Version2.0 2020-01-24T20:43:01Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 09-Sep-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCc1cc(ccc1C)Nc2cc(=O)n(c(=O)[nH]2)CCCCC[NH+]3CCC(=CC3)c4ccc(cc4)F C13674979 RHF 6-31G(d) (6D,7F) CCc1cc(ccc1C)Nc2cc(=O)n(c(=O)[nH]2)CCCCC[NH+]3CCC(=CC3)c4ccc(cc4)F C01[X(C29H36F1N4O2)] 210 C1 612 CCc1cc(ccc1C)Nc1cc(=O)n(c(=O)[nH]1)CCCCC[NH+]1CCC(=CC1)c1ccc(cc1)F CCc1cc(ccc1C)Nc1cc(=O)n(c(=O)[nH]1)CCCCC[NH+]1CCC(=CC1)c1ccc(cc1)F CCc1cc(NC2=CC(=O)N(CCCCC[NH+]3CCC(=CC3)c4ccc(F)cc4)C(=O)N2)ccc1C InChIKey=YTDGKAKXSJZKPA-UHFFFAOYSA-O InChI=1S/C29H35FN4O2/c1-3-22-19-26(12-7-21(22)2)31-27-20-28(35)34(29(36)32-27)16-6-4-5-15-33-17-13-24(14-18-33)23-8-10-25(30)11-9-23/h7-13,19-20,31H,3-6,14-18H2,1-2H3,(H,32,36)/p+1 InChI=1/C29H35FN4O2/c1-3-22-19-26(12-7-21(22)2)31-27-20-28(35)34(29(36)32-27)16-6-4-5-15-33-17-13-24(14-18-33)23-8-10-25(30)11-9-23/h7-13,19-20,31H,3-6,14-18H2,1-2H3,(H,32,36)/p+1/fC29H36FN4O2/h32-33H/q+1 CCc1cc(ccc1C)Nc2cc(=O)n(c(=O)[nH]2)CCCCC[NH+]3CCC(=CC3)c4ccc(cc4)F C01[X(C29H36F1N4O2)] 210 C01 612 CCc1cc(ccc1C)Nc1cc(=O)n(c(=O)[nH]1)CCCCC[NH+]1CCC(=CC1)c1ccc(cc1)F CCc1cc(ccc1C)N[C@H]1CC(=O)N(C(=O)N1)CCCCC[NH]1CCC(=CC1)c1ccc(cc1)F CCc1cc(N[C@H]2CC(=O)N(CCCCC[NH]3CCC(=CC3)c4ccc(F)cc4)C(=O)N2)ccc1C InChIKey=JLKUKZWYFWGYIU-HHHXNRCGSA-N InChI=1S/C29H38FN4O2/c1-3-22-19-26(12-7-21(22)2)31-27-20-28(35)34(29(36)32-27)16-6-4-5-15-33-17-13-24(14-18-33)23-8-10-25(30)11-9-23/h7-13,19,27,31,33H,3-6,14-18,20H2,1-2H3,(H,32,36)/t27-/m1/s1 InChI=1/C29H38FN4O2/c1-3-22-19-26(12-7-21(22)2)31-27-20-28(35)34(29(36)32-27)16-6-4-5-15-33-17-13-24(14-18-33)23-8-10-25(30)11-9-23/h7-13,19,27,31,33H,3-6,14-18,20H2,1-2H3,(H,32,36)/t27-/m1/s1/f/h32H 3377.3097786283 -1585.9655683 1-A 50096.7927 131 481 612 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1124.65 1136.23 1136.34 1141.89 1164.83 1168.89 1180.03 1221.18 1235.70 1247.72 1249.86 1264.34 1282.15 1301.66 1322.90 1337.78 1346.82 1362.29 1384.14 1439.95 1455.01 1464.71 1479.49 1490.09 1518.74 1533.92 1550.15 1562.27 1569.61 1580.13 1586.25 1588.51 1589.07 1601.29 1617.64 1633.38 1637.18 1652.62 1654.29 1678.26 1688.26 1697.26 1708.19 1710.94 1723.08 1748.90 1787.23 1801.74 1838.04 1843.78 1850.06 1854.25 1864.97 1879.58 1886.88 1898.15 1943.50 1950.48 1976.55 1990.08 2010.11 2015.93 2024.73 2033.60 2046.98 2069.14 2079.36 2086.92 2101.18 2104.84 2109.70 2116.20 2147.69 2151.27 2170.12 2176.57 2203.64 2220.60 2228.15 2243.55 2250.68 2255.33 2258.67 2262.41 2262.93 2279.84 2284.60 2301.26 2330.47 2345.59 2349.75 2350.92 2352.27 2353.43 2357.62 2361.77 2364.05 2366.51 2371.47 2382.55 2389.21 2391.83 2415.01 2445.75 2449.26 2543.90 2562.07 2605.95 2615.75 2618.59 2712.74 2755.20 2839.98 4597.74 4605.06 4613.86 4623.46 4623.64 4629.44 4639.82 4645.66 4673.21 4683.55 4687.36 4703.06 4704.50 4707.02 4709.01 4713.07 4720.99 4728.80 4739.88 4742.01 4750.77 4788.13 4820.07 4825.78 4842.84 4845.85 4858.49 4866.61 4872.88 4875.09 4905.06 4905.90 4928.34 5305.78 5550.82 5558.08 0.660939 0.693570 0.694514 0.587726 -1585.304630 -1585.271998 -1585.271054 -1585.377843 3.581721D-04 MUNgauss RevisionA2.0 retrievium 24-Jan-2020 DUDE CCc1cc(ccc1C)Nc2cc(=O)n(c(=O)[nH]2)CCCCC[NH+]3CCC(=CC3)c4ccc(cc4)F C13674979 RHF 6-31G(d) (6D,10F) C1 