Version2.3 2021-04-01T17:50:18Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 09-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE c1ccc2c(c1)CC(C2)NC(=O)[C@H]3CC=CC[C@H]3C(=O)N4CCN(CC4)c5cccc[nH+]5 C38740315 RHF 6-31G(d) (6D,7F) c1ccc2c(c1)CC(C2)NC(=O)[C@H]3CC=CC[C@H]3C(=O)N4CCN(CC4)c5cccc[nH+]5 C01[X(C26H31N4O2)] 183 C1 542 O=C([C@H]1CC=CC[C@H]1C(=O)N1CCN(CC1)c1cccc[nH+]1)NC1Cc2c(C1)cccc2 O=C([C@H]1CC=CC[C@H]1C(=O)N1CCN(CC1)c1cccc[nH+]1)NC1Cc2c(C1)cccc2 O=C(NC1Cc2ccccc2C1)[C@H]3CC=CC[C@H]3C(=O)N4CCN(CC4)c5cccc[nH+]5 InChIKey=NJUCCVZAGJEVDG-XZOQPEGZSA-O InChI=1S/C26H30N4O2/c31-25(28-21-17-19-7-1-2-8-20(19)18-21)22-9-3-4-10-23(22)26(32)30-15-13-29(14-16-30)24-11-5-6-12-27-24/h1-8,11-12,21-23H,9-10,13-18H2,(H,28,31)/p+1/t22-,23+/m0/s1 InChI=1/C26H30N4O2/c31-25(28-21-17-19-7-1-2-8-20(19)18-21)22-9-3-4-10-23(22)26(32)30-15-13-29(14-16-30)24-11-5-6-12-27-24/h1-8,11-12,21-23H,9-10,13-18H2,(H,28,31)/p+1/t22-,23+/m0/s1/fC26H31N4O2/h27-28H/q+1 c1ccc2c(c1)CC(C2)NC(=O)[C@H]3CC=CC[C@H]3C(=O)N4CCN(CC4)c5cccc[nH+]5 C01[X(C26H31N4O2)] 183 C01 542 O=C([C@H]1CC=CC[C@H]1C(=O)N1CCN(CC1)c1cccc[nH+]1)NC1Cc2c(C1)cccc2 O=C([C@@H]1CC=CC[C@@H]1[C]([NH][C@@H]1C[C]2[C]([CH][CH][CH][CH]2)C1)=O)N1CC[N@@]([C]2[CH]=[CH][CH]=CN2)CC1 O=C(NC1C[C]2[CH][CH][CH][CH][C]2C1)[C@H]3CC=CC[C@H]3C(=O)N4CCN(CC4)[C]5NC=CC=C5 InChIKey=LKABSGZHDZTMIS-XZOQPEGZSA-N InChI=1S/C26H31N4O2/c31-25(28-21-17-19-7-1-2-8-20(19)18-21)22-9-3-4-10-23(22)26(32)30-15-13-29(14-16-30)24-11-5-6-12-27-24/h1-8,11-12,21-23,27H,9-10,13-18H2,(H,28,31)/t22-,23+/m0/s1 InChI=1/C26H31N4O2/c31-25(28-21-17-19-7-1-2-8-20(19)18-21)22-9-3-4-10-23(22)26(32)30-15-13-29(14-16-30)24-11-5-6-12-27-24/h1-8,11-12,21-23,27H,9-10,13-18H2,(H,28,31)/t22-,23+/m0/s1/f/h28H 3237.3584517724 -1369.9957567 1-A 16255.2194 115 427 542 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0.06499 11.52 14.07 20.26 40.26 58.08 62.51 74.37 84.63 141.06 171.78 181.30 206.62 239.64 264.96 271.51 289.23 293.67 318.16 347.00 363.39 411.06 423.86 446.63 494.00 502.90 548.44 606.27 617.59 639.16 661.65 674.89 685.59 706.91 717.21 740.59 779.77 792.83 800.97 804.55 807.24 827.58 875.29 916.40 968.03 978.69 993.93 1022.45 1039.76 1061.29 1068.06 1121.74 1133.53 1182.56 1185.76 1195.75 1209.07 1223.03 1242.43 1246.61 1284.52 1320.83 1334.51 1363.95 1370.36 1388.11 1402.97 1407.90 1441.45 1459.45 1471.04 1504.59 1515.54 1530.27 1542.07 1546.23 1570.40 1587.56 1590.63 1608.15 1612.13 1616.93 1617.08 1648.31 1659.11 1660.95 1666.32 1675.28 1675.44 1715.12 1724.23 1739.59 1752.60 1757.09 1771.47 1801.40 1805.00 1842.67 1846.09 1875.99 1898.93 1904.20 1907.19 1918.10 1929.39 1938.67 1941.46 1966.12 1967.04 1967.56 1985.57 2015.43 2027.29 