1743.81 1756.47 1788.73 1791.29 1807.03 1811.96 1830.86 1857.99 1871.48 1873.83 1877.41 1889.72 1898.48 1909.68 1913.39 1934.75 1976.70 2006.66 2021.31 2027.98 2051.40 2068.83 2088.38 2093.29 2098.68 2117.40 2134.63 2138.99 2166.89 2226.83 2234.82 2245.93 2252.12 2257.88 2261.88 2268.34 2274.55 2285.98 2286.74 2342.52 2347.42 2348.26 2352.68 2356.73 2360.62 2366.64 2366.68 2380.84 2387.45 2406.53 2431.09 2445.07 2525.35 2541.24 2588.20 2605.21 2606.15 2613.88 2626.07 2746.89 3697.35 4605.03 4614.22 4637.01 4637.87 4638.06 4663.77 4667.81 4680.14 4694.91 4715.19 4717.26 4722.87 4730.54 4738.83 4740.33 4779.80 4780.82 4814.19 4822.47 4835.77 4840.91 4870.98 4879.64 4893.06 4903.87 4911.76 4914.12 5319.77 5507.76 5687.20 0.566858 0.596607 0.597551 0.502542 -1423.181243 -1423.151494 -1423.150550 -1423.245559 3.186617D-04 MUNgauss RevisionA2.0 retrievium 17-Dec-2020 DUDE CCCOc1ccc(cc1)C2=NN=C3[C@@H]2[C@H](C(=C(O3)N)C#N)c4ccc(cc4)[NH+](CC)CC C09245775 RHF 6-31G(d) (6D,10F) C1 444.239950 |X|Y|Z| 102.918274 73.544933 44.313843 69.480279 21 6 7 8 18 2 1 |36.858105| |12.465715|36.858105| |7.544868|12.552811|36.858105| |5.093946|8.044752|13.484508|73.516695| |3.889035|5.229331|7.968682|25.354117|36.858105| |3.147186|4.088891|5.237461|14.613923|13.607146|36.858105| |2.616695|3.202334|3.975937|9.449108|7.919477|13.898827|36.858105| |2.513282|2.966218|3.764059|8.195834|6.804552|7.901716|13.592496|36.858105| |2.848959|3.332518|4.490748|9.270243|7.944599|6.909156|7.970727|13.754007|36.858105| |3.592118|4.388402|6.670673|14.031216|13.734858|7.918146|6.862643|7.862965|13.714051|36.858105| |2.112383|2.415148|2.927007|6.046421|4.462204|5.077700|7.651449|12.961901|7.642042|5.046786|36.858105| |1.919869|2.190211|2.572696|5.327555|3.759136|4.482403|6.603657|7.904977|5.225127|3.951134|15.005648|53.358707| |1.702127|1.901241|2.195234|4.399793|2.983515|3.374668|4.449743|5.255377|4.067908|3.187238|8.621939|18.324508|53.358707| |1.715751|1.895763|2.208758|4.340743|2.945992|3.189069|4.077662|5.178165|4.302534|3.282307|8.539464|12.089612|20.768856|36.858105| |1.948896|2.165548|2.597461|5.106702|3.589155|3.765169|4.878459|7.172506|6.153193|4.250099|12.607000|11.301837|11.225813|12.824510|36.858105| |1.982137|2.178757|2.626542|5.051556|3.517211|3.548671|4.387992|6.344659|6.175714|4.302392|8.824680|8.635115|8.589636|8.962088|17.545676|0.500000| |1.907720|2.094568|2.497306|4.811132|3.294142|3.345100|4.068332|5.502683|5.285185|3.917742|7.150546|7.433184|7.627659|7.738053|12.293495|0.245582|36.858105| |2.051223|2.236779|2.708265|5.114689|3.501961|3.393272|3.963897|5.410671|5.881641|4.369739|6.095182|6.201199|6.022075|5.658419|8.875688|0.225798|17.602605|0.500000| |1.676301|1.807682|2.104162|3.974011|2.622889|2.656050|3.122900|3.914154|3.807783|3.033566|4.947028|5.871359|6.755336|7.085189|7.757