491.282230 |X|Y|Z| 59.633859 35.414034 212.805794 76.597969 30 6 7 26 4 |36.858105| |12.414380|36.858105| |7.487898|12.557424|36.858105| |5.708308|7.613330|13.715188|36.858105| |4.170891|5.020033|7.863653|13.742825|36.858105| |3.738028|4.416835|6.810824|7.958950|13.768531|36.858105| |4.133457|4.991757|7.923716|6.942131|7.978281|13.764952|36.858105| |5.585605|7.450023|13.594926|7.929493|6.822729|7.860686|13.705271|36.858105| |5.181033|6.331041|7.481356|5.004639|4.425606|5.019195|7.601403|12.590811|36.858105| |3.391195|3.861070|5.119659|7.822773|13.326995|7.792794|5.143489|4.512849|3.322511|53.358707| |3.072044|3.280463|4.086821|5.608600|7.686575|5.785493|4.172251|3.701862|2.870664|19.181003|36.858105| |2.562994|2.707288|3.203949|4.117157|5.112226|4.236823|3.269016|2.947896|2.392800|10.847021|14.056580|36.858105| |2.316885|2.368115|2.718339|3.318351|3.890605|3.418339|2.778771|2.539236|2.125301|7.029968|7.870662|13.286876|36.858105| |2.037926|2.079547|2.336899|2.779942|3.169122|2.848703|2.381500|2.197515|1.878551|5.486534|5.378257|8.126016|15.836287|73.516695| |2.436034|2.419435|2.770414|3.310964|3.812929|3.427259|2.844073|2.609517|2.196167|6.345875|6.955968|7.899757|13.505890|15.042632|53.358707| |2.865659|2.804475|3.279932|3.944221|4.561938|4.075637|3.364417|3.082306|2.544180|7.178867|7.852169|6.776035|7.761679|9.628695|18.965942|36.858105| |2.892693|2.732918|3.127068|3.577744|3.944040|3.669090|3.195926|2.982935|2.525272|5.701235|5.437910|4.752362|5.353787|7.503534|11.446293|15.893745|73.516695| |3.307093|3.356744|4.153140|5.385707|6.784261|5.573818|4.256821|3.819197|2.987077|11.210794|13.931252|8.102793|6.920389|8.566566|11.184487|13.860565|15.136616|53.358707| |3.853036|3.865246|4.956863|6.352475|7.791287|6.484320|5.048743|4.560315|3.462809|10.355028|9.238640|5.848478|5.081574|6.843911|8.100040|9.481881|14.059004|26.013437|0.500000| |2.134340|2.085872|2.325218|2.672229|2.971382|2.761802|2.387668|2.219269|1.924704|4.676852|4.538486|5.082014|7.746154|12.618797|17.768274|7.866086|12.386932|7.090224|0.119588|36.858105| |2.080807|2.004502|2.173429|2.477584|2.647437|2.417033|2.134886|2.038825|1.789419|4.106106|3.806947|4.218490|5.867552|10.424079|10.462622|5.792250|9.857935|5.785981|0.101842|12.482311|36.858105| |1.814191|1.741667|1.864936|2.075356|2.197886|2.053613|1.850987|1.773209|1.587182|3.323654|2.942905|3.214571|4.167873|7.820521|6.774912|4.113529|7.416083|4.389620|0.080392|7.543557|12.457794|36.858105| |1.727346|1.647679|1.731275|1.910407|1.979838|1.837920|1.678039|1.632776|1.475544|2.962042|2.547948|2.752927|3.380160|6.360150|5.169457|3.313656|5.992881|3.731489|0.069759|4.892126|7.501376|12.428699|36.858105| |1.532773|1.464024|1.530945|1.665638|1.724062|1.624842|1.500059|1.459306|1.335149|2.545367|2.144179|2.297159|2.741283|5.181272|4.106153|2.696567|4.927103|3.114737|0.059130|3.776921|4.901303|7.562525|12.496100|36.858105| |1.450362|1.381538|1.426797|1.541463|1.575415|1.481347|1.379408|1.354909|1.248792|2.307540|1.909064|2.028090|2.349121|4.410580|3.439279|2.311588|4.213217|2.745469|0.052715|2.990739|3.761925|4.916434|7.544535|12.638627|53.358707| |1.520979|1.437922|1.476141|1.592632|1.614330|1.510389|1.410591|1.394430|1.285753|2.353739|1.943214|2.044024|2.348589|4.342194|3.465914|2.365217|4