Version2.0 2020-01-15T02:14:06Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 23-Oct-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE C[C@@]1(C(=O)N(C(=O)N1)CC(=O)N2[C@H](CC(=N2)c3ccco3)c4ccco4)c5ccc(cc5)C(C)(C)C C32835691 RHF 6-31G(d) (6D,7F) C[C@@]1(C(=O)N(C(=O)N1)CC(=O)N2[C@H](CC(=N2)c3ccco3)c4ccco4)c5ccc(cc5)C(C)(C)C C01[X(C27H28N4O5)] 186 C1 596 O=C(N1N=C(C[C@@H]1c1ccco1)c1ccco1)CN1C(=O)N[C@@](C1=O)(C)c1ccc(cc1)C(C)(C)C O=C(N1N=C(C[C@@H]1c1ccco1)c1ccco1)CN1C(=O)N[C@@](C1=O)(C)c1ccc(cc1)C(C)(C)C CC(C)(C)c1ccc(cc1)[C@]2(C)NC(=O)N(CC(=O)N3N=C(C[C@@H]3c4occc4)c5occc5)C2=O InChIKey=BJJZHHBNNVLWQF-HRFSGMKKSA-N InChI=1S/C27H28N4O5/c1-26(2,3)17-9-11-18(12-10-17)27(4)24(33)30(25(34)28-27)16-23(32)31-20(22-8-6-14-36-22)15-19(29-31)21-7-5-13-35-21/h5-14,20H,15-16H2,1-4H3,(H,28,34)/t20-,27+/m1/s1 InChI=1/C27H28N4O5/c1-26(2,3)17-9-11-18(12-10-17)27(4)24(33)30(25(34)28-27)16-23(32)31-20(22-8-6-14-36-22)15-19(29-31)21-7-5-13-35-21/h5-14,20H,15-16H2,1-4H3,(H,28,34)/t20-,27+/m1/s1/f/h28H C[C@@]1(C(=O)N(C(=O)N1)CC(=O)N2[C@H](CC(=N2)c3ccco3)c4ccco4)c5ccc(cc5)C(C)(C)C C01[X(C27H28N4O5)] 186 C01 596 O=C(N1N=C(C[C@@H]1c1ccco1)c1ccco1)CN1C(=O)N[C@@](C1=O)(C)c1ccc(cc1)C(C)(C)C O=C(N1N=C(C[C@@H]1c1ccco1)c1ccco1)CN1C(=O)N[C@@](C1=O)(C)c1ccc(cc1)C(C)(C)C CC(C)(C)c1ccc(cc1)[C@]2(C)NC(=O)N(CC(=O)N3N=C(C[C@@H]3c4occc4)c5occc5)C2=O InChIKey=BJJZHHBNNVLWQF-HRFSGMKKSA-N InChI=1S/C27H28N4O5/c1-26(2,3)17-9-11-18(12-10-17)27(4)24(33)30(25(34)28-27)16-23(32)31-20(22-8-6-14-36-22)15-19(29-31)21-7-5-13-35-21/h5-14,20H,15-16H2,1-4H3,(H,28,34)/t20-,27+/m1/s1 InChI=1/C27H28N4O5/c1-26(2,3)17-9-11-18(12-10-17)27(4)24(33)30(25(34)28-27)16-23(32)31-20(22-8-6-14-36-22)15-19(29-31)21-7-5-13-35-21/h5-14,20H,15-16H2,1-4H3,(H,28,34)/t20-,27+/m1/s1/f/h28H 3750.6839948594 -1630.8571843 1-A 24332.1594 129 467 596 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1914.32 1918.58 1928.99 1942.58 1965.80 1984.77 1987.01 1995.60 2003.33 2027.51 2039.49 2074.07 2117.07 2120.68 2160.34 2161.51 2186.70 2228.83 2236.67 2237.01 2242.95 2244.83 2253.65 2262.40 2281.69 2289.27 2313.30 2339.40 2345.54 2346.94 2351.37 2354.13 2357.63 2361.18 2375.87 2384.76 2400.13 2424.37 2441.74 2455.66 2534.02 2600.88 2618.66 2623.41 2745.40 2805.70 2858.77 2944.26 4604.98 4606.10 4620.94 4630.89 4673.33 4690.40 4692.50 4707.07 4708.26 4715.66 4720.61 4723.80 4743.22 4755.03 4770.67 4778.98 4823.88 4852.89 4879.18 4900.57 4907.99 4948.58 4954.36 4968.73 4979.55 5011.41 5014.32 5605.02 0.556207 0.587043 0.587987 0.487797 -1630.300977 -1630.270141 -1630.269197 -1630.369388 3.360423D-04 MUNgauss RevisionA2.0 retrievium 15-Jan-2020 DUDE C[C@@]1(C(=O)N(C(=O)N1)CC(=O)N2[C@H](CC(=N2)c3ccco3)c4ccco4)c5ccc(cc5)C(C)(C)C C32835691 RHF 6-31G(d) (6D,10F) C1 488.205970 |X|Y|Z| 61.476565 46.629597 135.567360 72.975228 28 6 7 8 22 4 2 |36.858105| |12.393510|36.858105| |7.606762|12.407896|36.858105| |6.206529|7.805630|16.012496|73.516695| |5.686873|8.150841|13.949045|14.863224|53.358707| |5.658808|8.101542|8.334423|9.876110|18.671834|36.858105| |4.321336|5.435568|5.562227|7.495769|11.298639|15.985262|73.516695| |7.739465|13.135557|8.322589|9.808433|11.793593|14.056799|14.782358|53.358707| |4.070822|5.106912|7.701003|11.749888|18.051702|7.667101|11.751858|7.257784|36.858105| |3.377269|4.323500|5.895289|9.641931|10.664144|5.862875|9.569416|6.116856|12.492324|36.858105| |3.433747|4.609593|5.886153|9.374512|9.634309|5.854665|9.278066|6.523904|7.959003|15.905747|73.516695| |2.760810|3.325393|4.267387|7.436851|7.083014|4.249134|7.392409|4.663794|7.813750|14.076946|15.190881|53.358707| |2.358990|2.804791|3.396576|6.014350|5.264682|3.372604|5.935318|3.908325|4.958623|7.636658|12.024494|17.664104|36.858105| |2.398192|2.879445|3.478745|6.285185|5.154144|3.276273|5.597271|3.914166|4.596743|7.041168|12.671731|12.428232|17.648270|0.500000| |2.091688|2.396169|2.875225|5.225242|4.355930|2.798875|4.956770|3.296370|4.071633|5.249532|8.028277|11.148850|12.332887|0.240800|36.858105| |2.229153|2.519145|3.092902|5.627357|4.806288|3.016762|5.365729|3.472996|4.774168|5.586535|7.781316|12.109035|8.046287|0.167527|12.617397|36.858105| |2.591004|2.981088|3.801754|6.796449|6.215583|3.742465|6.613518|4.144829|6.925106|7.994344|9.740521|18.890103|8.026349|0.169208|8.174097|15.129400|53.358707| |2.008988|2.202387|2.644471|4.849831|4.020201|2.575765|4.609143|3.022224|3.793598|4.028615|5.892103|7.322091|5.035865|0.116550|7.287732|13.085511|10.908630|36.858105| |1.991755|2.136486|2.547231|4.664046|3.865453|2.493039|4.478892|2.932800|3.583289|3.531154|5.194025|5.903328|3.862066|0.092756|4.863897|7.400423|8.495262|14.162304|36.858105| |1.742044|1.846307|2.149776|3.949819|3.188703|2.099059|3.771724|2.524132|2.825762|2.819635|4.315532|4.569397|3.175496|0.078518|4.006843|5.196508|5.910646|8.586017|13.281847|36.858105| |1.655849|1.772361|2.054032|3.782472|3.024401|1.998038|3.581888|2.418683|2.663196|2.768534|4.306321|4.580929|3.371402|0.083593|4.513825|5.408263|5.707102|8.791496|8.604569|14.202584|36.858105| |1.777698|1.936658|2.273190|4.184749|3.376285|2.206897|3.946881|2.646449|3.042877|3.292663|5.060359|5.753261|4.379176|0.105478|6.594718|7.995370|7.309075|14.115246|8.617196|8.629068|14.209100|73.516695| |2.193683|2.605622|3.004559|5.136213|4.716235|3.235443|5.936001|3.761909|4.179486|5.956825|10.437399|10.534216|12.744948|0.252184|7.488921|5.599542|7.647273|4.048581|3.271939|2.784311|2.951625|6.537782|36.858105| |2.120229|2.532970|2.815566|4.761540|4.318606|3.075497|5.640882|3.683700|3.577067|4.872630|9.554566|7.332830|7.339310|0.192919|5.074449|4.033607|5.592335|3.155517|2.660303|2.331378|2.462260|5.249976|14.226598|36.858105| |1.932258|2.263090|2.454245|4.111037|3.787465|2.792482|5.297890|3.355210|3.086814|3.877653|7.283672|5.751997|5.141902|0.129563|4.120837|3.482832|4.777736|2.869873|2.478674|2.207783|2.321914|4.837013|8.578322|13.224577|36.858105| |1.903173|2.200312|2.419878|4.063061|3.802577|2.780323|5.369792|3.271769|3.201970|3.926674|6.891593|6.143662|5.336218|0.124096|4.564828|3.970587|5.353814|3.287007|2.820925|2.493685|2.620175|5.495892|8.777078|8.602036|14.238789|