240|0.190222|12.528341|0.249343|36.858105| |1.547171|1.666753|1.915898|3.631127|2.375217|2.448794|2.894119|3.523758|3.313459|2.681566|4.597849|5.924544|7.583376|8.300833|6.853814|0.173805|7.518167|0.160224|14.048056|36.858105| |1.556925|1.693671|1.945245|3.743768|2.470000|2.612607|3.172329|3.843362|3.429412|2.743593|5.377648|7.505869|11.326781|14.141085|7.720469|0.187023|6.521922|0.138282|8.042121|14.171473|73.516695| |1.404645|1.497613|1.697145|3.181393|2.039156|2.090798|2.410359|2.830035|2.704371|2.270048|3.497702|4.648439|5.805852|5.519320|4.658754|0.125300|5.012070|0.118406|7.909862|14.229276|15.347872|53.358707| |1.610113|1.711138|1.972306|3.651769|2.354187|2.334492|2.643498|3.195807|3.242966|2.712650|3.716846|4.480477|4.937578|4.631008|5.065497|0.134116|7.525170|0.198509|13.354509|7.976826|9.288076|9.141665|36.858105| |1.547128|1.626410|1.856484|3.392799|2.148940|2.108718|2.334161|2.751842|2.839168|2.456086|3.076977|3.759126|4.061961|3.627165|3.925318|0.106328|5.366374|0.152027|7.424938|5.566271|7.162995|7.258310|16.722144|53.358707| |1.899009|2.107579|2.484646|4.878860|3.313510|3.469620|4.215011|5.248616|4.755790|3.740405|6.306538|7.127523|6.969515|5.976850|7.398147|0.152706|12.460278|0.249986|7.460256|5.466178|9.006932|5.551629|5.822147|6.298301|36.858105| |2.098094|2.348075|2.794944|5.509331|3.736952|3.820656|4.420664|5.263568|5.058159|4.196426|5.337437|5.967540|5.419585|4.348159|5.454587|0.124276|7.546995|0.206319|5.119385|3.969077|6.648121|4.337997|4.575553|5.404656|13.727090|36.858105| |2.025610|2.274701|2.632734|5.228103|3.412984|3.578023|3.982724|4.268186|4.002015|3.581988|4.213892|5.111246|4.659430|3.540349|4.062195|0.095438|5.000011|0.134164|3.904059|3.246652|5.553673|3.714943|3.636692|4.498962|7.885934|13.747726|36.858105| |1.793607|2.003090|2.266056|4.502483|2.891739|3.128124|3.538956|3.683100|3.317719|2.964129|3.855182|5.008135|4.747863|3.506075|3.727974|0.086825|4.426125|0.111883|3.713240|3.230648|5.610669|3.757892|3.432434|4.248771|6.863563|7.992144|13.822865|36.858105| |1.661498|1.844045|2.086206|4.128370|2.673687|2.918066|3.418503|3.660993|3.213903|2.779763|4.154489|5.611381|5.665089|4.188740|4.179316|0.094541|4.975733|0.116935|4.352722|3.884375|6.799285|4.455902|3.863364|4.634797|7.878816|6.882363|7.923491|13.773728|36.858105| |1.702355|1.884164|2.166276|4.266308|2.823298|3.046348|3.682755|4.231740|3.691694|3.041992|5.207767|6.787484|7.190835|5.735311|5.734529|0.122151|7.454785|0.156177|6.269214|5.334344|9.149294|5.659346|5.052073|5.647192|13.676617|7.980884|6.890118|7.997047|13.790863|36.858105| |1.703174|1.896011|2.092117|4.138010|2.571103|2.784869|3.027506|3.008857|2.747798|2.556793|3.061393|4.089275|3.883971|2.806184|2.915357|0.070261|3.296384|0.085702|2.899099|2.612888|4.582639|3.150497|2.753768|3.514477|4.481462|5.107684|7.751