.346109|2.813385|0.054307|2.969654|3.795345|4.733394|7.403603|9.302531|25.695216|0.500000| |1.387114|1.333475|1.374710|1.490846|1.523003|1.425582|1.323638|1.300895|1.197614|2.247520|1.847885|1.988733|2.286993|4.376225|3.240189|2.153128|3.836661|2.603481|0.049758|2.747208|3.403261|4.170437|5.947490|7.574082|17.289382|0.259267|36.858105| |1.326056|1.271104|1.296700|1.396027|1.411196|1.320431|1.235869|1.224359|1.134720|2.063618|1.671981|1.778460|1.997012|3.766774|2.811312|1.907688|3.409959|2.347987|0.045345|2.311578|2.791498|3.223584|4.289119|4.967399|10.477043|0.205704|12.529091|36.858105| |1.250247|1.193613|1.214452|1.295470|1.307512|1.233786|1.163549|1.153950|1.077506|1.892085|1.523226|1.601991|1.784351|3.327834|2.536736|1.746361|3.160268|2.153949|0.041963|2.084427|2.454969|2.849302|3.627045|4.400149|9.106195|0.179501|7.553938|12.566116|36.858105| |1.255279|1.194928|1.220459|1.298530|1.315667|1.248790|1.179292|1.165828|1.090073|1.897423|1.533265|1.605958|1.799146|3.340452|2.593265|1.790451|3.274715|2.188260|0.042706|2.162252|2.532551|3.024524|3.817962|4.982102|10.454281|0.194980|6.815302|7.727231|14.371790|36.858105| |1.333094|1.268523|1.306280|1.396470|1.425522|1.354551|1.272340|1.250312|1.162929|2.065135|1.688938|1.775837|2.024381|3.768942|2.961745|2.025068|3.725314|2.431162|0.047169|2.541108|3.022841|3.827265|4.987535|7.651254|17.319977|0.260351|7.774391|6.463614|7.596969|12.680660|36.858105| |1.168800|1.116990|1.129548|1.198108|1.203138|1.137292|1.078410|1.073852|1.008349|1.731339|1.379039|1.442771|1.583622|2.938932|2.233172|1.551888|2.802832|1.939756|0.038011|1.801612|2.078655|2.338545|2.849161|3.275295|5.992411|0.122454|4.914143|7.411308|12.795186|7.728764|4.906476|36.858105| |1.083480|1.037882|1.050425|1.109270|1.116263|1.061801|1.010076|1.004089|0.946898|1.600414|1.269275|1.325176|1.448201|2.685716|2.039376|1.421378|2.569970|1.783278|0.035042|1.641990|1.858767|2.089056|2.465537|2.852865|4.935998|0.098194|3.907455|5.074638|7.604266|6.312893|4.249128|13.673357|36.858105| |1.023665|0.981667|0.989489|1.040788|1.043860|0.994202|0.949368|0.946355|0.896024|1.490806|1.173953|1.221174|1.321976|2.442570|1.852696|1.298919|2.344888|1.643715|0.032421|1.474655|1.651007|1.822513|2.109017|2.370913|3.935211|0.079525|3.097802|3.880832|5.038383|4.365444|3.258284|7.879672|13.780384|36.858105| |1.033830|0.990706|0.993752|1.044661|1.042545|0.989438|0.945992|0.946867|0.897041|1.487342|1.166742|1.211191|1.303347|2.401011|1.820042|1.280524|2.306493|1.629531|0.032195|1.435440|1.610382|1.751037|2.027576|2.220435|3.659778|0.075628|2.907265|3.706612|4.478173|3.748788|2.901072|6.889322|8.020058|13.817106|36.858105| |1.105106|1.056930|1.057950|1.115626|1.109959|1.047528|0.999483|1.002813|0.947093|1.587237|1.247305|1.295838|1.395635|2.569694|1.948109|1.369627|2.463212|1.741903|0.034368|1.533474|1.740828|1.882679|2.215003|2.390649|4.008456|0.084638|3.237385|4.344316|5.036021|3.958841|3.066533|7.879015|6.873131|7.901789|13.815392|36.858105| |1.180610|1.127297|1.132740|1.200487|1.197568|1.126985|1.070573|1.071725|1.007260|1.720601|1.362776|1.421489|1.546011|2.856441|2.167791|1.514798|2.726797|1.909681|0.037517|1.723761|1.988824|2.180407|2.638381|2.887141|5.081614|0.108246|4.198157|6.262981|7.596269|5.244140|3.849936|13.