2042.78 2063.55 2074.44 2077.63 2099.56 2115.77 2133.65 2139.01 2177.76 2188.26 2196.64 2212.75 2214.12 2227.94 2236.81 2239.11 2249.15 2265.76 2282.06 2309.11 2339.49 2340.76 2346.49 2352.31 2357.25 2360.86 2366.19 2378.93 2379.23 2384.08 2407.51 2475.42 2481.49 2568.25 2610.10 2611.48 2663.12 2707.66 2735.33 2794.12 4572.22 4584.36 4593.82 4598.08 4604.53 4630.88 4645.84 4671.36 4680.32 4685.67 4685.94 4699.52 4716.78 4725.83 4752.37 4758.75 4791.12 4813.53 4819.43 4826.23 4834.41 4843.30 4847.38 4854.00 4875.32 4894.68 4932.41 4955.50 4999.63 5586.04 5587.74 0.582933 0.608651 0.609595 0.521653 -1369.412824 -1369.387106 -1369.386161 -1369.474104 2.949623D-04 MUNgauss RevisionA2.1 retrievium 01-Apr-2021 DUDE c1ccc2c(c1)CC(C2)NC(=O)[C@H]3CC=CC[C@H]3C(=O)N4CCN(CC4)c5cccc[nH+]5 C38740315 RHF 6-31G(d) (6D,10F) C1 431.244701 |X|Y|Z| 78.709306 95.302168 31.263888 61.667633 30 6 7 26 4 |36.858105| |13.724008|36.858105| |7.906837|13.731313|36.858105| |6.895989|7.978467|13.769307|36.858105| |7.980905|6.899601|7.915070|13.715066|36.858105| |13.731731|7.907645|6.816032|7.910637|13.770815|36.858105| |4.961810|4.473581|5.154165|7.993501|12.604638|7.290912|36.858105| |4.064881|4.063997|5.118738|8.012483|8.018442|5.122642|12.368132|36.858105| |4.472594|4.959328|7.283541|12.604240|7.998439|5.154885|7.801149|12.346303|36.858105| |3.158243|3.153991|3.802824|5.174672|5.192944|3.818099|7.638476|13.137701|7.543913|53.358707| |2.664626|2.695263|3.198000|4.049140|3.946959|3.098160|5.154989|7.732332|5.592010|19.341475|36.858105| |2.612385|2.674774|3.176621|3.918364|3.729229|2.978801|4.564359|6.789385|5.265129|11.579130|15.691806|73.516695| |2.249953|2.265117|2.615365|3.161413|3.120272|2.569226|3.919180|4.984581|4.069149|10.636689|12.458704|14.125474|36.858105| |2.215464|2.261435|2.634231|3.148450|3.027500|2.495278|3.684519|4.655389|4.111399|9.487773|9.047237|11.314266|17.491960|0.500000| |2.179432|2.139837|2.404837|2.894339|2.994471|2.523218|3.852287|4.385534|3.510670|8.792201|7.412696|9.471782|12.356509|0.247984|36.858105| |1.862801|1.834278|2.029877|2.363865|2.425743|2.110554|2.962637|3.263335|2.776505|5.860786|4.902909|7.126835|7.536101|0.183543|12.663854|36.858105| |1.710334|1.703411|1.887373|2.161946|2.176017|1.906555|2.580084|2.894291|2.539922|5.025544|4.387867|6.783537|6.653458|0.170396|7.625859|14.454939|36.858105| |1.733777|1.750877|1.963828|2.242351|2.206587|1.916344|2.581941|3.016536|2.686776|5.216326|4.901863|7.968392|7.499998|0.192910|6.331488|7.638846|12.654135|36.858105| |1.972315|1.997554|2.276688|2.656560|2.597798|2.203712|3.104286|3.829941|3.290908|6.929246|7.588591|12.463063|12.386182|0.250649|7.376703|6.595170|7.481104|12.341039|36.858105| |1.972897|2.030002|2.339368|2.700378|2.569863|2.174869|2.987925|3.777490|3.392945|6.548001|7.082936|13.033684|9.011880|0.226469|5.491445|4.930577|5.572025|8.903932|17.666691|0.500000| |1.945171|1.945686|2.183923|2.538069|2.536724|2.182484|3.033209|3.645696|3.037641|6.177797|6.431165|12.134455|7.540899|0.154395|6.018124|5.440464|5.831864|7.548520|12.517450|0.248142|36.858105| |1.994992|1.960733|2.173213|2.545752|2.621957|2.270980|3.208139|3.709370|2.979111|6.241963|6.033278|10.694275|6.714845|0.136159|6.496785|5.701992|5.512309|5.912949|7.996221|0.165796|15.883093|73.516695| |1.808763|1.823320|2.034332|2.310533|2.280943|1.994351|2.628928|3.125051|2.710908|4.937715|4.805073|9.930200|5.091648|0.117165|4.197748|3.992086|4.426903|5.779532|7.628877|0.202651|13.796634|15.177930|53.358707| |1.770689|1.767998|1.942530|2.187170|2.192128|1.949737|2.499955|2.880787|2.487142|4.340387|3.960259|8.209676|3.935480|0.092262|3.502890|3.322532|3.524274|4.134664|5.008995|0.132633|7.922221|12.811904|17.958378|36.858105| |1.953110|1.953509|2.151300|2.424630|2.423708|2.150212|2.733645|3.186229|2.735927|4.575653|4.091708|9.079254|3.694292|0.087485|3.236802|2.922325|2.977978|3.419987|4.301785|0.118909|6.043782|10.304021|10.654713|12.503527|36.858105| |1.983065|2.026875|2.264705|2.520331|2.437353|2.147326|2.676854|3.215600|2.881976|4.524817|4.060949|9.499980|3.573314|0.087690|2.987285|2.686007|2.771250|3.283457|4.163660|0.124701|5.186838|8.106193|9.186236|7.623007|12.879678|53.358707| |1.930965|2.001003|2.271885|2.529302|2.391863|2.081142|2.631489|3.245727|2.989187|4.744667|4.442971|10.476547|4.048614|0.101523|3.195008|2.897589|3.078416|3.869834|5.031807|0.166192|5.755167|8.095419|10.517750|6.575917|7.416431|17.458752|36.858105| |1.764806|1.809404|2.034432|2.273126|2.186337|1.913604|2.448885|2.952147|2.680432|4.531924|4.323601|9.281181|4.415435|0.109288|3.505938|3.332724|3.729145|5.008927|6.309623|0.205606|7.558883|9.509246|17.955249|8.086015|6.588698|10.321897|12.466314|36.858105| |2.090669|2.152979|2.397802|2.624312|2.513571|2.234871|2.676992|3.185679|2.928890|4.248343|3.616672|8.317266|3.083303|0.077498|2.625520|2.342090|2.373970|2.734011|3.377707|0.101040|3.937475|6.458245|6.284321|5.105966|7.865504|19.478417|7.906018|5.100164|36.858105| |2.090622|2.203787|2.475866|2.640732|2.452012|2.186145|2.531003|3.025806|2.938317|3.959271|3.291506|7.394029|2.815587|0.073163|2.378471|2.132099|2.169073|2.503701|3.032341|0.093316|3.304550|5.350585|5.112392|3.858194|5.051879|10.629136|6.694431|4.383030|13.372632|36.858105| |2.134062|2.263643|2.504593|2.597402|2.406527|2.189531|2.408987|2.798483|2.780196|3.547438|2.829064|6.095716|2.424305|0.063712|2.101001|1.887886|1.900281