Version2.0 2020-07-19T13:52:52Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 06-Jun-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCC[C@H](CC)C(=O)N([C@@H](c1ccc(cc1)C(F)(F)F)C(=O)NC(C)(C)CC(C)(C)C)C(C)(C)C C36582535 RHF 6-31G(d) (6D,7F) CCCC[C@H](CC)C(=O)N([C@@H](c1ccc(cc1)C(F)(F)F)C(=O)NC(C)(C)CC(C)(C)C)C(C)(C)C C01[X(C29H47F3N2O2)] 243 C1 634 CCCC[C@@H](C(=O)N(C(C)(C)C)[C@H](C(=O)NC(CC(C)(C)C)(C)C)c1ccc(cc1)C(F)(F)F)CC CCCC[C@@H](C(=O)N(C(C)(C)C)[C@H](C(=O)NC(CC(C)(C)C)(C)C)c1ccc(cc1)C(F)(F)F)CC CCCC[C@H](CC)C(=O)N([C@H](C(=O)NC(C)(C)CC(C)(C)C)c1ccc(cc1)C(F)(F)F)C(C)(C)C InChIKey=DCUYOVVICUTSRT-REWPJTCUSA-N InChI=1S/C29H47F3N2O2/c1-11-13-14-20(12-2)25(36)34(27(6,7)8)23(21-15-17-22(18-16-21)29(30,31)32)24(35)33-28(9,10)19-26(3,4)5/h15-18,20,23H,11-14,19H2,1-10H3,(H,33,35)/t20-,23-/m0/s1 InChI=1/C29H47F3N2O2/c1-11-13-14-20(12-2)25(36)34(27(6,7)8)23(21-15-17-22(18-16-21)29(30,31)32)24(35)33-28(9,10)19-26(3,4)5/h15-18,20,23H,11-14,19H2,1-10H3,(H,33,35)/t20-,23-/m0/s1/f/h33H CCCC[C@H](CC)C(=O)N([C@@H](c1ccc(cc1)C(F)(F)F)C(=O)NC(C)(C)CC(C)(C)C)C(C)(C)C C01[X(C29H47F3N2O2)] 243 C01 634 CCCC[C@@H](C(=O)N(C(C)(C)C)[C@H](C(=O)NC(CC(C)(C)C)(C)C)c1ccc(cc1)C(F)(F)F)CC CCCC[C@@H]([C]([O])N(C(C)(C)C)[C@@H]([C]1[CH][CH][C]([CH][CH]1)C(F)(F)F)[C]([NH]C(CC(C)(C)C)(C)C)=O)CC CCCC[C@H](CC)[C]([O])N([C@@H]([C]1[CH][CH][C]([CH][CH]1)C(F)(F)F)C(=O)NC(C)(C)CC(C)(C)C)C(C)(C)C InChIKey=DCUYOVVICUTSRT-REWPJTCUSA-N InChI=1S/C29H47F3N2O2/c1-11-13-14-20(12-2)25(36)34(27(6,7)8)23(21-15-17-22(18-16-21)29(30,31)32)24(35)33-28(9,10)19-26(3,4)5/h15-18,20,23H,11-14,19H2,1-10H3,(H,33,35)/t20-,23-/m0/s1 InChI=1/C29H47F3N2O2/c1-11-13-14-20(12-2)25(36)34(27(6,7)8)23(21-15-17-22(18-16-21)29(30,31)32)24(35)33-28(9,10)19-26(3,4)5/h15-18,20,23H,11-14,19H2,1-10H3,(H,33,35)/t20-,23-/m0/s1/f/h33H 4408.9630411859 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1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 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 16512.2937 25652.6750 31842.2130 0.99646 0.08344 -0.01040 -0.08313 0.99615 0.02770 0.01267 -0.02674 0.99956 1 0.00525 0.00338 0.00272 0.10930 0.07035 0.05668 10.52 17.40 26.10 36.59 44.97 56.60 67.53 74.60 82.90 92.97 100.42 114.22 118.08 134.89 151.12 165.34 170.53 202.92 212.15 236.43 237.50 262.27 277.99 289.92 307.49 312.50 321.67 359.72 365.47 370.18 375.11 382.58 395.19 401.61 411.83 418.59 421.36 439.83 461.95 464.06 472.74 480.56 483.90 497.90 515.17 544.00 567.92 586.35 591.08 611.96 630.26 644.89 649.75 656.41 661.74 668.24 677.01 685.77 705.48 713.29 753.17 778.25 797.21 807.31 824.75 864.98 903.69 911.50 947.76 961.23 1013.67 1033.66 1069.01 1103.11 1135.69 1138.98 1167.48 1193.07 1201.41 1216.80 1232.84 1250.71 1292.14 1318.54 1331.44 1337.96 1361.36 1378.72 1381.99 1398.06 1406.72 1439.42 1451.63 1462.33 1469.28 1470.25 1481.27 1510.54 1520.60 1523.98 1528.44 1543.27 1582.27 1585.50 1588.41 1603.45 1609.47 1619.62 1624.75 1636.93 1640.99 1658.76 1666.67 1669.70 1681.59 1689.16 1707.88 1734.35 1745.35 1777.35 1786.21 1827.35 1831.83 1851.12 1855.13 1901.78 1908.97 1920.83 1940.16 1946.65 1953.65 1957.69 1962.78 1963.69 1985.29 1987.96 2007.77 2012.62 2045.04 2046.62 2055.43 2068.71 2085.40 2098.65 2121.60 2132.79 2137.68 2139.45 2154.51 2190.24 2207.72 2214.68 2237.16 2238.84 2241.76 2245.47 2250.83 2254.11 2255.15 2265.49 2270.12 2272.19 2287.73 2292.58 2307.17 2333.75 2336.97 2345.26 2350.41 2351.41 2352.15 2352.40 2352.91 2355.79 2361.33 2365.65 2366.30 2367.68 2369.18 2373.75 2376.23 2379.61 2383.45 2386.31 2387.53 2389.64 2398.55 2400.67 2408.96 2427.89 2447.69 2472.11 2552.18 2632.51 2682.96 2765.22 4569.44 4578.05 4589.44 4596.70 4599.58 4605.84 4606.60 4617.23 4619.16 4621.30 4624.50 4635.14 4639.26 4641.42 4641.75 4650.28 4653.22 4659.14 4676.98 4681.79 4683.60 4689.07 4689.91 4692.48 4698.36 4706.04 4709.51 4722.03 4731.28 4735.24 4738.76 4745.43 4746.26 4764.49 4765.66 4772.57 4775.43 4793.20 4797.25 4799.54 4799.84 4835.85 4867.57 4876.72 4896.37 4970.97 5599.29 0.780347 0.818741 0.819685 0.706261 -1681.738169 -1681.699775 -1681.698831 -1681.812255 3.804260D-04 MUNgauss RevisionA2.0 retrievium 19-Jul-2020 DUDE CCCC[C@H](CC)C(=O)N([C@@H](c1ccc(cc1)C(F)(F)F)C(=O)NC(C)(C)CC(C)(C)C)C(C)(C)C C36582535 RHF 6-31G(d) (6D,10F) C1 512.358964 |X|Y|Z| 107.802932 79.466061 56.410545 78.473710 6 6 6 |36.858105| |12.465796|36.858105| |7.468867|12.446501|36.858105| |4.867097|7.485033|12.441310|36.858105| |3.721825|4.850175|7.412887|12.368545|36.858105| |3.702278|4.632355|6.994436|9.040858|17.748059|0.500000| |3.440189|4.156578|6.072374|7.352653|12.295939|0.248291|36.858105| |3.226795|3.871928|5.095876|6.087652|7.296979|0.151618|12.457790|36.858105| |2.983003|3.782401|4.895878|7.617822|12.448587|0.245909|7.549125|6.039553|36.858105| |2.907450|3.737760|4.521984|7.064121|8.132619|0.167181|5.928113|5.740664|15.734799|73.516695| |2.520962|3.045078|3.767703|5.059946|7.380119|0.191380|5.676452|4.608040|13.857886|15.291474|53.358707| |2.186224|2.602008|3.048190|3.948147|4.955668|0.126251|4.223436|3.866370|8.020863|13.356636|17.598725|36.858105| |1.990038|2.314792|2.694056|3.332647|4.167155|0.110570|3.763693|3.433904|5.905353|9.520697|12.648602|17.698305|0.500000| |2.093150|2.489331|2.800195|3.564503|4.063517|0.106855|3.360259|3.124449|5.901959|10.898772|10.228912|12.457679|0.253745|36.858105| |1.819690|2.111116|2.328499|2.829525|3.161916|0.085005|2.748479|2.595157|4.174043|7.605684|7.030716|7.618900|0.211664|13.693525|36.858105| |1.714691|1.972232|2.122095|2.522804|2.708984|0.073641|2.356896|2.240955|3.388918|6.258897|5.333045|5.018195|0.136730|7.861851|13.761365|36.858105| |1.813359|2.101457|2.221398|2.644238|2.740597|0.074601|2.329952|2.213180|3.368540|6.337979|5.032058|4.404727|0.113081|6.808962|7.963131|13.772675|36.858105| |2.083845|2.474412|2.619338|3.214416|3.265980|0.088054|2.666614|2.512864|4.101456|7.904842|5.889056|4.954971|0.118298|7.896367|6.922947|7.960324|13.742828|36.858105| |2.278174|2.762254|3.035381|3.924969|4.158981|0.109513|3.274059|3.042859|5.771478|11.294514|8.445931|7.370936|0.157224|13.676538|7.983459|6.874547|7.922186|13.770575|36.858105| |1.663285|1.895615|1.961525|2.265875|2.298319|0.063115|1.988622|1.901779|2.696649|5.040125|3.923206|3.269800|0.086111|4.430987|5.045971|7.597312|12.682031|7.623251|5.044895|36.858105| |1.643711|1.855504|1.916869|2.178724|2.212289|0.061933|1.910453|1.800300|2.536332|4.613662|3.710099|2.974397|0.079463|3.870119|4.287446|5.867600|8.127466|6.108358|4.372190|14.365231|97.533100| |1.696154|1.936424|1.965220|2.259140|2.228584|0.060674|1.927634|1.865224|2.573698|4.908963|3.610811|2.947468|0.076127|3.845257|4.067500|5.369720|8.132041|6.813311|4.590113|14.385854|20.164942|97.533100| |1.501843|1.692513|1.753183|2.003550|2.049563|0.056125|1.814791|1.753167|2.388242|4.454432|3.497278|2.955455|0.079994|3.835262|4.620253|6.929213|8.121933|5.299815|4.025751|14.393580|20.143750|20.091394|97.533100| |2.124642|2.518975|2.921821|3.750345|4.540160|0.109262|4.253867|4.323591|6.783554|13.361680|10.405285|12.287701|0.259549|7.239537|5.580809|4.076631|3.639786|4.000368|5.378940|2.840564|5.721901|5.956239|5.950338|36.858105| |2.117714|2.477860|2.922185|3.653929|4.576667|0.109473|4.740667|4.975584|6.219282|11.188801|9.180424|8.072587|0.206878|5.134306|4.269197|3.295976|2.977681|3.227153|4.117808|2.417287|4.972550|5.107834|5.122902|15.827189|73.516695| |1.993081|2.353366|2.629848|3.311840|3.695736|0.089913|3.446991|3.648527|5.083779|11.008932|7.163634|7.695712|0.177187|6.620136|5.572065|4.285392|3.849691|4.151571|5.278437|3.015822|5.880872|6.423270|6.403507|14.157518|14.982084|53.358707| |1.883953|2.194279|2.406832|2.933998|3.158559|0.076776|3.094728|3.470529|3.970763|8.490397|5.299258|4.897746|0.122209|4.394348|3.984508|3.348743|3.094490|3.275645|3.860208|2.568475|5.046759|5.616454|5.574512|7.605568|11.692559|17.540449|36.858105| |2.090779|2.458346|2.698461|3.305020|3.462296|0.081551|3.491835|4.230525|4.171584|9.235647|5.124765|4.275927|0.104140|3.752320|3.264663|2.813112|2.707816|2.967034|3.509285|2.292244|4.590133|5.114983|4.895553|6.250202|10.831277|10.516417|12.377156|36.858105| |1.703316|1.941887|2.140022|2.527870|2.781095|0.069073|2.838744|3.164445|3.362770|6.657715|4.675617|4.214832|0.114301|3.663021|3.508550|2.959290|2.663395|2.728036|3.139328|2.260494|4.522345|4.874928|5.012358|6.187848|11.201815|10.502861|12.427881|7.616902|36.858105| |1.759265|2.035142|2.165693|2.590404|2.675355|0.066327|2.562596|2.820787|3.255738|6.936377|4.332030|3.908693|0.098671|3.917856|3.731632|3.357412|3.177751|3.293623|3.642704|2.707812|5.201835|6.060889|5.969329|5.079284|7.738810|10.583996|12.265668|7.690911|7.371253|36.858105| |1.564154|1.783069|1.883903|2.208343|2.290883|0.058261|2.186488|2.335671|2.748157|5.597487|3.798242|3.450225|0.091000|3.627020|3.751939|3.527049|3.248750|3.170660|3.330557|2.837977|5.