670922|7.958588|6.873506|8.020044|13.780559|36.858105| |0.976943|0.937593|0.937901|0.982405|0.978501|0.930496|0.892514|0.894851|0.850816|1.391242|1.085159|1.123172|1.200130|2.204701|1.670529|1.180389|2.123963|1.511738|0.029956|1.307583|1.452278|1.562729|1.780380|1.924240|3.085230|0.063786|2.425852|2.965165|3.416949|2.987582|2.420933|4.661881|5.322483|8.185326|14.418874|8.187009|5.323053|97.533100| |17.555644|8.783706|5.474027|4.460752|3.423358|3.103635|3.393889|4.383496|4.333258|3.950693|2.663765|2.285292|2.091151|3.319170|2.974164|2.514545|4.525794|3.848792|0.088848|1.946748|1.924616|1.698317|1.637631|1.462708|1.901881|0.040809|1.340221|1.291660|1.221157|1.222345|1.289084|1.148112|1.064897|1.009954|1.023629|1.094969|1.165104|2.182578|0.500000| |17.561552|8.735835|6.768964|5.047487|3.956221|3.749969|4.324317|5.862749|5.862579|4.340660|2.934513|2.448200|2.240195|3.503669|3.253959|2.841119|5.211323|4.403053|0.106337|2.113671|2.040570|1.793132|1.696561|1.514747|1.943858|0.041528|1.356959|1.294448|1.227687|1.239784|1.320410|1.146720|1.066588|1.007171|1.013892|1.079924|1.153375|2.156020|0.301522|0.500000| |17.551965|8.766320|6.777943|6.034108|4.407030|3.779455|3.949563|4.970135|4.319613|5.015784|3.421641|2.828049|2.568078|3.976464|3.717844|3.263614|5.873244|5.129355|0.122841|2.372407|2.333028|2.005117|1.908904|1.673414|2.148823|0.046205|1.505293|1.434413|1.345654|1.350343|1.439558|1.251599|1.154126|1.086264|1.097259|1.177646|1.264582|2.324072|0.301365|0.302073|0.500000| |8.847593|17.583331|8.868845|5.694483|4.206090|3.949424|4.673071|7.011960|7.193007|4.505001|2.834847|2.392627|2.112434|3.339899|2.925800|2.454162|4.277421|3.917617|0.090587|1.880163|1.805339|1.589943|1.508605|1.353901|1.745496|0.036982|1.239791|1.186060|1.118993|1.120734|1.185413|1.051795|0.981384|0.931297|0.939943|0.999587|1.061599|2.007948|0.213973|0.209019|0.173053|0.500000| |8.869579|17.552835|8.938285|7.269559|4.779545|4.002424|4.232227|5.647678|4.798540|5.287225|3.275939|2.748833|2.385744|3.748137|3.258656|2.721541|4.640484|4.421128|0.100672|2.060878|2.003002|1.735796|1.654896|1.466025|1.891903|0.040224|1.351245|1.291953|1.207222|1.201760|1.271100|1.131769|1.049059|0.993367|1.005675|1.075992|1.146985|2.142375|0.213199|0.172913|0.211936|0.305211|0.500000| |5.639376|7.099701|8.911117|17.704750|8.971052|5.668617|4.986941|5.635338|4.070691|9.867287|5.520610|4.210792|3.398203|5.092739|4.547676|3.891597|6.221506|7.024757|0.159346|2.699467|2.566138|2.132723|1.986884|1.718455|2.176857|0.046104|1.554963|1.460674|1.347102|1.342472|1.439150|1.246257|1.148422|1.077508|1.085458|1.164618|1.254807|2.294621|0.127220|0.130384|0.176653|0.145239|0.219816|0.500000| |3.104550|3.535640|4.919924|5.652792|8.918810|17.720662|8.894541|5.609556|4.098850|9.714550|5.783142|4.417623|3.578702|5.315762|4.828928|4.107423|6.481726|7.394958|0.163465|2.861406|2.444353|2.087069|1.845977|1.638905|2.019995|0.041762|1.428926|1.316025|1.230088|1.248299|1.359208|1.131445|1.058980|0.990060|0.981978|1.036782|1.116297|2.076431|0.073605|0.087144|0.087790|0.089980|0.091056|0.124555|0.500000| |3.516068|4.065702|5.639690|4.987931|5.673738|8.967949|17.718885|8.931928|7.098820|5.679316|3.563969|2.907263|2.533003|3.918272|3.543228|3.028092|5.197698|4.984091|0.117169|2.233211|1.