576|12.911380|7.692096|5.096695|53.358707| |1.804214|2.012553|2.212877|4.366978|2.679134|2.862679|3.023290|2.971686|2.771464|2.640818|2.920394|3.828149|3.570020|2.595062|2.759374|0.067474|3.111068|0.083197|2.705902|2.416885|4.221393|2.920521|2.600758|3.354138|4.117998|4.995353|7.834052|9.504611|5.829248|4.343010|25.719431|0.500000| |1.653730|1.857335|2.025118|4.068592|2.513227|2.814511|3.068413|2.922017|2.593335|2.428744|2.974652|4.140572|3.892339|2.703823|2.732472|0.066034|2.922629|0.075207|2.586644|2.411950|4.370337|2.926774|2.402555|3.043267|3.779449|4.076723|5.422953|7.627132|6.154083|4.361283|17.108659|0.259792|36.858105| |1.833839|2.104652|2.302262|4.767222|2.962660|3.454377|3.745303|3.368450|2.915146|2.763977|3.297037|4.603091|4.103550|2.787997|2.871229|0.069403|2.957074|0.076765|2.533314|2.362622|4.366253|2.829902|2.307950|2.894920|3.745536|4.142683|5.316773|6.314708|5.151759|4.063277|10.275017|0.200018|12.538118|36.858105| |1.527432|1.670670|1.822139|3.525877|2.157627|2.289840|2.464020|2.489732|2.324133|2.172279|2.573096|3.455124|3.399767|2.494164|2.541802|0.062371|2.905599|0.075941|2.693179|2.454850|4.224377|3.045800|2.649034|3.468545|3.763101|4.061524|5.409561|7.615596|6.149371|4.352393|17.118256|0.259865|7.606609|4.937247|36.858105| |1.536315|1.659854|1.814533|3.446649|2.097744|2.166021|2.302466|2.378191|2.289422|2.151911|2.437702|3.190670|3.153825|2.378679|2.475831|0.061633|2.921720|0.078348|2.746197|2.445369|4.087792|3.057920|2.815952|3.793525|3.713349|4.110290|5.290633|6.300480|5.145531|4.048399|10.278074|0.200065|4.937082|3.792568|12.538615|36.858105| |17.538228|8.757675|6.814722|8.300501|3.715900|2.995950|2.533032|2.474845|2.838591|3.557574|2.092075|2.570068|2.292884|1.712004|1.954938|0.055157|1.945901|0.058643|1.710867|1.565859|2.774932|1.936186|1.659423|2.183673|1.942986|2.169144|2.095925|1.839362|1.692454|1.732128|2.376541|0.051669|1.675187|1.841806|1.571644|1.597000|0.500000| |17.543281|8.761050|6.816631|8.300558|3.731517|3.017654|2.551682|2.489267|2.849378|3.563970|2.104629|2.599079|2.313549|1.720245|1.955356|0.055923|1.897495|0.056813|1.676432|1.553482|2.781779|1.923464|1.608436|2.101958|1.859045|2.026898|1.931073|1.716661|1.608006|1.663458|2.202380|0.047225|1.570767|1.731991|1.457688|1.467416|0.301367|0.500000| |17.576529|8.808594|5.497997|7.483344|3.301696|2.792964|2.350490|2.237767|2.477574|3.023232|1.911322|2.396171|2.139067|1.576141|1.766702|0.049711|1.730871|0.051236|1.535920|1.427191|2.557184|1.775024|1.479313|1.941345|1.732873|1.903628|1.859297|1.666302|1.545772|1.572310|2.178100|0.047086|1.564366|1.730461|1.443892|1.448753|0.302153|0.302231|0.500000| |8.822287|17.551352|8.945830|13.116376|4.917022|4.029925|3.149065|2.867870|3.147306|4.038304|2.350186|2.922658|2.539351|1.851598|2.101585|0.057940|2.056376|0.060635|1.773748|1.632