374902|6.282138|6.521311|4.127050|6.349874|7.829748|6.908655|4.792170|5.843135|12.241499|36.858105| |1.550964|1.769203|1.885363|2.220770|2.346096|0.060523|2.201428|2.279286|2.872075|5.718295|4.142142|3.937574|0.106448|4.370983|4.935026|4.655833|4.000634|3.688834|3.822635|3.390771|6.277488|7.185433|7.976230|4.438456|6.557776|8.215011|5.826444|4.051786|5.150123|7.364655|12.413926|36.858105| |1.516933|1.722145|1.782437|2.064033|2.083536|0.053351|1.968319|2.094066|2.441136|4.973590|3.313130|2.895354|0.075654|3.147452|3.241250|3.234932|3.139052|3.059546|3.064435|2.871180|5.388945|6.613818|6.649243|3.276388|5.107815|5.793646|4.801353|3.894108|4.057842|7.708666|12.359977|7.652181|36.858105| |1.425458|1.601229|1.693048|1.945562|2.032703|0.052088|1.990110|2.137849|2.376056|4.699575|3.304862|2.918928|0.079582|2.948120|3.081468|2.894602|2.640916|2.556879|2.683187|2.368274|4.613436|5.207305|5.523403|3.483980|5.700036|6.049292|5.530522|4.121982|5.817984|7.405184|12.376746|7.598484|7.681450|36.858105| |2.345386|2.726256|3.363833|4.102042|5.830700|0.176711|5.008865|3.895408|7.241820|9.228543|17.225528|7.610399|0.217672|5.476716|4.422379|3.486638|3.229982|3.576482|4.599910|2.612448|5.743599|5.334526|5.323808|5.265813|9.201331|5.352393|3.114153|2.992523|2.922163|2.616694|2.381756|2.617525|2.097738|2.138371|36.858105| |2.611847|2.994611|3.811687|4.379686|6.267081|0.228685|5.328203|3.830923|6.077533|7.826426|10.088116|4.907269|0.133707|4.042105|3.378896|2.858499|2.762711|3.089207|3.772681|2.323626|5.227166|4.835954|4.715892|3.868577|6.942971|4.214860|2.585877|2.578713|2.430638|2.230864|2.033444|2.186898|1.834726|1.844655|12.401966|36.858105| |2.088120|2.391033|2.813390|3.327449|4.201635|0.127510|3.600258|2.993537|5.103138|7.377284|10.472449|6.600677|0.206863|5.826419|5.142987|4.089541|3.687133|3.915386|4.798459|2.958788|6.654391|5.832399|6.011868|4.420918|7.275794|4.859678|2.825874|2.624032|2.663345|2.470309|2.331823|2.646845|2.074473|2.088511|12.344954|7.810257|36.858105| |2.106366|2.389492|2.909898|3.406721|4.662726|0.133320|4.703329|3.852108|5.412648|7.593735|10.397509|6.203121|0.202273|4.376082|3.832643|3.043866|2.747555|2.924999|3.599014|2.277344|4.968216|4.672558|4.780902|5.142778|10.128481|5.170304|3.124038|2.983041|3.103814|2.563974|2.345404|2.554466|2.030794|2.166373|12.386577|7.675437|7.539151|36.858105| |17.548115|8.772220|5.452289|4.043403|3.157604|0.086782|2.919570|2.806381|2.644809|4.671427|3.087240|2.008493|0.050939|1.952555|1.714555|1.633808|1.739003|1.989518|2.138229|1.613733|3.590615|3.736764|3.283790|1.959530|3.448316|2.539584|1.777353|1.965470|1.605785|1.683528|1.505137|1.487079|1.474813|1.372734|2.107441|2.307945|1.909507|1.901730|0.500000| |17.533369|8.772510|6.768604|4.492219|3.621746|0.104538|3.324319|3.002878|2.891088|4.890649|3.395744|2.143741|0.054661|2.055333|1.795585|1.694656|1.789045|2.045761|2.228193|1.645324|3.695625|3.749786|3.340379|2.049502|3.633299|2.596337|1.787026|1.953097|1.628658|1.666195|1.495659|1.497152|1.446875|1.366614|2.375916|2.711923|2.129633|2.122433|0.301697|0.500000| |17.535556|8.773098|6.764416|4.498839|3.589574|0.097721|3.516430|3.379673|2.863200|4.956575|3.302619|2.111494|0.053720|1.992194|1.740247|1.630313|1.705420|1.940289|2.131522|1.562031|3.458722|3.569619|3.200319|2.084913|3.750016|2.655574|1.865531|2.090728|1.702078|1.730463|1.533742|1.511488|1.480668|1.408931|2.269511|2.517656|2.000357|2.080374|0.301719|0.301685|0.500000| |8.861440|17.512276|8.853933|6.876565|4.564086|0.124561|3.713475|3.408045|3.741150|6.614332|4.163861|2.632309|0.064801|2.588348|2.192221|2.072425|2.245985|2.680314|2.950222|2.035466|4.510256|4.711154|4.041976|2.494311|4.276140|3.197770|2.163629|2.379335|1.901547|2.032815|1.796548|1.797836|1.748633|1.600573|2.732219|2.989191|2.452058|2.346987|0.212862|0.210561|0.172945|0.500000| |8.860641|17.514375|8.859540|6.907545|4.504719|0.113643|3.988612|3.989570|3.683906|6.781747|3.998798|2.574638|0.063283|2.466978|2.094829|1.958971|2.088041|2.456923|2.738009|1.884780|4.101274|4.369893|3.802468|2.559306|4.470285|3.310282|2.306643|2.640129|2.020815|2.152111|1.863246|1.822775|1.808737|1.669316|2.576200|2.738082|2.262483|2.292052|0.212654|0.172927|0.210737|0.304073|0.500000| |6.915860|8.889797|17.525560|8.805159|6.661839|0.168850|6.690521|5.865966|4.464540|7.362331|4.767203|2.871681|0.071489|2.582726|2.176305|1.973568|2.036298|2.356622|2.723036|1.804342|3.953021|4.055501|3.673993|2.835713|5.