|2.142224|2.534024|0.076471|2.721679|4.536013|4.071713|3.110395|3.948189|7.101349|4.537092|3.341732|7.903439|14.037338|36.858105| |2.184111|2.274934|2.454878|2.539430|2.414777|2.241804|2.401830|2.702633|2.630513|3.371710|2.632702|5.557392|2.255335|0.058725|2.005641|1.800921|1.792383|1.980098|2.323275|0.068278|2.540465|4.364351|3.745543|2.962019|3.821286|6.252172|3.763008|2.930728|6.759061|7.856274|13.434377|36.858105| |2.191585|2.230250|2.393186|2.538156|2.481479|2.300081|2.530397|2.825018|2.638802|3.554179|2.797765|5.941979|2.389772|0.061044|2.147298|1.921425|1.902597|2.089740|2.471216|0.071334|2.794681|4.894289|4.136907|3.413189|4.665171|7.204204|3.964811|3.124773|7.928057|6.940875|8.088954|14.192774|36.858105| |2.146879|2.175516|2.371818|2.583493|2.535769|2.299030|2.678319|3.068096|2.779666|3.979895|3.254107|7.161209|2.769787|0.069375|2.451721|2.184911|2.176800|2.426886|2.935871|0.084709|3.451484|5.989367|5.268659|4.513496|6.988404|11.178842|5.217988|3.945293|14.123175|8.116045|7.086028|8.093377|13.956652|53.358707| |2.113768|2.107053|2.276533|2.507310|2.518527|2.293646|2.711245|3.049750|2.686559|4.007804|3.277147|7.081746|2.818104|0.069526|2.546012|2.272108|2.249660|2.476524|2.987430|0.084024|3.632850|6.518642|5.508144|5.004914|8.197073|10.339328|4.813287|3.892017|9.405000|5.845581|5.173043|5.904160|9.442442|26.050520|0.500000| |17.718400|8.918093|5.636217|4.964036|5.664307|8.917429|4.021999|3.343374|3.571949|3.687770|2.335059|4.082137|2.012083|0.054979|1.970258|1.709134|1.574740|1.588498|1.786020|0.049492|1.772530|3.242624|2.258392|1.636810|1.797613|2.471050|1.759156|1.617605|1.914975|1.912707|1.966416|2.032159|2.040515|2.698123|0.054429|0.500000| |8.919021|17.717142|8.916586|5.663106|4.965809|5.636715|3.572490|3.342341|4.019798|3.681186|2.371642|4.216870|2.031279|0.056608|1.919109|1.670583|1.565182|1.611877|1.819386|0.051597|1.773150|3.161205|2.285498|1.632983|1.798066|2.553118|1.855168|1.679401|2.001395|2.072143|2.154298|2.165836|2.096329|2.752741|0.054164|0.215628|0.500000| |5.629468|8.897997|17.701060|8.884316|5.625882|4.921112|4.208699|4.482109|6.568254|4.782688|3.057381|5.472517|2.532968|0.071852|2.289782|1.955682|1.842149|1.938660|2.237909|0.064860|2.125681|3.704099|2.724204|1.898191|2.095567|3.056878|2.287126|2.035908|2.387109|2.523409|2.564040|2.463126|2.352585|3.164318|0.061241|0.124013|0.214856|0.500000| |8.897869|5.629779|4.921262|5.624186|8.884013|17.703045|6.577434|4.487419|4.210136|4.812260|2.907539|4.938843|2.460207|0.065721|2.479451|2.088665|1.874139|1.859952|2.119380|0.057403|2.123544|3.987888|2.634618|1.910364|2.094085|2.796146|1.973126|1.835205|2.122612|2.047265|2.045116|2.116462|2.202537|3.004769|0.062022|0.214