988856|1.750002|1.584682|1.430625|1.790506|0.037241|1.260500|1.177294|1.113934|1.132457|1.221544|1.034085|0.972618|0.915209|0.909990|0.957908|1.023909|1.934600|0.082772|0.104600|0.092643|0.110612|0.097200|0.108103|0.215772|0.500000| |6.065317|6.523700|6.684029|4.571803|3.941871|4.261643|5.840651|8.798354|17.570583|4.154003|2.714395|2.276614|2.055600|3.237276|2.931202|2.510812|4.518747|3.936301|0.093716|1.906363|1.789974|1.593241|1.488881|1.348258|1.721569|0.036320|1.207778|1.147736|1.093056|1.107186|1.179917|1.023642|0.960607|0.909317|0.911170|0.962718|1.023661|1.944534|0.140449|0.212468|0.134020|0.205923|0.133007|0.107505|0.098771|0.151774|0.500000| |4.788427|6.228138|6.572316|4.550918|3.963279|4.321879|5.964148|8.826221|17.548540|4.178334|2.631402|2.233609|1.979308|3.142036|2.744322|2.291707|4.008306|3.635533|0.083919|1.776175|1.665570|1.484328|1.390231|1.262064|1.615833|0.033937|1.144847|1.089404|1.034169|1.042543|1.106801|0.971671|0.913351|0.866827|0.869714|0.918095|0.973410|1.860518|0.117174|0.141335|0.109470|0.222679|0.136901|0.106718|0.100358|0.156250|0.302482|0.500000| |4.086838|4.676148|5.549046|4.185563|3.988560|4.799549|7.366741|8.863138|17.595199|4.194846|2.708404|2.283685|2.046784|3.231583|2.886514|2.442321|4.331508|3.847060|0.090094|1.874109|1.727206|1.543785|1.428378|1.300374|1.651144|0.034568|1.161489|1.098345|1.046353|1.061920|1.134659|0.979076|0.922436|0.872860|0.871522|0.917198|0.974786|1.860815|0.098031|0.128934|0.099116|0.142191|0.105228|0.095971|0.114316|0.229288|0.302413|0.302397|0.500000| |3.041184|3.521660|4.483310|6.385714|9.126691|6.393780|4.508320|4.005154|3.050886|26.040739|9.542057|7.463750|4.792014|6.984222|5.567173|4.320535|6.239262|8.107213|0.151589|3.121826|2.779616|2.286647|2.057972|1.782229|2.212396|0.045870|1.599671|1.473040|1.347701|1.345424|1.456973|1.237878|1.146207|1.070350|1.069141|1.140034|1.232395|2.254642|0.073962|0.078954|0.090070|0.085904|0.100933|0.172707|0.171593|0.104942|0.077240|0.080379|0.079102|0.500000| |2.383239|2.562534|2.996590|3.805714|4.635740|3.889112|3.044713|2.760958|2.265052|9.658469|8.966701|17.792353|8.850538|12.885921|7.676047|4.907516|6.667895|7.772210|0.126949|4.137920|3.599248|2.864470|2.514797|2.133422|2.596949|0.053187|1.899591|1.710080|1.537394|1.531144|1.678110|1.393500|1.283136|1.187083|1.179763|1.260948|1.377274|2.468861|0.059707|0.062826|0.071972|0.063651|0.073308|0.109205|0.113166|0.075817|0.059416|0.059638|0.060108|0.218264|0.500000| |2.140630|2.069298|2.308571|2.602675|2.885304|2.750073|2.413964|2.236590|1.956122|4.373918|4.114595|4.297543|5.778762|9.224025|12.589656|7.644858|14.316797|6.774592|0.119711|17.663319|8.831531|6.815279|4.509203|3.650746|3.932401|0.079938|2.589357|2.199103|2.023185|2.128699|2.514977|1.752963|1.608394|1.445799|1.402361|1.490275|1.669797|2.878884|0.054118|0.059734|0.065831|0.052025|0.056077|0.071880|0.079307|0.063348|0.054129|0.049756|0.053284|0.080265|0.098585|0.500000| |1.939801|1.920344|2.140762|2.447609|2.745740|2.588434|2.236832|2.062648|1.800204|4.355387|4.126484|4.859581|7.496297|14.341988|12.632274|5.904392|9.210507|6.010457|0.102603|17.665165|8.855601|6.925850|4.569607|3.700794|3.970165|0.078592|2.732162|2.277361|2.050970|2.126002|2.498880|1.774117|1.627320|1.460994|1.415867|1.504629