186640|3.463587|2.375233|2.705805|2.143431|2.116252|1.834170|1.819126|1.725961|1.667825|3.178134|3.574181|2.625919|2.864848|0.140984|0.170235|0.205157|0.174054|0.211907|0.500000| |6.866922|8.864618|17.482317|8.819339|6.908708|0.214299|5.610808|4.383204|4.593477|7.185904|5.077555|2.963687|0.073945|2.733040|2.293209|2.095655|2.188296|2.560117|2.943076|1.940042|4.325396|4.334272|3.897560|2.757556|4.905361|3.345896|2.225968|2.433583|2.007376|2.007558|1.774559|1.798724|1.677165|1.602554|3.498906|4.209874|2.945712|2.982771|0.140418|0.203736|0.168653|0.212236|0.173807|0.303880|0.500000| |4.580471|7.008504|8.897331|17.517818|8.890502|0.217165|5.435991|4.635187|7.167469|12.302461|6.863002|4.017503|0.093204|3.845938|3.016022|2.731057|2.941341|3.698462|4.503032|2.511795|5.455480|5.671674|4.901808|3.651251|6.069130|4.484506|2.863275|3.128474|2.438742|2.590733|2.236322|2.276877|2.114714|1.945547|4.055078|4.279182|3.449108|3.246775|0.109883|0.120067|0.112177|0.212052|0.176155|0.173747|0.209632|0.500000| |4.514224|6.789853|8.829138|17.621979|8.787656|0.175598|6.657683|6.722712|6.940565|13.571491|6.302310|3.864568|0.089908|3.495552|2.788319|2.489834|2.607220|3.157917|3.836977|2.237881|4.764353|5.076444|4.483601|3.904670|6.760060|4.830957|3.227697|3.804714|2.719658|2.845285|2.365488|2.328499|2.214478|2.072732|3.656002|3.694534|3.011446|3.161630|0.108003|0.110778|0.119529|0.168534|0.205146|0.212046|0.173255|0.305868|0.500000| |3.810043|4.419116|6.702599|6.649841|8.877469|0.223748|17.548303|8.860917|5.534918|8.127361|6.104751|3.460591|0.087899|2.879268|2.415391|2.115096|2.106978|2.392067|2.851613|1.830290|3.999570|4.010016|3.766716|3.427974|6.675492|3.923669|2.639877|2.956949|2.456455|2.246393|1.947588|1.957682|1.777341|1.790116|4.258489|4.899569|3.211753|4.034788|0.087571|0.103804|0.110904|0.106336|0.114059|0.227093|0.179989|0.138212|0.161128|0.500000| |2.918754|3.400512|4.625951|5.430928|8.819392|0.213733|17.568819|8.923464|7.037446|9.495960|8.386938|4.519270|0.116265|3.442133|2.852536|2.406738|2.328818|2.615345|3.215416|1.978861|4.285875|4.258176|4.096021|4.509021|9.394823|4.783304|3.116321|3.395773|2.948908|2.540820|2.195630|2.238709|1.949875|2.018062|5.903304|6.109667|3.995644|6.047130|0.070204|0.079855|0.082606|0.086933|0.090557|0.137122|0.125813|0.123367|0.138372|0.305524|0.500000| |2.865189|3.458845|4.323306|5.501150|6.616585|0.137230|8.772954|17.616578|6.661317|12.235751|6.913235|4.480946|0.108214|3.513213|2.883933|2.449482|2.395252|2.718712|3.350031|2.031352|4.268865|4.471238|4.224275|5.449457|11.535687|6.151568|4.316885|5.501383|3.842129|3.340537|2.683993|2.597935|2.359043|2.432843|4.047129|3.721647|3.122606|4.037555|0.070809|0.074214|0.081698|0.087477|0.100474|0.129057|0.104779|0.123719|0.175745|0.173104|0.211072|0.500000| |3.685362|4.520796|5.822079|6.662597|6.543227|0.138396|8.737648|17.566293|5.268338|9.495813|5.405965|3.412764|0.083678|2.894696|2.416880|2.129368|2.140037|2.449287|2.915332|1.859368|3.960897|4.158809|3.843079|3.759951|7.284505|4.544678|3.239878|4.037022|2.895577|2.728083|2.253376|2.172770|2.060546|2.053422|3.357618|3.369237|2.685921|3.223698|0.088563|0.092036|0.108833|0.106514|0.135234|0.194981|0.129647|0.136685|0.226224|0.210878|0.173413|0.301539|0.500000| |2.929595|3.343154|4.219837|4.616434|5.398997|0.123818|8.852726|17.547717|4.650194|7.832572|5.283092|3.362794|0.086050|2.742342|2.345113|2.038919|1.995935|2.222046|2.634339|1.735099|3.710199|3.820787|3.638045|3.784759|7.983291|4.413500|3.176406|3.821555|3.026595|2.596385|2.181329|2.119333|1.953618|2.040376|3.479001|3.451861|2.723275|3.625234|0.071440|0.076446|0.087043|0.081864|0.095247|0.138106|0.104758|0.102900|0.136991|0.214107|0.217606|0.301881|0.302348|0.500000| |1.709551|1.960182|2.174072|2.601207|2.957193|0.079692|2.661836|2.526704|3.825004|6.820222|6.569513|7.139706|0.235174|8.905809|17.705612|8.976396|5.670416|4.977070|5.659512|4.116337|8.146632|7.638281|9.017229|5.602392|7.911135|7.416582|3.991171|3.197265|3.724762|3.642928|3.745274|5.020117|3.132102|3.193522|4.374864|3.285426|5.086702|4.057739|0.044680|0.046944|0.045811|0.055898|0.054040|0.057255|0.059650|0.075283|0.071341|0.065084|0.078333|0.078166|0.064581|0.064437|0.500000| |1.564390|1.775333|1.898888|2.213354|2.371040|0.064805|2.109404|2.018220|2.882009|5.275247|4.499185|4.111194|0.117033|5.619585|8.929425|17.747788|8.911892|5.652404|4.955241|7.009662|12.653077|11.069697|17.508551|3.508757|5.221401|5.044740