859|0.124020|0.106964|0.500000| |4.433459|4.004446|4.508109|6.425006|8.862629|6.193207|17.480066|8.743147|6.530124|9.871861|4.840887|7.245620|3.946881|0.105466|4.070299|3.122843|2.663767|2.601303|3.051029|0.080528|2.908527|5.481065|3.389870|2.341261|2.488790|3.298499|2.422258|2.310659|2.385715|2.263831|2.146316|2.125350|2.228670|3.219168|0.066710|0.102980|0.091054|0.105233|0.163886|0.500000| |4.492301|3.905531|4.240966|5.849038|8.699775|6.542320|17.571248|8.681130|5.644533|8.778284|4.806723|7.782651|3.739935|0.094525|3.804474|2.951701|2.558841|2.535469|3.039567|0.079937|3.089411|5.998756|3.646361|2.608432|2.874585|3.721538|2.615491|2.445417|2.729999|2.519896|2.401038|2.442239|2.632911|3.807913|0.080303|0.105765|0.089057|0.098467|0.185153|0.302518|0.500000| |3.868784|3.868826|4.749015|6.790070|6.789155|4.748987|8.876327|17.647837|8.882816|12.699905|7.462259|13.914405|4.700221|0.117417|4.057417|3.093865|2.802109|2.977974|3.856345|0.106746|3.871462|7.013915|4.620152|3.198937|3.702268|5.109981|3.657115|3.205066|3.792664|3.528531|3.243012|3.157687|3.356366|5.022310|0.101602|0.089741|0.089736|0.117450|0.117474|0.174818|0.221714|0.500000| |3.903607|4.487903|6.531828|8.699291|5.851999|4.240911|5.646964|8.677748|17.565529|8.652530|5.459937|9.987875|3.972560|0.112030|3.286572|2.656140|2.493452|2.713541|3.360201|0.099712|3.099130|5.258918|3.858402|2.585025|2.880920|4.286722|3.325688|2.888115|3.249474|3.363656|3.165416|2.909158|2.856093|4.094022|0.078946|0.089021|0.105648|0.184676|0.098493|0.133987|0.126567|0.222279|0.500000| |4.000220|4.425115|6.174296|8.847475|6.427321|4.507107|6.538451|8.758364|17.500630|9.768313|5.302713|8.344711|4.145458|0.122559|3.603860|2.867495|2.612897|2.738218|3.277070|0.093708|2.917054|5.049845|3.510648|2.330514|2.493129|3.555978|2.770250|2.555222|2.605575|2.621407|2.467465|2.319451|2.320272|3.337466|0.066167|0.090975|0.102787|0.163281|0.105258|0.176693|0.134107|0.175207|0.302241|0.500000| |3.045534|3.007240|3.552710|4.717622|4.869374|3.684684|7.117107|9.054484|6.382113|26.068591|9.460157|10.885922|7.508239|0.200720|7.187156|4.666741|3.835748|3.793311|4.727200|0.121015|4.092283|7.458710|4.441249|2.871785|2.941454|3.916842|3.029899|2.984047|2.697026|2.532890|2.295958|2.194076|2.302834|3.467977|0.071635|0.073252|0.072037|0.091084|0.096342|0.221883|0.165679|0.181733|0.145753|0.189661|0.500000| |2.297106|2.245894|2.524344|3.062229|3.195858|2.679175|4.161132|4.559707|3.699879|9.146360|6.509963|8.280596|8.812086|0.225576|17.514977|9.016317|5.886904|4.941840|5.475050|0.125219|4.537027|8.558590|4.662569|2.948456|2.805528|3.595232|2.808636|2.989995|2.385582|2.201920|1.977562|1.894858|2.009025|3.062399|0.064416|0.057502|0.055687