36.858105| |2.039206|2.368607|2.692598|4.569123|4.286460|3.014502|5.734163|3.476010|3.807155|4.877576|8.068293|8.514759|7.849483|0.160300|6.554284|5.514682|7.296274|4.230109|3.461132|2.956952|3.122549|6.844456|14.120099|8.634362|8.628333|14.158112|73.516695| |7.495219|12.453611|7.537052|11.066388|7.482602|5.465431|7.405100|10.435088|4.035255|3.824593|7.743455|4.120826|2.681337|0.078816|2.276506|2.313873|3.621339|2.019893|1.931496|1.694689|1.652570|3.220229|2.513970|2.514921|2.225633|2.112403|3.989497|36.858105| |5.208080|7.470709|5.351284|8.004695|6.244403|4.969850|7.197636|9.159530|3.562085|3.566704|7.519995|3.905359|2.619413|0.077177|2.196981|2.187465|3.378568|1.904091|1.806399|1.596195|1.569821|3.066223|2.542134|2.626174|2.342073|2.177589|4.024265|13.725709|36.858105| |3.973202|4.982746|4.028762|6.517609|4.792747|3.679990|5.635254|6.154068|2.927626|3.025304|6.356651|3.449130|2.396201|0.071643|2.033468|1.988515|3.001477|1.744607|1.648118|1.475077|1.463773|2.852743|2.341378|2.462637|2.201354|2.021004|3.695301|7.903131|13.772047|36.858105| |3.717984|4.366791|3.715994|6.392269|4.282111|3.133449|4.811563|5.068999|2.682633|2.762322|5.668995|3.216174|2.252790|0.068063|1.947496|1.901757|2.838762|1.683381|1.592670|1.435304|1.427590|2.771729|2.158830|2.244596|1.997278|1.846921|3.405525|6.724387|7.847403|13.678151|36.858105| |4.363490|4.991823|4.298657|7.733635|4.654836|3.265619|4.893354|5.293301|2.883248|2.892763|5.800268|3.347974|2.301004|0.069489|2.008933|1.989585|2.989362|1.766711|1.680721|1.508990|1.492278|2.891140|2.149184|2.181655|1.929251|1.811655|3.394710|7.888919|6.929104|8.042887|13.697585|36.858105| |6.215333|7.517983|6.045172|10.685537|5.949241|4.068406|5.813640|6.870037|3.482711|3.353316|6.638520|3.758633|2.495063|0.074457|2.165205|2.188239|3.360405|1.932542|1.849391|1.639263|1.604876|3.113344|2.299802|2.291210|2.020476|1.920719|3.642354|13.727471|8.018858|6.943304|7.857443|13.751322|36.858105| |2.879157|3.228859|2.876814|5.043658|3.442202|2.522813|4.002686|3.925909|2.238740|2.334723|4.727961|2.804753|2.012842|0.060912|1.766301|1.705510|2.499484|1.524753|1.441040|1.314356|1.316265|2.544747|1.949484|2.049046|1.842270|1.694776|3.092527|4.358899|4.974784|7.496197|12.387967|7.392635|4.944580|36.858105| |2.525826|2.898606|2.685659|4.707279|3.310217|2.421078|3.905457|3.645854|2.206955|2.376310|4.892022|2.889944|2.126242|0.065151|1.850447|1.751948|2.543171|1.555467|1.454004|1.328970|1.343317|2.614470|2.084040|2.236256|1.996829|1.805411|3.269151|3.744711|4.374829|6.213517|7.574208|5.273795|4.004111|12.361577|36.858105| |2.649942|2.860591|2.628364|4.766148|3.118532|2.234634|3.554507|3.415983|2.062424|2.133212|4.223383|2.604773|1.873690|0.056765|1.675530|1.622423|2.356891|1.465607|1.390179|1.276723|1.279619|2.460506|1.789464|1.855571|1.669226|1.551552|2.851597|3.680758|3.825653|4.942901|7.460098|6.581610|4.453145|12.399916|7.654185|36.858105| |2.672083|2.903237|2.527973|4.351291|3.090358|2.326536|3.753837|3.648010|2.007353|2.063406|4.118126|2.496763|1.787543|0.053216|1.582245|1.537962|2.249