388|2.944172|1.997960|1.684152|2.183999|2.110112|2.380642|2.356263|2.075121|1.885574|1.899826|2.709065|0.059300|1.954822|2.230604|1.746192|1.730547|0.209917|0.172491|0.212096|0.500000| |8.823301|17.558533|8.951262|13.114607|4.953174|4.082538|3.184807|2.890364|3.162262|4.048133|2.368017|2.965301|2.567392|1.862063|2.102255|0.058829|2.000029|0.058638|1.735852|1.618586|2.952467|1.984217|1.631411|2.102964|2.004601|2.197469|2.130310|1.904561|1.771578|1.810922|2.460563|0.052874|1.795113|2.044188|1.594596|1.569973|0.172470|0.210053|0.212082|0.303451|0.500000| |6.849859|8.833064|17.550033|16.519843|7.141115|4.824182|3.839483|3.765066|4.615431|6.784246|2.953963|3.516722|3.016087|2.244448|2.649342|0.076072|2.505064|0.075821|2.125598|1.946138|3.520426|2.349506|1.986246|2.539195|2.425069|2.664872|2.459817|2.135866|2.001290|2.108882|2.660937|0.056770|1.892437|2.127968|1.718049|1.714160|0.168055|0.202637|0.140301|0.174121|0.213240|0.500000| |6.856542|8.835382|17.537505|16.507195|7.027974|4.733887|3.774809|3.714048|4.568153|6.737067|2.918515|3.444592|2.969848|2.225674|2.647644|0.074158|2.619463|0.080340|2.196953|1.970371|3.505873|2.372533|2.084750|2.687411|2.620748|3.016133|2.831602|2.387506|2.171532|2.254199|2.986620|0.065039|2.083865|2.342146|1.913997|1.931883|0.202838|0.168252|0.140382|0.213064|0.174186|0.300646|0.500000| |3.119052|4.126224|4.869231|13.532206|8.943509|17.740513|8.923199|5.617246|4.972896|5.656231|4.120724|5.270507|4.096081|2.800804|3.171246|0.083109|2.863034|0.079843|2.344159|2.191468|4.162045|2.587572|2.086007|2.590604|3.014012|3.301612|3.226006|2.902616|2.695255|2.739644|3.640891|0.076771|2.776179|3.477497|2.207336|2.066712|0.081215|0.081904|0.078545|0.116334|0.118348|0.121596|0.119305|0.500000| |2.331312|2.810646|3.324986|7.628627|5.637207|8.973498|17.744617|8.902878|5.667207|4.948879|7.098536|10.049744|6.543859|4.123514|4.554900|0.111207|3.778129|0.098531|2.993182|2.849614|5.687117|3.253802|2.520477|3.028432|4.015891|4.059826|3.805067|3.568515|3.527567|3.724495|4.219096|0.084431|3.267949|4.080468|2.511838|2.293189|0.062571|0.063087|0.059204|0.077744|0.078729|0.089193|0.087712|0.214615|0.500000| |2.650518|2.981210|3.906127|7.487366|5.670406|4.970547|5.644591|8.897198|17.708282|8.996164|7.003652|6.538388|5.477633|4.531813|6.904959|0.212548|6.106571|0.206621|4.359226|3.684109|6.574189|4.047843|3.708683|4.373058|4.929703|5.023720|3.821015|3.180955|3.142571|3.719109|3.557575|0.072736|2.424886|2.642041|2.260111|2.265505|0.074347|0.074585|0.064269|0.077909|0.078190|0.114162|0.113287|0.107864|0.124113|0.500000| |3.985501|4.651409|7.367077|12.485905|8.867778|5.622702|4.951195|5.631883|8.945741|17.771422|4.122109|4.513916|3.807963|2.933831|3.743013|0.108461|3.582490|0.114364|2.865665|2.521841|4.495970|2.949700|2.636630|3.304735|3.361881|3.771827|3.240832|2.687