|0.066326|0.073147|0.129096|0.111041|0.111219|0.093250|0.109066|0.241523|0.500000| |2.243974|2.168867|2.409511|2.915757|3.106236|2.634684|4.095129|4.506373|3.446778|8.609924|7.022087|9.491867|8.762756|0.175158|17.604436|8.967806|6.077669|5.226606|6.288622|0.133553|6.174083|13.735692|5.836701|3.752057|3.504600|4.234034|3.193854|3.451936|2.736029|2.425431|2.150005|2.084499|2.269591|3.548669|0.076589|0.056499|0.053811|0.062936|0.072975|0.117865|0.117940|0.119417|0.088993|0.095045|0.184743|0.303494|0.500000| |1.792354|1.749296|1.911051|2.208312|2.296813|2.030428|2.784656|2.948066|2.530696|5.091161|4.008738|5.959655|5.447340|0.139427|8.653785|17.694775|9.193795|5.497553|4.813100|0.107114|4.287503|8.271304|4.544169|2.906838|2.588652|3.225284|2.506339|2.831258|2.100226|1.920126|1.723595|1.660353|1.771278|2.708459|0.057682|0.046022|0.044381|0.050918|0.056434|0.082838|0.077755|0.077264|0.066572|0.072825|0.114779|0.215570|0.204373|0.500000| |1.565339|1.557443|1.709212|1.931282|1.946291|1.730498|2.267534|2.492048|2.226840|4.170937|3.516143|5.602950|4.841577|0.129250|5.491967|9.185956|17.696441|8.637328|5.428954|0.122884|4.630898|7.926953|5.191342|3.154886|2.656355|3.369602|2.723832|3.294275|2.140957|1.968909|1.740268|1.647717|1.743930|2.691703|0.056783|0.040335|0.040026|0.046468|0.047464|0.065163|0.062705|0.067249|0.060843|0.063703|0.088596|0.128890|0.130941|0.222224|0.500000| |1.695054|1.728511|1.947558|2.202986|2.134767|1.855362|2.455571|2.876520|2.651280|4.905102|4.463845|7.269060|6.486182|0.194335|5.309354|6.137512|8.946777|17.510939|8.845031|0.228921|5.580147|8.023317|6.401870|3.499002|3.009947|4.084730|3.611544|4.508109|2.555195|2.405514|2.071796|1.896754|1.970626|3.070762|0.063046|0.043128|0.044408|0.053951|0.049683|0.069128|0.065893|0.077857|0.074979|0.076393|0.100200|0.125131|0.120127|0.131653|0.201345|0.500000| |1.613056|1.628024|1.810559|2.041671|2.012229|1.769963|2.319284|2.674092|2.401294|4.438570|4.084400|7.034791|5.500070|0.140285|4.874023|5.818176|8.927719|17.533303|8.784784|0.203347|7.279934|10.028152|8.691155|4.512449|3.533495|4.574496|3.959392|5.494891|2.752062|2.500794|2.129563|1.968776|2.084987|3.314747|0.069281|0.041312|0.041891|0.049777|0.047891|0.064261|0.063978|0.074750|0.067969|0.067140|0.088424|0.109439|0.121122|0.127725|0.215271|0.305249|0.500000| |1.623083|1.626986|1.776300|1.969252|1.962220|1.766120|2.195823|2.497077|2.213284|3.706628|3.289495|6.692009|3.317820|0.080561|2.988918|2.921806|3.160767|3.700054|4.189129|0.114439|5.832004|9.368512|12.567263|17.585669|8.841829|9.107107|5.967255|7.523367|4.712388|3.684894|2.997866|2.843666|3.230606|5.669969|0.125506|0.041948|0.042101|0.048552|0.048084|0.057485|0.063242|0.076