563|1.387817|1.321569|1.211139|1.208971|2.320725|1.757221|1.851570|1.699895|1.569930|2.833016|3.745920|4.373581|6.215490|7.573023|5.262438|4.000337|12.361677|7.571420|7.655131|36.858105| |17.561161|8.790950|7.013327|10.210369|8.011012|5.875952|8.183292|9.732506|4.280224|3.379896|5.887179|3.801062|2.348656|0.065209|2.106902|2.289797|3.652276|2.083552|2.095848|1.823094|1.712732|3.248808|2.182657|2.082343|1.914988|1.913244|3.661093|5.474156|4.201609|3.307823|3.088322|3.519205|4.671245|2.482023|2.228682|2.306877|2.326892|0.500000| |17.565466|8.821099|5.522752|8.292340|6.182016|4.870689|6.993117|9.359541|3.410583|2.938298|5.394888|3.331623|2.136416|0.060348|1.900378|2.003368|3.122914|1.817776|1.802101|1.593567|1.520927|2.889942|2.023481|1.983307|1.829029|1.791800|3.364607|6.855015|5.253378|4.080909|3.769112|4.272465|5.697651|2.940834|2.535456|2.677747|2.818458|0.300177|0.500000| |17.623489|8.763866|6.859007|11.641869|6.670919|4.529115|6.378848|7.634820|3.745922|3.171500|5.707602|3.597707|2.281477|0.065073|2.048323|2.178201|3.407472|1.977224|1.961955|1.726531|1.643816|3.127907|2.092465|2.016035|1.826504|1.798317|3.441717|6.803713|4.658462|3.779768|3.754389|4.674964|6.796331|2.927795|2.534788|2.780549|2.674911|0.301023|0.301132|0.500000| |6.842008|8.787394|5.864822|7.713885|8.298116|9.349008|13.080732|26.075409|4.279899|3.724622|7.038839|4.042768|2.553081|0.070737|2.184158|2.289143|3.648577|2.021619|1.974187|1.718888|1.647712|3.179023|2.510080|2.491568|2.319884|2.259483|4.188658|6.393111|6.232912|4.351604|3.534552|3.582571|4.436345|2.792273|2.577227|2.414177|2.678215|0.179218|0.194520|0.138609|0.500000| |3.661544|4.358450|5.760981|8.814393|12.589207|7.223605|13.045853|6.620477|17.648275|8.875044|10.989328|9.513785|4.597828|0.113172|3.921633|4.764053|9.406275|3.897165|3.783609|2.946180|2.728599|5.480779|4.096410|3.474278|3.120324|3.343990|7.052233|3.465032|3.155631|2.624275|2.390604|2.527760|2.991430|2.028254|2.004192|1.868889|1.851154|0.110341|0.087581|0.092341|0.113786|0.500000| |3.956498|4.658750|7.214023|12.915969|12.602493|5.743064|8.838618|6.112012|17.653824|8.862770|10.957887|9.528918|4.622312|0.121009|4.072550|4.988310|9.767555|4.081261|3.933656|3.056656|2.839102|5.727184|3.731687|3.175653|2.748770|2.866150|6.083629|3.742437|3.218201|2.708065|2.556845|2.811246|3.396057|2.151863|2.106810|2.022578|1.921447|0.116717|0.090890|0.105452|0.102646|0.302009|0.500000| |2.021701|2.296469|2.749942|5.125317|4.023267|2.566848|4.463851|3.092444|3.643909|4.551068|7.230666|8.623480|8.664923|0.222974|17.572197|8.894880|8.634537|6.436088|4.474136|3.864161|4.477914|11.452080|5.696385|4.337076|3.531137|3.739678|8.694976|2.213827|2.123899|1.990664|1.936780|2.010889|2.147672|1.769884|1.858096|1.698526|1.574790|0.056173|0.051035|0.055712|0.056979|0.095092|0.104405|0.500000| |1.898981|2.154484|2.517259|4.516172|3.812404|2.528198|4.561412|3.000218|3.451117|4.277746|6.794729|8.245884|8.658276|0.181727|17.633204|8.817431|8.353460|6.559257|4.529364|3.936365|4.606945|11.916057|7.347721|5.106941|4.405253|5.107041