Version2.0 2020-02-15T23:32:10Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 26-Dec-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC(C)C[NH+](Cc1c(nn(c1Oc2ccc(cc2F)F)C)c3ccccc3)C[C@@H](COC(C)(C)C)O C36316112 RHF 6-31G(d) (6D,7F) CC(C)C[NH+](Cc1c(nn(c1Oc2ccc(cc2F)F)C)c3ccccc3)C[C@@H](COC(C)(C)C)O C01[X(C28H38F2N3O3)] 216 C1 616 Fc1ccc(c(c1)F)Oc1n(C)nc(c1C[NH+](C[C@@H](COC(C)(C)C)O)CC(C)C)c1ccccc1 Fc1ccc(c(c1)F)Oc1n(C)nc(c1C[NH+](C[C@@H](COC(C)(C)C)O)CC(C)C)c1ccccc1 CC(C)C[NH+](C[C@H](O)COC(C)(C)C)Cc1c(Oc2ccc(F)cc2F)n(C)nc1c3ccccc3 InChIKey=BCRMIDXPHJGWTF-QFIPXVFZSA-O InChI=1S/C28H37F2N3O3/c1-19(2)15-33(16-22(34)18-35-28(3,4)5)17-23-26(20-10-8-7-9-11-20)31-32(6)27(23)36-25-13-12-21(29)14-24(25)30/h7-14,19,22,34H,15-18H2,1-6H3/p+1/t22-/m0/s1 InChI=1/C28H37F2N3O3/c1-19(2)15-33(16-22(34)18-35-28(3,4)5)17-23-26(20-10-8-7-9-11-20)31-32(6)27(23)36-25-13-12-21(29)14-24(25)30/h7-14,19,22,34H,15-18H2,1-6H3/p+1/t22-/m0/s1/fC28H38F2N3O3/h33H/q+1 CC(C)C[NH+](Cc1c(nn(c1Oc2ccc(cc2F)F)C)c3ccccc3)C[C@@H](COC(C)(C)C)O C01[X(C28H38F2N3O3)] 216 C01 616 Fc1ccc(c(c1)F)Oc1n(C)nc(c1C[NH+](C[C@@H](COC(C)(C)C)O)CC(C)C)c1ccccc1 CC(C[NH](Cc1c(nn(c1Oc1ccc(cc1F)F)C)c1ccccc1)C[C@@H](COC(C)(C)C)O)C CC(C)C[NH](C[C@H](O)COC(C)(C)C)Cc1c(Oc2ccc(F)cc2F)n(C)nc1c3ccccc3 InChIKey=GFQGNBIUPKVACT-QFIPXVFZSA-N InChI=1S/C28H38F2N3O3/c1-19(2)15-33(16-22(34)18-35-28(3,4)5)17-23-26(20-10-8-7-9-11-20)31-32(6)27(23)36-25-13-12-21(29)14-24(25)30/h7-14,19,22,33-34H,15-18H2,1-6H3/t22-/m0/s1 InChI=1/C28H38F2N3O3/c1-19(2)15-33(16-22(34)18-35-28(3,4)5)17-23-26(20-10-8-7-9-11-20)31-32(6)27(23)36-25-13-12-21(29)14-24(25)30/h7-14,19,22,33-34H,15-18H2,1-6H3/t22-/m0/s1 4106.6632229001 -1669.0086273 1-A 20879.0664 134 482 616 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2250.88 2263.67 2270.68 2279.31 2284.25 2297.87 2313.93 2316.42 2320.79 2334.08 2335.58 2343.45 2344.67 2346.78 2349.11 2355.30 2360.49 2365.66 2367.68 2369.08 2371.85 2374.12 2376.47 2385.29 2393.69 2396.08 2410.32 2432.17 2443.12 2467.26 2530.74 2564.62 2608.19 2612.09 2637.15 4612.54 4617.42 4617.49 4620.47 4625.57 4626.21 4632.76 4638.33 4681.00 4681.88 4698.11 4708.66 4712.74 4714.56 4719.98 4725.56 4728.62 4731.77 4733.58 4741.81 4743.49 4744.89 4753.76 4801.22 4809.21 4830.30 4836.88 4837.59 4843.59 4850.82 4865.17 4879.03 4885.99 4891.13 4916.05 4924.31 5334.72 5848.03 0.677411 0.712477 0.713421 0.603161 -1668.331217 -1668.296150 -1668.295206 -1668.405466 3.698139D-04 MUNgauss RevisionA2.0 retrievium 15-Feb-2020 DUDE CC(C)C[NH+](Cc1c(nn(c1Oc2ccc(cc2F)F)C)c3ccccc3)C[C@@H](COC(C)(C)C)O C36316112 RHF 6-31G(d) (6D,10F) C1 502.288124 |X|Y|Z| 110.086996 75.157835 55.778168 77.278410 18 6 7 8 15 2 1 |36.858105| |12.426239|36.858105| |7.545806|12.415543|36.858105| |7.465295|12.431174|7.707268|36.858105| |6.176911|7.406042|4.924808|12.622001|53.358707| |7.242176|7.147417|4.677488|9.363301|25.718850|0.500000| |4.979493|6.018690|4.222932|7.564896|17.141012|0.257486|36.858105| |4.025232|4.295852|3.240308|4.966170|10.389348|0.201561|12.774378|36.858105| |3.116835|3.308496|2.664916|3.837949|7.250468|0.139141|7.165625|13.376022|36.858105| |2.826009|2.871314|2.351891|3.193951|5.