151|0.064207|0.058032|0.069114|0.071326|0.087186|0.072172|0.080964|0.089394|0.115919|0.500000| |1.753843|1.730214|1.883699|2.129710|2.174132|1.946902|2.509310|2.818767|2.393998|4.271608|3.804044|7.500933|3.854621|0.089288|3.642102|3.499996|3.637205|4.027736|4.702962|0.117810|7.496458|14.701820|12.471300|17.699812|8.946929|7.616875|4.881533|5.776402|4.203814|3.270875|2.744570|2.684378|3.115584|5.414724|0.126416|0.045216|0.044296|0.050670|0.053597|0.065780|0.073917|0.086077|0.067792|0.062554|0.079702|0.084526|0.112182|0.086286|0.091042|0.092963|0.121156|0.301671|0.500000| |1.854923|1.845407|2.001678|2.222946|2.239517|2.026366|2.482491|2.803436|2.443215|3.930423|3.363641|7.147767|3.075108|0.074398|2.790722|2.565901|2.605449|2.911910|3.482097|0.095904|4.618043|8.233336|7.761236|8.989191|17.572115|12.376256|5.599918|5.066871|7.169764|4.699594|3.867446|3.926303|5.007878|10.188058|0.273814|0.047887|0.047510|0.054099|0.055239|0.062913|0.073180|0.089777|0.071034|0.061943|0.071382|0.068447|0.084196|0.064484|0.065893|0.072155|0.084266|0.222365|0.211984|0.500000| |2.157655|2.136728|2.360072|2.715259|2.758423|2.418083|3.188338|3.739598|3.074685|5.347889|4.779698|10.755731|4.093626|0.094452|3.617208|3.136280|3.089156|3.460538|4.498941|0.120578|6.348871|11.811005|9.343177|8.907491|17.563110|12.335036|6.203117|5.506026|6.896367|4.671812|3.793886|3.762609|4.644732|9.135117|0.226973|0.054781|0.053999|0.062982|0.065583|0.079368|0.094897|0.124311|0.088628|0.076653|0.093544|0.086846|0.112298|0.077075|0.075369|0.083999|0.095924|0.174526|0.222836|0.298280|0.500000| |1.817832|1.900516|2.148026|2.340257|2.190612|1.929518|2.354819|2.853390|2.721838|4.084081|3.659558|8.170471|3.396029|0.088298|2.747158|2.541410|2.717075|3.369832|4.100362|0.135577|4.427958|6.477034|7.740185|5.126159|5.630337|12.381489|17.632526|8.974407|7.184031|7.222598|4.819658|3.808109|3.830269|6.514770|0.118593|0.046252|0.049479|0.060835|0.050695|0.060541|0.064597|0.087985|0.084874|0.070645|0.073743|0.068456|0.075576|0.061964|0.068162|0.090195|0.096825|0.141063|0.110847|0.131457|0.131862|0.500000| |2.122921|2.220094|2.573465|2.908339|2.699206|2.298705|2.985256|3.850061|3.563532|5.655763|5.479524|14.111894|4.676549|0.117961|3.503476|3.063576|3.193092|4.018764|5.543116|0.192819|5.818462|8.188170|9.043187|5.402937|6.176869|12.398884|17.636909|8.864377|7.044691|6.505191|4.544197|3.736336|3.858299|6.662307|0.124418|0.053103|0.056694|0.072213|0.059819|0.075689|0.080925|0.121365|0.113010|0.090887|0.097558|0.086158|0.095955|0.072922|0.077083|0.105749|0.108707|0.130783|0.120161|0.131564|0.163727|0.299314|0.500000| |1.744725|1.801446|2.039910|2.276077|2.164560|1.885427|2.419595|2.938356|2.722486|4.600