|1.687880|2.904153|0.049427|0.053348|0.059105|0.048536|0.052879|0.068393|0.075748|0.058695|0.049190|0.046449|0.049002|0.082886|0.114785|0.301112|0.500000| |2.048821|1.996633|2.156950|2.486964|2.649637|2.380257|2.088659|2.002195|1.750944|4.204432|3.889256|4.526963|6.402976|12.327242|9.658127|5.183612|8.272999|5.574189|0.096994|8.918971|17.565156|8.850169|6.908606|4.568642|4.997576|0.102581|3.506350|2.880214|2.468669|2.488293|2.907872|2.100008|1.866568|1.662309|1.631387|1.774181|2.028121|3.311011|0.052860|0.055147|0.063765|0.049903|0.056120|0.072638|0.066693|0.053765|0.048408|0.045626|0.046728|0.080453|0.109700|0.174280|0.212967|0.500000| |2.272211|2.149052|2.309943|2.624953|2.748294|2.484696|2.215303|2.144816|1.881999|4.177354|3.831171|4.015794|5.169833|8.554770|9.485923|6.136170|11.228338|6.078632|0.109642|8.884522|17.538301|8.835603|6.829464|4.538760|4.973910|0.106662|3.244443|2.743052|2.435525|2.510510|2.960101|2.075333|1.846967|1.646722|1.616464|1.756612|2.004858|3.283715|0.058306|0.061846|0.071821|0.053355|0.059515|0.076068|0.068597|0.056933|0.052777|0.048467|0.050122|0.077331|0.094426|0.213898|0.174100|0.301544|0.500000| |1.807705|1.721984|1.844560|2.028320|2.146730|2.034539|1.851157|1.770976|1.595686|3.185545|2.793852|2.962165|3.726931|6.730708|6.269276|4.037125|7.691650|4.271074|0.079713|6.883128|8.837041|17.516947|8.840790|6.952917|6.261236|0.124131|3.728686|2.970164|2.728887|2.974736|3.812344|2.254536|2.038131|1.781331|1.702346|1.815202|2.088829|3.427971|0.046959|0.050142|0.055321|0.043805|0.047245|0.057289|0.057506|0.048935|0.044689|0.041255|0.043322|0.060430|0.073000|0.203584|0.171164|0.173514|0.212337|0.500000| |1.690345|1.642141|1.766452|1.965668|2.103392|1.981299|1.779608|1.691308|1.516067|3.204960|2.824390|3.159958|4.135430|8.199962|6.355303|3.743527|6.541574|4.098565|0.074662|6.973703|8.859390|17.519116|8.858463|6.970952|6.247742|0.116788|4.102814|3.123064|2.758625|2.920871|3.678204|2.274439|2.055365|1.793980|1.712978|1.826622|2.104604|3.446717|0.043993|0.046418|0.051414|0.041875|0.045523|0.055840|0.056548|0.047000|0.042009|0.039520|0.041155|0.062014|0.079597|0.170474|0.210732|0.211563|0.173573|0.302943|0.500000| |1.710975|1.645452|1.725534|1.918045|1.984633|1.824964|1.658003|1.616185|1.455637|3.005035|2.578973|2.841910|3.486475|6.753071|5.082335|3.196189|5.590572|3.682512|0.068297|4.586942|6.938592|8.876400|17.562076|8.810863|9.294277|0.185113|6.500473|4.606407|3.654693|3.654977|4.493876|2.894433|2.476298|2.127200|2.064808|2.278735|2.723204|4.077719|0.045164|0.046287|0.052518|0.041813|0.046299|0.055911|0.050849|0.043326|0.040642|0.038291|0.039012|0.058571|0.073135|0.112149|0.122142|0.210164|0.170786|0.173906|0.212346|0.500000| |1.827991|1.721140|1.793028|1.969845|2.014481|1.861062|1.711011|1.680944|1.522215|2.978671|2.545612|2.684716|3.216713|5.835586|5.012681|3.357033|6.229941|3.790106|0.071820|4.537843|6.868628|8.841549|17.509108|8.874509|9.434233|0.221933|5.287601|4.172613|3.603786|3.784066|4.781815|2.864226|2.454682|2.112181|2.051307|2.262082|2.697105|4.055339|0.048268|0.049849|0.056530|0.043627|0.047981|0.057172|0.051404|0.044723|0.042957|0.039775|0.040757|0.057046|0.067678|0.119696|0.112347|0.171348|0.205017|0.212153|0.173676|0.302477|0.500000| |1.528175|1.451574|1.518