|3.031422|2.540431|2.772197|3.085510|3.375447|4.531770|3.122523|2.852992|3.057008|2.549986|3.594973|2.763711|0.041573|0.043043|0.041499|0.051586|0.049012|0.049478|0.052263|0.065792|0.060797|0.053105|0.060169|0.060938|0.053309|0.051678|0.217188|0.500000| |2.164984|2.577091|2.656073|3.212110|3.124265|0.084574|2.540497|2.402619|3.741962|7.249886|5.112831|4.044375|0.097483|5.634798|4.979182|5.656722|8.916911|17.733334|8.949203|7.068189|13.564178|16.890295|10.894173|3.419976|5.064958|4.835772|2.935558|2.749303|2.453311|2.999012|2.866930|3.205398|2.857618|2.340077|3.161981|2.853745|3.384488|2.606549|0.057982|0.058923|0.055398|0.079065|0.071155|0.065659|0.071950|0.105071|0.087719|0.064209|0.068094|0.071205|0.066229|0.059010|0.107954|0.124191|0.500000| |2.605712|3.264241|3.619464|4.947549|5.047740|0.129389|3.736057|3.439922|7.139693|14.702393|9.057140|6.774969|0.140556|8.903881|5.666122|4.960809|5.658835|8.979176|17.815132|4.123568|8.359910|8.946713|7.564518|5.256898|7.391956|6.803199|3.785857|3.653268|3.044875|3.510475|3.089142|3.369951|2.870835|2.521181|4.676702|4.008571|4.513390|3.593414|0.067385|0.070237|0.067094|0.097757|0.089843|0.088062|0.095911|0.165831|0.133527|0.089612|0.098596|0.104429|0.092847|0.080643|0.124201|0.107698|0.217383|0.500000| |2.013976|2.394463|2.634527|3.338767|3.608765|0.088776|3.227293|3.341124|4.978040|11.125995|6.945229|7.440707|0.164640|7.897609|6.456234|5.052090|4.642551|5.112281|6.565405|3.510633|6.654963|7.507531|7.325291|9.606831|10.967761|26.094516|9.053382|6.339240|5.775241|7.686238|5.980127|6.616560|4.652513|4.298931|3.787462|3.025477|3.571654|3.487185|0.052685|0.053549|0.054178|0.067462|0.068733|0.069580|0.068487|0.095268|0.099009|0.076022|0.089685|0.111299|0.087152|0.081756|0.160600|0.116771|0.118456|0.165304|0.500000| |2.201233|2.590581|2.925685|3.602684|3.921413|0.090560|4.152382|5.307125|4.682633|10.028249|5.651388|4.521258|0.110477|3.717257|3.179475|2.693252|2.576349|2.837297|3.421116|2.175306|4.423823|4.805813|4.624168|6.810639|13.504599|9.531667|8.785175|17.641005|6.953131|5.543434|3.920040|3.526073|3.232925|3.510300|3.291143|2.832972|2.782415|3.353103|0.056758|0.057207|0.061688|0.068622|0.076739|0.082878|0.073106|0.091754|0.115044|0.095138|0.113034|0.208756|0.134037|0.132891|0.087480|0.067525|0.072927|0.100413|0.154496|0.500000| |1.957368|2.260519|2.437454|2.882007|2.963695|0.071098|3.050294|3.720106|3.403983|7.211839|4.236051|3.455422|0.086995|3.113656|2.801950|2.478254|2.394590|2.580190|2.950180|2.077124|4.180831|4.670648|4.489425|4.689333|8.434976|7.604966|8.782998|17.543712|6.967756|6.983052|4.578743|3.691157|3.829304|4.198761|2.575929|2.268347|2.291420|2.602913|0.051535|0.050673|0.054787|0.060504|0.067845|0.068649|0.061211|0.075715|0.091699|0.073738|0.082438|0.127948|0.100788|0.097004|0.076983|0.063322|0.067360|0.084735|0.134445|0.301320|0.500000| |2.267547|2.719334|2.942442|3.682652|3.683835|0.085676|3.564424|4.286902|4.436514|10.505764|5.200340|4.235078|0.099837|3.876928|3.283546|2.878369|2.856805|3.223636|3.821967|2.416006|4.817703|5.481972|5.078135|5.720232|9.301493|9.532903|8.755939|17.563008|5.512320|7.108417|4.512733|3.869934|3.916980|3.713364|2.973544|2.602442|2.619683|2.854899|0.059407|0.058265|0.062438|0.073528|0.082433|0.080746|0.072532|0.097970|0.121848|0.084084|0.093151|0.151426|0.118750|0.103754|0.086507|0.071227|0.084297|0.114009|0.180584|0.301618|0.300468|0.500000| |1.602230|1.816260|1.997016|2.343720|2.593682|0.065651|2.609245|2.807704|3.148425|6.085369|4.552534|4.230845|0.119959|3.767170|3.799829|3.187962|2.781241|2.767437|3.139551|2.357614|4.700316|5.005208|5.311492|5.812649|10.059023|9.697531|8.750413|5.512367|17.600860|6.507099|6.157508|5.990555|4.117233|6.408033|2.913935|2.394019|2.735659|3.115070|0.042044|0.042877|0.044270|0.049802|0.052015|0.055166|0.052669|0.063619|0.068782|0.063292|0.076169|0.092202|0.071378|0.074729|0.116530|0.084439|0.068262|0.082279|0.155508|0.142959|0.140578|0.122819|0.500000| |1.615844|1.824729|1.983846|2.300697|2.476415|0.061833|2.550783|2.881445|2.894040|5.715708|3.947163|3.415043|0.092602|3.070038|2.972619|2.598273|2.379516|2.427747|2.724263|2.067974|4.152762|4.515321|4.620399|4.633193|8.477702|7.616139|8.819352|6.811432|17.559260|6.897033|5.662227|4.589396|4.078169|6.341885|2.517045|2.152083|2.313293|2.663814|0.042576|0.042782|0.045050|0.049494|0.053084|0.055534|0.051571|0.061573|0.069154|0.062390|0.072772|0.095156|0.074673|0.077808|0.086675