932|4.413171|9.078588|4.740865|0.122338|3.630284|3.500361|4.035149|5.811848|7.106924|0.265703|6.905325|8.602710|12.326955|5.748627|4.897254|7.605067|8.945446|17.679327|4.214366|3.884494|3.048024|2.652052|2.758374|4.554140|0.090715|0.044328|0.046510|0.057143|0.049986|0.064204|0.066029|0.086365|0.081771|0.073499|0.085250|0.086466|0.095464|0.081553|0.098472|0.153074|0.175062|0.150648|0.127610|0.110010|0.122561|0.210144|0.223283|0.500000| |1.615809|1.653819|1.837721|2.023810|1.955162|1.737769|2.160575|2.536926|2.334204|3.816758|3.478153|7.188223|3.585550|0.090763|3.001711|2.944105|3.321626|4.286650|4.850187|0.149865|5.724288|7.915487|12.660830|7.509317|5.870854|8.930489|8.842549|17.585908|4.649947|4.057839|3.162048|2.795199|2.971447|5.027304|0.101540|0.041477|0.042975|0.051195|0.046532|0.056908|0.060255|0.076068|0.069482|0.062073|0.071051|0.072253|0.082631|0.071086|0.084447|0.109133|0.136738|0.237376|0.151388|0.136536|0.130831|0.225460|0.174813|0.305428|0.500000| |2.011332|2.141151|2.431653|2.587075|2.366832|2.095880|2.447652|2.963252|2.939001|3.959626|3.338839|7.466947|2.905908|0.076767|2.407388|2.173253|2.239405|2.634180|3.180821|0.101084|3.352814|5.274677|5.220177|3.736624|4.559486|9.543376|7.519941|4.764475|8.801616|17.851854|9.052911|5.619787|4.997981|7.805873|0.127218|0.051010|0.056099|0.069825|0.054289|0.061569|0.066678|0.093641|0.094804|0.074079|0.070739|0.061899|0.066978|0.054029|0.056449|0.071382|0.073113|0.100218|0.087186|0.114373|0.116272|0.258537|0.206994|0.121253|0.121814|0.500000| |2.079058|2.239203|2.478319|2.513280|2.292644|2.098559|2.257650|2.608040|2.671830|3.300848|2.600179|5.479505|2.254272|0.060235|1.956355|1.768719|1.784714|2.008502|2.341488|0.071128|2.452392|4.071527|3.628926|2.710866|3.285157|5.723550|3.943150|3.006532|5.634451|9.078364|17.734339|8.827068|5.724496|6.891413|0.111250|0.053361|0.059962|0.071797|0.054128|0.056345|0.061731|0.082072|0.085206|0.066577|0.059960|0.051619|0.055038|0.045012|0.045627|0.054658|0.055330|0.073258|0.067063|0.088933|0.088115|0.119711|0.111516|0.078295|0.079623|0.219649|0.500000| |2.161602|2.256408|2.392778|2.421568|2.305377|2.181526|2.248529|2.475982|2.448074|3.062642|2.346208|4.830430|2.028804|0.053297|1.827247|1.648961|1.635835|1.788182|2.067449|0.060425|2.231552|3.864509|3.245439|2.547342|3.166055|4.969320|3.116889|2.518967|4.897774|5.608753|8.731719|17.784911|9.047718|7.784098|0.128606|0.056444|0.060458|0.066863|0.057265|0.055516|0.063409|0.079020|0.074556|0.060285|0.055997|0.048415|0.052651|0.042561|0.042022|0.047846|0.049303|0.068401|0.065229|0.090861|0.087453|0.088113|0.086637|0.064336|0.067259|0.123730|0.210877|0.500000| 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