747433|0.117868|5.148662|8.496516|14.624942|53.358707| |3.167189|3.089464|2.477788|3.313849|5.978957|0.130704|5.248920|8.695680|8.982895|19.377599|53.358707| |4.015032|3.917652|2.982455|4.174336|7.977813|0.180344|7.490319|13.892187|8.699272|11.809212|19.536939|36.858105| |4.791458|4.285612|3.196192|4.212222|7.483765|0.185446|6.226153|7.822742|5.430581|7.462958|11.040572|14.218858|73.516695| |4.318491|3.872995|3.005574|3.566315|5.740370|0.133133|4.890847|5.604940|4.304617|6.017179|8.238339|8.061115|24.513772|36.858105| |3.517765|3.375647|2.720761|3.146048|4.947407|0.107724|4.473755|5.171671|4.244730|5.963781|7.646102|6.670945|13.833671|13.812557|36.858105| |3.083743|2.948980|2.480581|2.684017|4.017314|0.086516|3.477249|3.781360|3.272634|4.593348|5.516453|4.492340|9.163424|7.947645|13.717247|36.858105| |3.140344|2.884632|2.465249|2.556430|3.728221|0.081693|3.066386|3.226727|2.786852|3.901143|4.670907|3.812816|8.214738|6.940282|7.999009|13.852852|36.858105| |3.662140|3.169530|2.667602|2.759952|4.020620|0.090907|3.178286|3.308330|2.791948|3.898784|4.770285|4.000652|9.347554|7.914421|6.846082|7.896909|13.783132|36.858105| |4.443251|3.710373|2.968020|3.264028|4.944436|0.116233|3.884083|4.124911|3.328079|4.641590|5.962173|5.317606|14.470064|13.757030|7.979570|6.915346|8.071507|13.875253|36.858105| |5.067679|3.875281|3.097711|3.402013|5.100712|0.125080|3.711716|3.844310|3.116401|4.317243|5.450934|4.823308|12.951016|8.184576|5.315123|4.672775|5.329222|8.167683|14.407555|97.533100| |2.681015|2.494613|2.207493|2.216274|3.163193|0.068370|2.562962|2.655857|2.359664|3.296044|3.812515|3.024909|6.222755|4.686192|5.311244|8.185020|14.428578|8.200205|5.349336|9.209482|97.533100| |2.770576|2.622889|2.165491|2.728082|4.629282|0.102786|3.808697|5.270725|5.447796|10.731029|17.862769|7.591409|11.358031|5.517362|5.168900|3.993805|3.476815|3.557941|4.319260|8.905272|6.454264|36.858105| |2.703270|2.959301|2.483603|3.512373|6.187698|0.112911|5.704318|7.269934|12.845432|10.698756|7.326363|5.222950|6.861423|3.266249|3.294016|2.698940|2.338306|2.320528|2.668784|5.699101|4.586342|3.951388|36.858105| |2.381148|2.554104|2.199273|3.026679|5.152837|0.096600|4.247146|5.112141|7.655312|8.669686|6.131206|4.150784|5.756086|2.762179|2.744038|2.310931|2.046887|2.048273|2.332551|5.082149|4.071849|3.581978|13.683669|36.858105| |2.110451|2.287255|2.027539|2.692566|4.338011|0.080743|3.484157|3.861375|5.062139|5.989763|4.636108|3.223214|4.705189|2.327480|2.334607|2.021376|1.808567|1.800616|2.012087|4.397601|3.655196|2.857375|7.909026|13.760471|36.858105| |2.068447|2.291833|2.060085|2.682559|4.179279|0.076378|3.431446|3.607469|4.463469|5.129252|4.128135|2.968308|4.411507|2.228226|2.269905|1.988343|1.773915|1.749584|1.933278|4.191404|3.608812|2.551768|6.840187|7.930922|13.741589|36.858105| |2.265883|2.566876|2.284797|2.997846|4.668172|0.083567|4.066727|4.163673|5.046511|5.465688|4.437063|3.290753|4.847897|2.466086|2.550665|2.218022|1.952139|1.908557|2.109951|4.512915|3.949854|2.674060|7.901563|6.872792|7.943544|13.751057|36.858105| |2.612111|2.963702|2.540158|3.482662|5.736563|0.101581|5.465756|5.889350|7.610050|7.276530|5.693731|4.300086|6.025