|0.068534|0.061697|0.074034|0.127811|0.166816|0.204303|0.140024|0.300838|0.500000| |1.760800|2.003306|2.244022|2.645239|2.985160|0.073779|3.151452|3.555846|3.577272|6.880380|4.986458|4.352402|0.119780|3.564651|3.338754|2.777771|2.506676|2.596308|3.035516|2.126110|4.319802|4.566373|4.673939|6.549510|13.884838|9.314441|8.824752|7.139875|17.643165|5.432406|4.420567|4.128609|3.320789|4.397501|3.150187|2.611219|2.785052|3.470586|0.045758|0.046853|0.049195|0.053980|0.057639|0.063137|0.058552|0.069646|0.078665|0.075005|0.092797|0.121776|0.087813|0.096095|0.099158|0.072027|0.065064|0.083058|0.141245|0.215038|0.178235|0.143602|0.302672|0.301176|0.500000| |1.875200|2.196825|2.314516|2.806314|2.829278|0.069810|2.634235|2.876102|3.469342|7.658590|4.506334|4.020980|0.098069|4.220633|3.891427|3.570594|3.517237|3.761801|4.138777|2.973616|5.635582|6.800847|6.411454|4.974132|7.323409|10.130042|8.962085|7.086069|5.481862|17.494438|8.867052|6.543769|7.545393|5.500751|2.667743|2.292270|2.526752|2.536356|0.049997|0.049123|0.050806|0.061527|0.064907|0.062022|0.059212|0.079268|0.086422|0.064140|0.071329|0.093946|0.078563|0.072150|0.100945|0.088994|0.096106|0.111999|0.238119|0.144749|0.170291|0.216952|0.137893|0.140516|0.123921|0.500000| |1.716429|1.969046|2.074201|2.437747|2.480246|0.061479|2.421783|2.721760|2.915681|6.139049|3.809055|3.286024|0.083902|3.238388|3.079867|2.824307|2.718000|2.826929|3.082122|2.381924|4.648148|5.403031|5.268216|4.182141|6.773186|7.750274|8.957056|7.562274|6.579236|17.541595|8.934776|5.475290|7.051492|7.116203|2.344512|2.042132|2.197808|2.320337|0.045840|0.044918|0.047209|0.054226|0.058372|0.056866|0.053133|0.067025|0.075107|0.059613|0.066222|0.088745|0.074133|0.070538|0.084034|0.073132|0.073248|0.084388|0.152327|0.148867|0.228094|0.191634|0.154048|0.197928|0.139754|0.306721|0.500000| |1.639847|1.887597|2.006509|2.391233|2.506972|0.064737|2.293889|2.344982|3.118452|6.291303|4.494841|4.333455|0.113366|5.232593|5.970322|5.843690|5.075612|4.615443|4.674420|4.121830|7.328829|8.697222|9.500222|4.633256|6.574475|8.567238|5.461845|3.982177|4.475184|6.719109|8.736625|17.551539|6.963561|5.495411|2.785381|2.320687|2.851368|2.632965|0.043689|0.043988|0.044051|0.053796|0.053914|0.053157|0.053183|0.069223|0.069410|0.056534|0.064271|0.073996|0.062425|0.059739|0.155374|0.150289|0.108515|0.110555|0.217543|0.096776|0.098146|0.110518|0.136669|0.109454|0.104188|0.192361|0.138320|0.500000| |1.433149|1.618266|1.711942|1.984710|2.085809|0.054481|1.964850|2.019550|2.496781|4.870104|3.614034|3.326344|0.091967|3.714200|4.332758|4.353204|3.741223|3.327140|3.318331|3.331758|6.189321|7.032302|8.206054|3.596821|5.505087|6.145304|4.423707|3.317281|4.172604|5.414266|8.810809|17.532171|7.031908|7.014222|2.350810|1.993062|2.419524|2.304455|0.038339|0.038575|0.038790|0.045791|0.046152|0.045918|0.045666|0.056665|0.057356|0.049125|0.055595|0.062930|0.053708|0.052635|0.124250|0.125177|0.081554|0.081400|0.135004|0.081939|0.086365|0.088617|0.135216|0.107794|0.096271|0.137673|0.123621|0.302563|0.500000| |1.561447|1.779244|1.923448|2.271590|2.459187|0.063520|2.330775|2.399456|3.047228|5.949847|4.524598|4.452878|0.125054|4.707098|5.426139|4.717280|3.856443|3.574927|3.855148|3.193900|6.062637|6.602198|7.435913|5.141072|7.577510|9.341934|6.259027|4.168336|6.028691|6.588920|8.711355|17.589684|5.509751|6.822479|2.878359|2.351091|2.903885|2.870395|0.041316|0.042025|0.042415|0.049953|0.050613|0.051787|0.051207|0.064100|0.065671|0.057178|0.066902|0.076472|0.062491|0.062247|0.166028|0.127542|0.085030|0.094123|0.191126|0.103964|0.103704|0.106665|0.216569|0.139980|0.134040|0.156292|0.138575|0.301880|0.301779|0.500000| |1.504610|1.701050|1.747857|2.006253|2.003813|0.051111|1.913899|2.065402|2.306832|4.706386|3.078281|2.624715|0.068424|2.781309|2.796756|2.764895|2.721517|2.711338|2.740977|2.517018|4.823401|5.867604|5.760742|3.001983|4.800025|5.181425|4.505684|3.901909|3.862057|7.083192|8.720289|5.516819|17.533056|6.947204|1.956326|1.732975|1.910991|1.904590|0.040781|0.039662|0.040975|0.047711|0.050025|0.047308|0.045429|0.056655|0.060346|0.048242|0.052336|0.064446|0.056976|0.053819|0.075324|0.073939|0.071662|0.073072|0.112134|0.089117|0.111495|0.109420|0.104876|0.112590|0.088745|0.190618|0.214215|0.141358|0.142423|0.122403|0.500000| |1.405684|1.581354|1.632998|1.869319|1.893531|0.049040|1.792792|1.886509|2.196035|4.380907|3.020569|2.621144|0.069804|2.868907|3.045416|3.121263|3.002834