644|1.639895|1.697584|1.613838|1.498874|1.457012|1.339325|2.479450|2.082135|2.197005|2.599965|4.816823|3.977920|2.670394|4.996782|3.067671|0.058791|3.675559|4.553425|6.909526|8.844932|17.619130|12.412016|0.214044|5.618361|4.176722|4.003683|4.784619|7.567549|3.063015|2.732745|2.286377|2.127269|2.261040|2.689834|4.174425|0.040479|0.042255|0.046243|0.037368|0.040116|0.046668|0.045251|0.039881|0.037689|0.035051|0.036357|0.047962|0.056337|0.103132|0.098874|0.112493|0.120600|0.208985|0.172369|0.173197|0.212636|0.500000| |1.452279|1.399841|1.470625|1.602054|1.671017|1.582247|1.456240|1.408232|1.288341|2.480706|2.086910|2.265143|2.714151|5.250625|3.977157|2.567512|4.614121|2.989815|0.056467|3.661553|4.518170|6.811159|8.755352|17.614138|12.401811|0.182513|7.287417|4.667843|4.126246|4.601272|6.709392|3.129761|2.788418|2.322967|2.156215|2.291772|2.735485|4.222378|0.038462|0.039868|0.043791|0.036078|0.038968|0.045759|0.044642|0.038711|0.035962|0.033899|0.034969|0.048597|0.058998|0.097202|0.104191|0.120271|0.111223|0.169852|0.206040|0.209515|0.172895|0.301833|0.500000| |1.310735|1.267107|1.311561|1.420265|1.459850|1.375296|1.276503|1.248436|1.151206|2.156076|1.769211|1.913558|2.201484|4.255867|3.094028|2.044072|3.627496|2.478881|0.047323|2.632454|3.158344|3.905003|5.116456|6.832116|12.469183|0.182553|17.617594|8.794988|6.640697|6.364743|7.328118|4.589193|3.885682|3.074649|2.815673|3.034360|3.807032|5.324172|0.035135|0.035711|0.039304|0.032839|0.035605|0.040936|0.038505|0.033907|0.032155|0.030593|0.031130|0.042798|0.051057|0.069142|0.074297|0.090067|0.081936|0.098095|0.112054|0.151822|0.122174|0.146647|0.214451|0.500000| |1.461583|1.410088|1.457654|1.594486|1.631652|1.514949|1.396831|1.371612|1.254271|2.432607|2.014258|2.193500|2.546995|4.934144|3.568739|2.334902|4.104130|2.818442|0.053392|3.019659|3.849491|4.610907|6.779574|7.208823|12.320452|0.217514|17.665655|8.804170|5.513476|4.971559|5.644407|4.042485|3.282642|2.714791|2.613935|2.936065|3.695529|5.007199|0.039120|0.039521|0.044250|0.036263|0.039851|0.046451|0.042155|0.036778|0.035051|0.033308|0.033692|0.048168|0.058253|0.077180|0.083410|0.114478|0.100525|0.108865|0.125876|0.239547|0.161414|0.144086|0.193693|0.301265|0.500000| |1.267005|1.222237|1.246513|1.342675|1.358394|1.271138|1.189025|1.177233|1.091670|1.991279|1.604737|1.715930|1.913813|3.637408|2.652223|1.793483|3.175460|2.229487|0.043006|2.155117|2.556867|2.890722|3.677226|4.119248|7.642506|0.146899|8.977522|17.578056|8.894054|5.866471|4.971090|6.977198|5.028436|3.968817|3.839253|4.495031|6.248971|6.933215|0.034330|0.034278|0.037929|0.031755|0.034614|0.039055|0.035239|0.031485|0.030585|0.029210|0.029361|0.039738|0.046265|0.056608|0.059611|0.074375|0.069124|0.073584|0.079464|0.112406|0.097700|0.097361|0.113052|0.218723|0.208277|0.500000| |1.394748|1.331063|1.350466|1.455002|1.460299|1.357891|1.272144|1.267259|1.173357|2.132406|1.724809|1.825158|2.037266|3.807091|2.872708|1.964625|3.514963|2.426300|0.046968|2.333678|2.852148|3.198249|4.294258|4.591965|9.113017|0.207351|8.865834|17.525177|8.850665|6.148316|5.378253|6.461887|4.435519|3.585448|3.598399|4.422502|6.408631|6.562324|0.037841|0.037675|0.042083|0.034408|0.037695|0.042536|0.037387|0.033532|0.033047|0.031308|0.031423|0.042201|0.048652|0.061495