|13.098315|2.057423|2.012317|1.877718|1.793205|1.830281|1.953387|1.644218|1.730758|1.558331|1.487101|0.053222|0.048457|0.051475|0.055998|0.095201|0.094379|0.302290|0.500000| |2.149719|2.288261|2.748435|4.997780|4.228474|2.710449|4.879182|3.153109|3.963071|3.682731|5.330396|5.913789|3.654439|0.088343|4.265296|6.381953|8.594780|8.833951|17.813738|8.445695|5.854415|10.449458|3.128318|2.572202|2.403636|2.720159|5.859976|2.029342|1.881263|1.698332|1.634964|1.733902|1.929873|1.467774|1.468714|1.412572|1.349622|0.063718|0.053697|0.058558|0.058818|0.119510|0.122951|0.108052|0.108605|0.500000| |1.656516|1.732916|1.994346|3.658924|2.935937|1.951978|3.511416|2.367587|2.546389|2.492638|3.862909|3.912117|2.707503|0.068010|3.273169|4.065699|4.891617|5.847975|8.460566|17.804959|8.823691|10.454368|2.422778|2.071968|1.982879|2.222151|4.571352|1.588900|1.495501|1.384559|1.350180|1.420595|1.541129|1.240001|1.248097|1.208292|1.148676|0.048357|0.042275|0.045687|0.045085|0.074043|0.076424|0.088405|0.089778|0.192900|0.500000| |1.521948|1.622908|1.857245|3.420637|2.705918|1.805919|3.235591|2.210947|2.333819|2.440688|3.876932|3.961020|2.991388|0.075672|3.914981|4.320169|4.705719|6.040476|5.818267|8.610066|17.838309|16.525584|2.678727|2.283951|2.172708|2.428023|5.020387|1.528259|1.459689|1.372340|1.343417|1.399151|1.491824|1.248609|1.278108|1.218209|1.149583|0.043523|0.039077|0.042075|0.042078|0.066015|0.068518|0.110789|0.114079|0.123092|0.195151|0.500000| |2.167747|2.616137|2.878064|4.892614|4.290265|3.048308|5.445150|3.748269|3.436061|4.675666|9.875356|6.601028|6.362703|0.193218|4.460428|3.584663|5.019764|2.847638|2.429845|2.146481|2.262356|4.769206|8.849282|17.805297|8.432613|5.855096|10.459731|2.673001|2.833595|2.703888|2.464268|2.365628|2.448989|2.259212|2.516661|2.029505|2.016879|0.058303|0.056486|0.057520|0.070276|0.090020|0.085321|0.112276|0.120261|0.065567|0.053377|0.058696|0.500000| |1.825363|2.123011|2.251357|3.762344|3.424117|2.572164|4.883650|3.155932|2.709707|3.287801|6.275623|4.703466|4.034515|0.105924|3.362969|2.912971|4.005398|2.474367|2.180213|1.971050|2.065491|4.216849|5.845307|8.435734|17.802873|8.834677|10.450830|2.112767|2.257196|2.149713|1.943599|1.854070|1.920359|1.813511|1.979756|1.635675|1.690071|0.050050|0.048508|0.047894|0.061480|0.076019|0.067438|0.082774|0.099237|0.059020|0.049759|0.054258|0.192646|0.500000| |1.783432|2.029844|2.210188|3.709965|3.466093|2.563665|5.015685|3.030158|2.892736|3.376589|5.828981|5.206315|4.273955|0.100952|3.923959|3.585819|4.799357|3.113801|2.738490|2.457556|2.566402|5.257919|6.035259|5.815915|8.618068|17.837275|16.495891|1.935621|1.990073|1.848760|1.694012|1.664139|1.763998|1.561540|1.651691|1.435569|1.460462|0.050161|0.046884|0.046774|0.058784|0.085623|0.072681|0.090970|0.123512|0.073521|0.061421|0.066463|0.123081|0.195218|0.500000| |4.834397|6.905724|5.057761|7.281859|6.465094|5.647670|8.384648|10.566184|3.671706|3.679222|7.788058|4.005182|2.675242|0.077506|2.224103|2.218951|3.445809|1.925595|1.827451|1.610001|1.580871|3.090642|2.660292|2.772940|2.507