|2.838612|2.781256|2.829649|5.324567|6.482010|6.766191|2.886928|4.556753|4.903739|3.916906|3.227076|3.522186|5.536183|8.746199|6.975371|17.542750|7.064550|1.950943|1.714363|1.957389|1.896629|0.038054|0.037439|0.038100|0.044709|0.045839|0.043932|0.043023|0.053320|0.055082|0.045317|0.049611|0.058355|0.051457|0.049250|0.082757|0.086310|0.073825|0.071693|0.108162|0.076949|0.088596|0.089285|0.102456|0.098745|0.081761|0.148342|0.143820|0.172061|0.211830|0.141701|0.301691|0.500000| |1.599358|1.830135|1.882114|2.196172|2.189630|0.056056|2.030081|2.141999|2.580448|5.325012|3.473739|3.029106|0.077666|3.410522|3.468073|3.544412|3.568683|3.516621|3.440675|3.264840|5.993232|7.720356|7.431124|3.338951|5.098725|5.887313|4.580457|3.830960|3.692367|6.984843|8.716039|6.960454|17.540806|5.526185|2.173991|1.906378|2.160711|2.062777|0.043287|0.042324|0.043056|0.052079|0.053447|0.050129|0.049108|0.063359|0.065491|0.050889|0.055408|0.066797|0.058951|0.054881|0.089967|0.093104|0.092038|0.089206|0.138793|0.088800|0.101591|0.112010|0.102824|0.099936|0.086287|0.227248|0.169591|0.208823|0.173180|0.141176|0.301506|0.301724|0.500000| |1.420723|1.592594|1.702180|1.955555|2.078534|0.053331|2.059561|2.209289|2.436825|4.749788|3.440036|3.061208|0.085264|2.998206|3.147980|2.877219|2.569677|2.486646|2.655583|2.278436|4.490210|4.930303|5.298487|3.722482|6.226855|6.312538|5.757065|4.169482|7.071437|6.488100|8.668245|6.917378|5.520152|17.619790|2.246320|1.919021|2.183612|2.323101|0.037811|0.037957|0.039139|0.044023|0.045887|0.046804|0.044923|0.053912|0.057544|0.051284|0.058749|0.070129|0.058152|0.059029|0.093353|0.078983|0.062660|0.069238|0.118777|0.101747|0.116751|0.100666|0.241729|0.214022|0.144399|0.134225|0.168454|0.139973|0.174613|0.203344|0.140319|0.143770|0.122377|0.500000| |1.333059|1.487571|1.563695|1.780127|1.853081|0.047991|1.806249|1.915889|2.145002|4.187690|3.005775|2.628602|0.072463|2.708651|2.900543|2.805845|2.558085|2.425167|2.486001|2.346955|4.574592|5.155239|5.593307|3.012696|4.937439|5.037395|4.271129|3.352729|4.458099|5.438745|8.797648|6.891285|7.182896|17.536598|1.976551|1.717809|1.961919|1.996287|0.035792|0.035635|0.036524|0.041487|0.042899|0.042678|0.041368|0.049754|0.052232|0.045527|0.050927|0.059699|0.051294|0.050946|0.083704|0.078681|0.061946|0.064402|0.102054|0.081499|0.094340|0.086238|0.138843|0.131528|0.099665|0.124260|0.145454|0.141380|0.209494|0.166833|0.176300|0.219664|0.144561|0.303148|0.500000| |1.415862|1.584809|1.665643|1.899806|1.964146|0.050125|1.942412|2.118471|2.258789|4.483712|3.083096|2.653526|0.071669|2.644256|2.694642|2.539221|2.369830|2.336253|2.455743|2.147714|4.227773|4.790932|4.957131|3.182791|5.332441|5.402234|5.164930|4.174288|5.421921|6.895145|8.733732|5.498085|6.892448|17.533229|1.997049|1.746983|1.927628|2.026720|0.037979|0.037535|0.039040|0.043783|0.046208|0.045850|0.043562|0.052431|0.056701|0.048764|0.054324|0.066805|0.057017|0.056510|0.076644|0.069016|0.060334|0.065338|0.105833|0.097653|0.125102|0.104165|0.151336|0.180363|0.116729|0.144602|0.218860|0.122444|0.141822|0.139892|0.205067|0.171111|0.140253|0.301904|0.302035|0.500000| |2.835759|3.294449|4.178916|4.798992|6.443837|0.256378|4.916482|3.602166|6.026743|7.912469|9.177858|4.586205|0.119876|4.063097|3.352596|2.909837|2.900424|3.323628|4.026291|2.448815|5.573573|5.127302|4.884099|3.586378|6.210604|4.037400|2.479195|2.485268|2.285443|2.182629|1.992066|2.140872|1.823576|1.789835|8.705251|17.584192|6.991713|5.520087|0.069454|0.082743|0.074263|0.093673|0.081981|0.104074|0.132397|0.137083|0.108332|0.128665|0.142830|0.096711|0.091300|0.088632|0.087791|0.071427|0.086786|0.121910|0.082541|0.074619|0.060820|0.071059|0.062412|0.056612|0.067069|0.063243|0.055524|0.063908|0.054337|0.062994|0.047843|0.047332|0.053177|0.051163|0.046471|0.047158|0.500000| |2.353186|2.620378|3.220621|3.536050|4.649882|0.159753|4.241257|3.227803|4.549867|6.308386|7.494237|4.130841|0.118341|3.533971|3.107044|2.676426|2.561644|2.783362|3.273392|2.194121|5.001745|4.536061|4.503688|3.335321|6.025198|3.726416|2.323874|2.291538|2.228043|2.029815|1.882088|2.034300|1.703998|1.727801|8.958825|17.586835|7.472976|7.041943|0.058376|0.068528|0.063292|0.072848|0.066725|0.085123|0.099330|0.096806|0.085035|0.112804|0.135298|0.087180|0.079833|0.083471|0.085566|0.067624|0.071634|0.093789|0.074311|0.069309|0.056795|0.063687|0.061686|0.055237|0.066325|0.057480|0.051851|0.059529|0.052132|0.060858|0.044705|0.044637|0.048