642|2.518553|2.747769|3.193895|0.067703|2.204710|2.456574|2.033409|2.048998|0.112206|0.111911|0.090683|0.115243|0.114949|0.223279|0.225634|0.124075|0.107534|0.219004|0.500000| |1.375022|1.454990|1.643757|3.050442|1.938133|1.962622|2.226055|2.597862|2.539835|2.164366|3.102422|4.049954|4.827187|4.435468|4.043375|0.110983|4.563904|0.113251|7.147443|9.381649|10.809722|26.052827|7.436181|8.615588|3.776953|3.043681|2.621833|2.628999|3.052970|3.778805|3.027849|0.057688|2.042453|1.961562|2.181438|2.232671|0.038867|0.038437|0.035486|0.039633|0.039184|0.046424|0.047183|0.049696|0.060808|0.078108|0.058130|0.500000| |1.345366|1.433724|1.614900|3.030710|1.933078|1.994649|2.296055|2.656044|2.514764|2.129334|3.275850|4.487114|5.710807|5.189517|4.186623|0.114324|4.192585|0.100605|5.822486|9.462664|14.537010|26.053402|4.984486|5.706051|3.512169|2.814403|2.457211|2.505871|2.954214|3.635981|2.911741|0.055134|2.024042|1.968128|2.068828|2.053155|0.037669|0.037686|0.034812|0.038976|0.038998|0.045763|0.045726|0.050732|0.063891|0.075879|0.056379|0.309873|0.500000| |2.319911|2.593319|3.167033|6.143589|4.211733|4.056733|4.509994|5.538347|5.960148|5.001647|5.143744|5.513577|4.910815|3.983213|5.263067|0.127340|7.015020|0.227766|4.754924|3.670250|6.113503|4.059905|4.382486|5.284293|8.907323|17.744743|8.977960|5.686554|4.959150|5.658346|5.663822|0.118187|3.443606|3.596876|3.430299|3.566220|0.067257|0.062280|0.057721|0.072517|0.066428|0.083814|0.097326|0.095232|0.109492|0.168249|0.127085|0.080127|0.073508|0.500000| |2.155104|2.425458|2.788461|5.505582|3.499438|3.582990|3.773659|3.898863|3.797396|3.595321|3.647473|4.434269|3.997101|3.011306|3.459280|0.084255|4.090358|0.114966|3.289437|2.780847|4.769962|3.252280|3.147914|4.002803|5.629018|8.929188|17.700323|8.886607|5.628949|4.959628|9.695471|0.238601|5.100423|5.183920|5.094628|5.170950|0.062501|0.056367|0.054958|0.070880|0.062333|0.070983|0.084616|0.091082|0.098639|0.099386|0.091684|0.064414|0.060354|0.217483|0.500000| |1.531517|1.691580|1.887165|3.718873|2.371503|2.600691|3.011863|3.150230|2.768967|2.433119|3.582994|5.053398|5.274142|3.793374|3.593998|0.083243|4.071603|0.096775|3.796027|3.576455|6.367725|4.261511|3.421627|4.179422|5.631896|4.958308|5.627956|8.854038|17.733295|8.967498|9.563956|0.144307|6.324772|4.915570|6.339880|4.929365|0.043181|0.041229|0.039862|0.048085|0.045449|0.050435|0.054138|0.067977|0.088142|0.075239|0.061673|0.080959|0.079967|0.107652|0.123527|0.500000| |1.587199|1.744908|1.991397|3.894195|2.556509|2.759154|3.335352|3.828692|3.338679|2.753097|4.923972|6.790297|8.074529|6.588949|5.720351|0.123100|6.877868|0.140605|6.824955|6.509247|11.389292|6.825122|5.230592|5.724076|8.879820|5.658656|4.964884|5.693366|9.017005|17.763794|5.652465|0.099267|3.758246|3.501209|3.758356|3.501050|0.044666|0.043368|0.040875|0.048577|