464|3.003823|3.116499|2.619962|2.263041|2.212077|2.489621|5.263533|4.492833|3.239902|13.686179|7.937326|6.881278|7.937745|13.752621|36.858105| |4.383316|4.917723|3.855755|7.657875|17.159901|0.259186|7.582657|6.264616|5.307209|5.727928|5.556254|4.866343|7.652656|3.370222|2.992709|2.484943|2.311053|2.464825|2.952922|6.910679|4.502257|3.213496|4.955882|4.431278|3.723579|3.464024|3.690876|4.377615|36.858105| |4.132049|4.128637|3.342911|5.544557|10.436888|0.223117|5.255662|5.074139|4.514604|5.399479|5.441751|4.542482|7.470992|3.244356|2.801168|2.347717|2.227903|2.425307|2.928908|7.132104|4.350728|3.301058|4.066222|3.917378|3.295566|2.954327|3.011991|3.464772|12.527027|36.858105| |3.922229|3.780912|3.026505|4.721119|9.244451|0.214654|5.253428|5.711937|5.155299|6.441003|6.654885|5.427866|8.671701|3.605692|3.064635|2.522879|2.378299|2.597505|3.193648|7.768930|4.596567|3.983265|4.341528|4.188481|3.378270|2.954044|3.002051|3.528436|8.896174|17.520413|0.500000| |3.179685|3.216139|2.789946|4.123756|6.746604|0.136532|3.873126|3.825574|3.721956|4.589285|4.440887|3.469202|5.684215|2.602214|2.319292|1.994116|1.899864|2.041340|2.389880|5.764421|3.781403|2.813537|3.623776|3.775773|3.332744|2.934838|2.858148|3.123084|7.534798|12.520826|0.248609|36.858105| |2.963989|2.860512|2.517481|3.441860|5.428406|0.116465|3.223393|3.269216|3.176849|4.122477|4.113599|3.145840|5.333974|2.472010|2.182239|1.897925|1.834812|1.992757|2.324732|5.721878|3.669636|2.725475|3.014153|3.154664|2.807601|2.476456|2.404130|2.611357|5.169056|8.256601|0.206953|13.697190|73.516695| |2.446387|2.379423|2.161089|2.784151|4.214628|0.088640|2.621452|2.665393|2.659077|3.505813|3.452424|2.578350|4.381964|2.096222|1.885946|1.668753|1.619302|1.743275|1.991635|4.856091|3.281731|2.349707|2.597477|2.788385|2.573410|2.275357|2.166161|2.289609|3.842806|5.163244|0.134832|7.760670|23.605818|36.858105| |2.340538|2.319400|2.169457|2.720970|3.928326|0.080704|2.432293|2.391124|2.363086|3.057132|2.998123|2.273924|3.894616|1.896701|1.723010|1.540841|1.500095|1.607867|1.814909|4.404756|3.064261|2.030315|2.358411|2.505396|2.383276|2.164777|2.066076|2.143987|3.551619|4.401332|0.108474|6.357383|13.891833|12.459863|36.858105| |2.333047|2.203456|2.011448|2.483777|3.710693|0.080105|2.342099|2.402988|2.370992|3.204948|3.238671|2.403355|4.191965|2.030973|1.814917|1.621453|1.593427|1.730660|1.967818|4.867066|3.242964|2.274413|2.265042|2.393067|2.200514|1.965056|1.890776|2.008658|3.175916|4.174407|0.114841|5.198106|14.561419|12.490356|7.594866|36.858105| |2.168948|2.142633|1.943484|2.496803|3.842614|0.079444|2.495571|2.607329|2.713384|3.626303|3.465911|2.508546|4.154345|2.000105|1.830792|1.620080|1.555799|1.652460|1.875000|4.482583|3.161904|2.371232|2.719134|3.051300|2.852903|2.452709|2.268534|2.364315|3.509773|4.397319|0.121093|6.318599|13.924153|12.461008|7.545937|7.597588|36.858105| |5.070067|4.710086|3.815767|6.055183|9.693858|0.232849|4.668331|4.264550|3.632612|4.473551|4.725289|4.044247|7.277940|3.237277|2.729715|2.326864|2.265044|2.524250|3.055183|7.759448|4.433885|2.983899|3.243391|3.072578|2.670639|2.469341|2.551624|2.895375|8.145407|13.603353|0.259044|7.914204|12.591736