932|0.050079|0.045055|0.045409|0.303286|0.500000| |2.807735|3.199578|4.240429|4.725544|7.154057|0.267492|6.780964|4.458904|6.014223|7.750731|8.772726|4.380636|0.117659|3.548959|2.980307|2.543635|2.471781|2.765829|3.351358|2.105115|4.698174|4.447249|4.305664|3.727589|6.978443|4.065962|2.558153|2.619734|2.419703|2.187322|1.969912|2.079543|1.777885|1.801452|8.657953|17.653833|5.573831|7.053146|0.067831|0.080895|0.076435|0.086166|0.080927|0.114182|0.130922|0.120731|0.109847|0.178758|0.227549|0.115168|0.106494|0.112463|0.081082|0.063541|0.071952|0.100846|0.079834|0.081426|0.064354|0.073202|0.065226|0.059923|0.073193|0.062159|0.056265|0.060702|0.052562|0.061949|0.047084|0.045984|0.051059|0.052125|0.046392|0.047826|0.299290|0.305176|0.500000| |1.915967|2.187317|2.525550|2.991306|3.666529|0.106218|3.231300|2.806741|4.596115|7.052020|9.269326|7.251425|0.262311|6.621833|6.436761|4.806344|4.040111|4.084633|4.942938|3.175796|7.013161|6.120763|6.570491|4.765774|7.619402|5.300776|3.024589|2.710984|2.880577|2.646757|2.544038|2.971366|2.230805|2.274777|8.611972|5.566449|17.631439|6.826192|0.049125|0.053789|0.051200|0.062232|0.058364|0.066067|0.072060|0.085992|0.077415|0.079578|0.099240|0.083145|0.070100|0.071487|0.188861|0.117984|0.095120|0.121894|0.108192|0.078860|0.065682|0.074272|0.084170|0.068756|0.082797|0.074430|0.064580|0.088808|0.075457|0.092381|0.056424|0.058726|0.064226|0.066545|0.059493|0.057529|0.140679|0.149633|0.122561|0.500000| |1.976452|2.216848|2.591106|2.949134|3.653340|0.113188|3.259483|2.711683|4.118766|6.073579|7.593584|4.874043|0.153743|4.406027|4.129867|3.472395|3.157175|3.274048|3.802204|2.641812|6.059920|5.236503|5.455274|3.623878|6.197901|4.095841|2.471846|2.316348|2.380805|2.184205|2.084077|2.345086|1.869413|1.900267|8.832236|7.375905|17.576255|6.879604|0.050279|0.056553|0.052814|0.062905|0.057933|0.067875|0.076491|0.084009|0.074056|0.083265|0.101308|0.077144|0.067873|0.069970|0.116704|0.088061|0.080788|0.100757|0.082955|0.068300|0.057136|0.063888|0.068114|0.058269|0.069448|0.061585|0.054702|0.069186|0.060492|0.071198|0.048141|0.049432|0.053725|0.055313|0.049978|0.048970|0.178477|0.238552|0.148650|0.304608|0.500000| |2.180881|2.518006|2.925896|3.477821|4.219632|0.130087|3.436927|2.866646|5.079000|7.483755|9.586473|6.027965|0.169282|6.114895|5.248030|4.384104|4.148378|4.542804|5.509204|3.299758|7.572382|6.469139|6.497401|4.063918|6.491220|4.652237|2.711764|2.538673|2.495180|2.427598|2.294601|2.603353|2.078872|2.028660|8.751307|7.012655|17.574589|5.482162|0.055590|0.062014|0.057230|0.073164|0.065712|0.074133|0.085670|0.104097|0.086311|0.086154|0.101528|0.082512|0.073081|0.071567|0.133820|0.104443|0.109304|0.143518|0.098245|0.073680|0.061654|0.071863|0.070741|0.060768|0.071285|0.070274|0.059994|0.079460|0.066318|0.077591|0.053125|0.054492|0.060979|0.058091|0.053167|0.052125|0.207246|0.179764|0.140968|0.302166|0.301255|0.500000| |2.216383|2.512537|3.117391|3.627884|5.114933|0.141217|5.746638|4.628063|5.593409|7.823145|9.401708|5.473735|0.163375|3.879599|3.353593|2.718782|2.501471|2.695049|3.305892|2.097569|4.552278|4.377071|4.409540|5.085966|10.929257|5.099692|3.184039|3.153674|3.184072|2.569333|2.304243|2.444837|1.996105|2.143991|8.763086|6.890441|5.480351|17.610963|0.055148|0.061649|0.061587|0.067277|0.067234|0.087429|0.087760|0.092542|0.094310|0.133525|0.229354|0.132976|0.103051|0.123332|0.097194|0.068740|0.067789|0.094337|0.093734|0.101643|0.076603|0.083149|0.086355|0.076395|0.101612|0.070314|0.065460|0.069401|0.061017|0.075738|0.052584|0.051463|0.056085|0.063904|0.054458|0.056407|0.140971|0.168283|0.207709|0.139242|0.140988|0.122591|0.500000| |1.982606|2.205138|2.651160|2.988556|3.920750|0.116245|3.990290|3.292345|4.261521|6.180842|7.553355|4.722373|0.153072|3.674849|3.364619|2.767762|2.507201|2.624906|3.114330|2.123479|4.704416|4.347894|4.490681|4.007001|7.736610|4.290629|2.672157|2.556556|2.692190|2.253449|2.099727|2.287919|1.840936|1.964986|8.821848|7.167297|6.933600|17.548798|0.049883|0.056091|0.054467|0.060297|0.058337|0.072744|0.076832|0.079741|0.076605|0.100315|0.138451|0.093308|0.078311|0.088190|0.099543|0.071192|0.065729|0.085812|0.081750|0.078650|0.063255|0.068220|0.075815|0.065498|0.082675|0.061859|0.057228|0.065210|0.058329|0.070875|0.048093|0.048257|0.051825|0.058446|0.050881|0.051202|0.143704|0.217766|0.181494|0.171577|0.207843|0.141098|0.300751|0.500000| 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