814|2.325894|4.249534|8.906994|17.759154|8.981021|5.626857|4.985022|5.675844|4.085939|3.802344|3.213012|3.793232|0.113950|0.137064|0.115083|0.212138|0.092505|0.089421|0.058897|0.056996|0.052995|0.041880|0.040768|0.082346|0.067450|0.059126|0.500000| |3.355731|4.086642|3.416341|5.526253|4.259308|3.344763|5.313797|5.413817|2.669743|2.800263|5.885609|3.248746|2.296044|0.068352|1.949522|1.889469|2.826271|1.661740|1.566624|1.409522|1.404380|2.735027|2.294802|2.461384|2.229477|2.023329|3.639599|5.657722|9.019081|17.727293|8.886989|5.679936|4.989859|6.968002|6.532531|4.502738|6.528420|0.080247|0.096802|0.087892|0.109750|0.067710|0.068161|0.052822|0.050546|0.044656|0.036779|0.036712|0.075471|0.061368|0.051513|0.219963|0.500000| |3.804283|4.102469|3.728200|7.003281|4.093553|2.828675|4.311041|4.440594|2.612869|2.620110|5.146735|3.103130|2.152337|0.065121|1.912321|1.892561|2.810568|1.697766|1.619186|1.464974|1.451474|2.798520|1.996182|2.015325|1.787134|1.686270|3.166119|5.658484|4.985797|5.677790|8.880447|17.764579|9.029479|6.799121|4.898165|7.589318|4.876921|0.087679|0.103038|0.117339|0.084123|0.064021|0.072197|0.053747|0.048470|0.046231|0.038421|0.037955|0.060509|0.047723|0.043185|0.108145|0.124087|0.500000| |6.570203|6.970991|6.261551|12.342716|5.916644|3.862104|5.534583|6.252971|3.522913|3.293037|6.272656|3.737731|2.453283|0.072831|2.167617|2.221900|3.413898|1.980509|1.910686|1.692772|1.647692|3.180619|2.221876|2.175281|1.920833|1.849217|3.541872|8.904636|5.674740|4.991662|5.632970|8.982528|17.748386|4.055862|3.385215|3.928728|3.373755|0.138721|0.156665|0.230451|0.111447|0.083616|0.099002|0.060136|0.054033|0.055632|0.044319|0.042460|0.063868|0.050416|0.047370|0.124272|0.108202|0.220567|0.500000| |2.541863|2.955270|2.828398|5.046395|3.469170|2.481122|3.981280|3.672623|2.341805|2.565175|5.326556|3.127552|2.322169|0.072404|2.010793|1.885724|2.729949|1.662738|1.542674|1.407159|1.428672|2.797570|2.246659|2.405764|2.108455|1.901123|3.474922|3.791027|4.259963|5.648358|6.905310|5.359389|4.129128|8.745348|17.554867|6.918157|5.489185|0.062530|0.069434|0.071444|0.070770|0.058442|0.062419|0.056540|0.051887|0.043108|0.036550|0.037730|0.076101|0.057553|0.047951|0.102430|0.154278|0.141044|0.098322|0.500000| |2.224777|2.493791|2.332703|4.115099|2.908258|2.129029|3.479287|3.169443|1.965497|2.109307|4.272337|2.608886|1.936107|0.059028|1.708679|1.614353|2.320621|1.446118|1.354519|1.247626|1.264500|2.449625|1.907080|2.047931|1.849758|1.675932|3.017758|3.101887|3.526923|4.674380|5.496770|4.219406|3.317206|8.769296|17.534900|7.066835|6.910290|0.055213|0.062303|0.062254|0.062781|0.050066|0.052446|0.047844|0.044729|0.037883|0.032644|0.033590|0.063657|0.051287|0.042839|0.087735|0.138691|0.114311|0.080528|0.300987|0.500000| |2.531926|2.955864|2.713182|4.649300|3.411513|2.545577|4.142766|3.831854|2.267736|2.461948|5.136695|2.978647|2.196924|0.066975|1.889925|1.783987|2.598235|1.575795|1.469960|1.339836|1.354345|2.642796|2.192423|2.390529|2.145135|1.918181|3.437426|3.789354|4.699258|6.791154|6.847176|4.709002|3.812342|8