|4.713216|4.238370|4.134003|3.760426|73.516695| |17.579766|8.832009|7.024437|5.472718|6.321414|0.144712|4.091450|3.440484|2.741450|3.446621|3.868642|3.508333|7.522343|4.111316|3.414327|3.115950|3.282364|3.880903|4.490096|11.463215|6.396458|2.554449|2.401054|2.127783|1.906465|1.880926|2.059026|2.347016|3.518039|3.354398|0.090008|2.699359|4.555001|2.169961|2.089016|2.100443|1.941566|7.086489|0.500000| |17.549658|8.655755|5.459997|6.573912|9.037296|0.243382|5.549546|4.713336|3.515440|4.394977|5.121022|4.976976|11.494410|5.539834|4.186024|3.529485|3.577286|4.301165|5.660448|15.111119|6.640624|3.262725|2.927532|2.554727|2.219197|2.146969|2.350934|2.762503|4.586096|4.434238|0.122911|3.303989|5.513969|2.525331|2.353629|2.421152|2.257639|9.392915|0.304387|0.500000| |17.553433|8.763987|6.752711|6.861239|7.717016|0.186134|4.303531|3.601234|2.890083|3.600859|3.986269|3.588163|7.391843|3.671399|3.023896|2.677057|2.737431|3.183856|3.804576|10.093879|5.353052|2.599922|2.548246|2.298596|2.050995|1.994026|2.147429|2.437286|4.396922|4.398384|0.112702|3.416819|5.772420|2.662280|2.567749|2.555931|2.301013|10.492267|0.301865|0.301295|0.500000| 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|5.473702|8.725707|17.553058|7.048754|6.267767|0.115706|4.129553|3.136930|2.630704|3.122794|3.223143|2.813446|5.193638|2.758883|2.569678|2.351952|2.300091|2.429597|2.668696|6.120835|4.675924|2.059191|2.515331|2.221873|2.076721|2.146253|2.403651|2.637940|3.741325|3.140551|0.078705|2.683328|4.240468|2.071420|2.098965|1.906558|1.887009|6.106831|0.142226|0.121799|0.138686|0.213227|0.300963|0.500000| |6.903515|8.812925|17.585927|5.559839|5.510842|0.110523|3.665971|2.929963|2.432182|2.974835|3.164985|2.773591|5.389881|2.955369|2.694662|2.518166|2.551563|2.767185|3.001474|7.013919|5.200742|2.067570|2.254192|2.002487|1.850754|1.881402|2.082681|2.306977|3.230548|2.888076|0.074467|2.445473|4.005583|1.959507|1.958624|1.852534|1.773191|5.821230|0.211571|0.141670|0.166624|0.215974|0.302042|0.302232|0.500000| |5.452743|8.764359|7.045293|17.596959|12.429247|0.182777|7.134972|4.643596|3.754571|4.171732|4.185672|3.762028|6.490255|3.185019|2.929662|2.531125|2.379960|2.505010|2.886004|6.584494|4.703141|2.531425|3.617916|3.094845|2.817018|2.887902|3.292436|3.763889|6.886142|4.749766|0.113387|3.800942|5.554932|2.598698|2.582779|2.293082|2.380172|8.540036|0.122843|0.136589|0.139899|0.212478|0.171545|0.213261|0.143238|0.500000| |6.824785|8.870059|7.057803|17.655011|12.487464|0.221721|5.599057|4.169748|3.396961|3.955544|4.089645|3.647355|6.592128|3.143254|2.757380|2.390001|2.312739|2.521027|2.957401|7.141510|4.564601|2.535147|3.163894|2.837992|2.556842|2.516832|2.731130|3.082902|7.521865|6.060177|0.134380|4.598716|6.831801|3.077677|3.070163|2.725951|2.675284|13.104503|0.141213|0.162426|0.205086|0.173971|0.209708|0.174579|0.142793|0.301038|0.500000| |5.656813|7.053645|4.701703|7.286045|12.402405|0.219973|17.672319|8.941107|5.562682|6.000212|6.457327|6.828000|11.573741|5.569112|5.124094|3.976735|3.497181|3.613640|4.410316|9.184689|6.483967|3.615924|4.518579|3.495119|2.963056|2.968962|3.516856|4.529179|5.589128|4.299412|0.119649|3.276926|5.038060|2.347