0.046933|0.054428|0.057057|0.069499|0.095159|0.094793|0.069632|0.121487|0.121411|0.124041|0.107704|0.219105|0.500000| |1.555253|1.738202|1.898264|3.800432|2.364197|2.659218|2.965249|2.861992|2.507374|2.308372|3.018780|4.319553|4.176700|2.863882|2.801138|0.067189|2.969782|0.074790|2.680881|2.549250|4.668830|3.105407|2.462943|3.096788|3.815435|3.868037|4.822020|6.990245|6.792042|4.681993|12.356082|0.182248|17.653773|8.790756|6.923360|4.547843|0.043603|0.041349|0.040884|0.050320|0.046961|0.049839|0.053937|0.072473|0.089186|0.065717|0.058194|0.059700|0.059943|0.089890|0.119897|0.221294|0.115716|0.500000| |1.576827|1.758548|1.888524|3.753385|2.271817|2.510045|2.668713|2.531840|2.291308|2.184055|2.550439|3.542173|3.358293|2.346787|2.367978|0.058263|2.524312|0.065904|2.277716|2.138049|3.852320|2.638080|2.152573|2.766881|3.149416|3.400299|4.379761|5.625893|4.708519|3.548129|12.413933|0.224514|17.627248|8.831621|7.340262|4.789764|0.044423|0.041487|0.041739|0.051697|0.047249|0.048934|0.053967|0.069731|0.078366|0.059823|0.055749|0.051556|0.050949|0.082448|0.120395|0.137424|0.087443|0.301918|0.500000| |1.747808|2.004531|2.160056|4.472336|2.739123|3.227905|3.466403|3.057179|2.638917|2.522551|3.008354|4.316464|3.873205|2.586099|2.609289|0.063825|2.621285|0.068018|2.289215|2.178107|4.075668|2.639392|2.084383|2.622348|3.189919|3.406146|4.101383|4.750305|4.228829|3.476758|7.535921|0.146467|8.970017|17.586670|4.127622|3.226995|0.048377|0.045938|0.046169|0.058982|0.054738|0.055710|0.060227|0.092814|0.107764|0.066478|0.062499|0.050709|0.051569|0.084161|0.111468|0.117491|0.086558|0.211756|0.215715|0.500000| |1.966565|2.271416|2.468654|5.122439|3.121863|3.578858|3.695527|3.288921|2.931006|2.864778|3.092566|4.187612|3.697516|2.558707|2.702663|0.066359|2.805263|0.074688|2.389957|2.202428|4.021686|2.646953|2.209159|2.798439|3.497165|4.056579|5.294595|5.657737|4.391716|3.607671|9.321254|0.212817|8.789373|17.553065|4.612559|3.738305|0.055097|0.051034|0.051583|0.067934|0.060759|0.062357|0.070248|0.101354|0.107894|0.073297|0.071121|0.051413|0.051016|0.101301|0.157079|0.113236|0.086109|0.172350|0.210249|0.302465|0.500000| |1.919158|2.221483|2.480441|5.225156|3.360227|4.047064|4.624442|4.110306|3.406818|3.144683|4.044477|5.682615|4.886832|3.266119|3.389381|0.080161|3.429516|0.087638|2.849386|2.647498|4.963467|3.107302|2.530222|3.118836|4.430818|4.847064|5.996512|6.895563|5.853450|4.768568|9.144854|0.172799|8.766445|17.618019|4.461304|3.582848|0.053349|0.050627|0.049865|0.064701|0.060036|0.064024|0.069808|0.110420|0.143516|0.084447|0.075951|0.059215|0.059870|0.114469|0.152683|0.147267|0.111904|0.210541|0.172589|0.301957|0.300065|0.500000| |1.477507|1.613594|1.737388|3.356534|2.024888|2.151886|2.280211|2.263191|2.118489|2.011027|2.309483|3.126817|3.058881|2.220336|2.253932|0.055972|2.514555