.696003|17.573051|5.513928|6.871509|0.062367|0.070947|0.069161|0.075866|0.057546|0.059264|0.052194|0.049320|0.041274|0.034904|0.035747|0.075224|0.059574|0.048637|0.117507|0.227810|0.116196|0.088737|0.302017|0.302032|0.500000| |2.770595|2.896205|2.621831|4.767322|3.079712|2.209135|3.501559|3.412365|2.020567|2.050153|4.003456|2.499819|1.777634|0.053358|1.601525|1.568440|2.285634|1.426342|1.363486|1.253034|1.248872|2.388175|1.691826|1.737731|1.573055|1.475612|2.718625|3.690581|3.705569|4.584125|6.730452|6.685669|4.588209|8.712301|5.510543|17.554092|6.941308|0.066570|0.078669|0.081986|0.067386|0.051008|0.055379|0.045023|0.041360|0.038663|0.033069|0.032998|0.052217|0.042728|0.038117|0.086297|0.113617|0.230402|0.115084|0.140639|0.142909|0.122314|0.500000| |2.309123|2.471296|2.294483|4.149297|2.776682|2.001328|3.228891|3.019696|1.861352|1.933797|3.806413|2.392840|1.739200|0.052548|1.567169|1.510433|2.175581|1.372100|1.301584|1.203168|1.209930|2.319751|1.674222|1.744974|1.582108|1.468297|2.681418|3.068340|3.228828|4.073112|5.465298|4.795787|3.555960|8.829259|7.048790|17.553945|7.058484|0.056759|0.065056|0.066791|0.059785|0.047293|0.050716|0.044205|0.040779|0.036603|0.031691|0.032142|0.052981|0.043336|0.037865|0.077913|0.108772|0.148053|0.089220|0.171553|0.215640|0.143228|0.302309|0.500000| |2.652205|2.890655|2.739717|5.083417|3.224816|2.263188|3.583910|3.409053|2.155514|2.248813|4.452743|2.755446|1.990049|0.060936|1.781638|1.717524|2.488255|1.547023|1.460708|1.340450|1.347611|2.600172|1.876109|1.934677|1.720939|1.600733|2.965970|3.686206|3.703495|4.580837|6.723618|6.688625|4.585686|8.713136|6.949277|17.557213|5.511414|0.064407|0.072791|0.078218|0.065858|0.053771|0.059220|0.050591|0.045756|0.041097|0.035137|0.035626|0.059007|0.046532|0.040967|0.086350|0.113611|0.231755|0.115333|0.206664|0.174468|0.140655|0.300832|0.302350|0.500000| |2.684458|2.961523|2.547067|4.297236|3.166617|2.433804|3.958814|3.835161|2.047709|2.111108|4.242423|2.543853|1.821048|0.053933|1.600454|1.554358|2.280245|1.398120|1.330234|1.216428|1.213710|2.333389|1.812789|1.926932|1.780914|1.636218|2.929345|3.791578|4.698995|6.796078|6.848124|4.701734|3.809860|8.695727|6.869402|5.514083|17.571611|0.065256|0.079294|0.072966|0.079348|0.052775|0.053808|0.043918|0.041928|0.037775|0.032021|0.032023|0.058327|0.049487|0.042294|0.117177|0.227640|0.115836|0.088479|0.140177|0.170084|0.204427|0.140574|0.143315|0.122325|0.500000| |2.324169|2.496786|2.225747|3.867655|2.753866|2.063117|3.369565|3.171024|1.818788|1.878697|3.721667|2.305367|1.667167|0.049621|1.488429|1.440362|2.088444|1.306849|1.244210|1.147403|1.149188|2.200221|1.644392|1.737157|1.603789|1.480430|2.660782|3.102583|3.526556|4.675868|5.496139|4.212921|3.314764|8.768441|6.912107|7.064116|17.536215|0.057149|0.067629|0.064931|0.064678|0.046868|0.048597|0.041306|0.039064|0.035157|0.030278|0.030483|0.052539|0.044506|0.038371|0.087599|0.138680|0.113929|0.080317|0.140889|0.207464|0.170229|0.174078|0.215878|0.142955|0.302093|0.500000| 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