|0.062958|0.082273|0.079496|0.081559|0.083947|0.129762|0.121894|0.108700|0.115100|0.173603|0.219305|0.304893|0.500000| |1.199271|1.139980|1.161845|1.228791|1.243170|1.186007|1.125836|1.114175|1.047281|1.781320|1.431173|1.489242|1.655265|3.053717|2.389524|1.665512|3.061483|2.045970|0.040160|1.978265|2.271765|2.675382|3.239150|4.095363|7.569383|0.146871|4.933750|5.511913|9.116034|17.728975|8.742910|7.085593|6.793078|4.701352|3.869284|3.892749|4.861913|6.974484|0.032512|0.033011|0.035690|0.029805|0.031769|0.035168|0.032930|0.030130|0.029594|0.027838|0.028399|0.035083|0.039474|0.054650|0.054029|0.061555|0.062895|0.074487|0.071944|0.085340|0.090140|0.114698|0.106614|0.133437|0.107918|0.127437|0.131253|0.500000| |1.365695|1.291277|1.328766|1.414099|1.441092|1.374193|1.296077|1.275094|1.189134|2.072974|1.695017|1.763582|2.005041|3.682138|2.979753|2.065739|3.859519|2.467687|0.048175|2.562801|3.024520|3.822066|4.811646|7.002094|12.418721|0.231263|5.664196|4.976785|5.803722|8.893110|17.607747|4.194655|3.740482|2.975637|2.677843|2.813512|3.433734|5.110865|0.036668|0.037751|0.040987|0.033521|0.035780|0.040346|0.038248|0.034615|0.033633|0.031345|0.032263|0.040403|0.045983|0.071832|0.069098|0.078893|0.083822|0.110555|0.099380|0.115022|0.134498|0.227204|0.161247|0.146226|0.126942|0.110399|0.125100|0.216171|0.500000| |1.280731|1.225941|1.268986|1.357284|1.394969|1.332335|1.249124|1.220666|1.135295|2.025949|1.658086|1.753665|2.006557|3.769824|2.919289|1.978792|3.620310|2.375771|0.045952|2.522895|2.935039|3.766859|4.632973|7.276894|12.424604|0.182670|6.860852|5.414363|6.070516|8.810976|17.577008|4.279709|3.937894|3.067218|2.692439|2.778493|3.379350|5.126213|0.034318|0.035302|0.038272|0.031892|0.034078|0.038690|0.037346|0.033426|0.031889|0.030017|0.030876|0.039818|0.046182|0.069442|0.070234|0.078417|0.078024|0.104617|0.104935|0.116909|0.117235|0.202542|0.206770|0.212434|0.143859|0.125659|0.123192|0.198624|0.302420|0.500000| |1.067321|1.023673|1.040157|1.098272|1.109962|1.059788|1.007545|0.997997|0.941200|1.591879|1.265388|1.322804|1.451411|2.697421|2.049320|1.424705|2.580297|1.780737|0.034957|1.662023|1.870473|2.128981|2.490631|2.954834|5.051388|0.097491|3.908598|4.721574|7.022458|6.776421|4.591991|8.891579|17.731762|8.980682|5.694254|4.953581|5.649556|9.645395|0.029061|0.029269|0.031547|0.026903|0.028665|0.031472|0.029453|0.027012|0.026497|0.025181|0.025534|0.031650|0.035535|0.045410|0.045989|0.051842|0.051283|0.058102|0.058667|0.068707|0.068052|0.079532|0.081421|0.112241|0.089953|0.128086|0.111276|0.218087|0.111404|0.123031|0.500000| |0.971931|0.933574|0.941669|0.987979|0.992225|0.948553|0.907502|0.903619|0.857745|1.414037|1.110718|1.153935|1.245945|2.300511|1.744726|1.225278|2.212737|1.554033|0.030699|1.386558|1.536852|1.693768|1.930069|2.169109|3.511915|0.070383|2.727568|3.263601|4.094636|3.763004|2.928108|5.607390|8.865530|17.748404|8.960001|5.644789|4.955038|16.726629|0.026640|0.026616|0.028559|0.024664|0.026202|0.028332|0.026278|0.024363|0.024167|0.023064|0.023258|0.028228|0.031201|0.037890|0.038281|0.042857|0.042479|0.046235|0.046556|0.053818|0.053468|0.058664|0.059557|0.076491|0.067042|0.092764|0.083720|0.115013|0.075309|0.078350|0.214805|0.500000| 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