|0.066341|2.341060|2.164364|3.762197|2.714145|2.303090|3.035049|3.141020|3.392492|4.373562|5.621859|4.706659|3.543887|12.417531|0.224565|7.340311|4.789749|17.627649|8.833204|0.042163|0.039040|0.039052|0.047120|0.042900|0.045355|0.050478|0.058471|0.064896|0.056890|0.052464|0.054058|0.051763|0.082239|0.120310|0.137602|0.087445|0.178799|0.238033|0.115690|0.127205|0.114406|0.500000| |1.446713|1.579408|1.724820|3.338820|2.055685|2.196336|2.400720|2.445088|2.256926|2.080593|2.594065|3.544533|3.573909|2.613223|2.592560|0.063259|2.951078|0.075516|2.802347|2.600838|4.488005|3.251605|2.736964|3.559866|3.797514|3.854050|4.811432|6.979222|6.783492|4.669686|12.358197|0.182261|6.923811|4.547999|17.653791|8.789244|0.041161|0.038593|0.038005|0.045516|0.042134|0.045572|0.049981|0.058686|0.068744|0.061357|0.053983|0.064351|0.061485|0.089563|0.119780|0.222090|0.115698|0.206872|0.178832|0.109407|0.112687|0.117972|0.302020|0.500000| |1.420005|1.521482|1.648738|3.106558|1.874728|1.929449|2.041864|2.106490|2.036220|1.922126|2.170137|2.865350|2.867694|2.163065|2.220941|0.055922|2.588381|0.069490|2.501278|2.265162|3.777700|2.891227|2.600101|3.560070|3.163249|3.382072|4.085309|4.741782|4.223665|3.464011|7.536570|0.146487|4.126997|3.226740|8.966734|17.587032|0.040976|0.037783|0.037383|0.043964|0.040110|0.043483|0.048575|0.051432|0.056688|0.056299|0.051207|0.059094|0.054245|0.083483|0.111249|0.117795|0.086546|0.109382|0.115677|0.078922|0.088008|0.084464|0.215686|0.211650|0.500000| |1.567078|1.690249|1.869480|3.540271|2.180683|2.236125|2.405598|2.544578|2.464098|2.279300|2.643707|3.414298|3.408509|2.622612|2.752551|0.068138|3.370765|0.090200|3.190778|2.774984|4.539506|3.443995|3.333271|4.504952|4.374001|4.791591|5.956240|6.875862|5.843961|4.742975|9.147387|0.172830|4.461210|3.582887|8.767737|17.617806|0.045322|0.041790|0.040806|0.048567|0.044320|0.049368|0.055518|0.058438|0.065986|0.068675|0.060383|0.070245|0.063267|0.113099|0.152216|0.147794|0.111901|0.117977|0.114407|0.084471|0.097036|0.098077|0.172615|0.210508|0.301973|0.500000| |1.616556|1.744459|1.899659|3.590262|2.162093|2.207890|2.303296|2.359960|2.305013|2.206540|2.360343|3.054874|2.967411|2.236268|2.370316|0.059578|2.775788|0.076125|2.562981|2.267927|3.804711|2.827313|2.632233|3.564262|3.471741|4.027194|5.270041|5.648397|4.388325|3.597758|9.324155|0.212890|4.612506|3.738428|8.789360|17.553637|0.046969|0.042610|0.042362|0.050903|0.045514|0.049429|0.056644|0.058707|0.063051|0.063022|0.058726|0.057468|0.052886|0.100441|0.156644|0.113458|0.086112|0.112686|0.127201|0.088014|0.107223|0.097041|0.210256|0.172334|0.302527|0.300096|0.500000| 1422.185085 -9947.095575 3971.602489 -195.274319 -4748.582320 3324.834163 -1423.748157 2.001099 408AFFFFFFFFFFE3 44B6CC9AA8E211A0 4438A0847E40E26E 4199953400000002 37A16C2614EA07FF 43520D43877D802D