218|2.199229|2.143404|2.219998|7.330967|0.131856|0.175688|0.126608|0.249587|0.110172|0.125769|0.116119|0.187467|0.145916|0.500000| |4.161325|5.268968|4.030270|6.871401|12.419000|0.181909|17.660716|8.885660|6.665029|6.344261|5.999088|5.580772|8.280449|3.927396|3.793743|3.079366|2.713656|2.751968|3.226865|6.925110|5.234078|3.311593|6.268406|4.533821|3.839152|3.950398|4.934656|6.770457|7.096315|4.692677|0.125498|3.704379|5.377500|2.515344|2.378402|2.216856|2.428898|7.274804|0.098103|0.121428|0.102843|0.160290|0.099169|0.115565|0.096504|0.212907|0.144859|0.302282|0.500000| |3.248939|3.249400|2.630802|3.148167|5.064963|0.106779|4.848265|5.969181|5.068218|7.106986|8.783356|7.345005|12.438821|8.924655|17.743409|8.928683|5.680128|4.940049|5.660396|9.614796|9.619007|5.512869|3.846491|3.106216|2.609746|2.544514|2.903968|3.643698|3.118744|2.855372|0.086980|2.378805|3.921094|1.908894|1.742512|1.814601|1.876696|4.801933|0.085825|0.105180|0.078552|0.103079|0.065850|0.070331|0.071264|0.083189|0.076130|0.149116|0.116519|0.500000| |2.692733|2.643228|2.274904|2.438715|3.613923|0.076233|3.147369|3.407123|3.063420|4.294416|4.934613|3.868723|7.381154|5.643726|8.864365|17.758098|8.967792|5.641128|4.977358|8.323687|16.694285|3.581933|2.597453|2.231152|1.975273|1.962247|2.196434|2.566934|2.279946|2.138383|0.063382|1.846212|3.114697|1.556062|1.444428|1.507488|1.523288|3.733102|0.075546|0.083410|0.065741|0.083450|0.057122|0.060876|0.064168|0.065108|0.060533|0.098471|0.079831|0.214028|0.500000| |3.461017|2.943482|2.548606|2.546157|3.625875|0.081900|2.781720|2.845447|2.442096|3.401571|4.068580|3.347462|7.574186|5.637251|4.941400|5.626608|8.878117|17.761015|8.939728|16.555649|16.595680|3.066318|2.071267|1.855846|1.648678|1.603095|1.734368|1.981097|2.257074|2.249168|0.066293|1.917214|3.364714|1.669664|1.548111|1.674316|1.574139|4.226029|0.104795|0.109613|0.085390|0.087220|0.065778|0.064121|0.074454|0.064202|0.065731|0.086649|0.067872|0.107362|0.124139|0.500000| |2.509351|2.388267|2.003988|2.526427|4.256135|0.093504|3.393178|4.553748|5.031795|10.078479|12.590459|5.842547|8.783131|4.249846|4.002708|3.263688|2.917081|2.995549|3.537860|7.596211|5.586326|17.662561|3.860534|3.702580|2.950770|2.570865|2.620868|3.106139|3.089173|3.256234|0.110125|2.868526|5.009866|2.460896|2.095023|2.388845|2.536794|5.143684|0.064164|0.080528|0.066695|0.067854|0.053483|0.053189|0.052939|0.065563|0.066338|0.087693|0.084052|0.118399|0.083331|0.073802|0.500000| |2.967670|2.713946|2.230690|2.763909|4.629969|0.106264|3.672436|4.805112|4.559999|7.917588|12.507106|7.136522|12.848187|6.278297|5.328044|4.164072|3.789778|4.065824|5.128121|10.813219|6.920747|17.653523|3.408922|3.107639|2.538396|2.294871|2.406720|2.875394|3.146890|3.315508|0.111204|2.788820|4.904259|2.364525|2.040345|2.332405|2.336024|5.520051|0.076426|0.098992|0.077511|0.077606|0.059086|0.058107|0.059560|0.069968|0.071870|0.099183|0.087152|0.144416|0.100151|0.097261|0.299728|0.500000| |2.540272|2.433605|2.037606|2.490579|4.105515|0.089275|3.455721|4.607851|4.823834|9.076842|12.401291|6.170892|9.607679|5.263971|5.490535|4.370892|3.677195|3.587589|4.144146|8.177239|6.878499|17.616073|3.665076|3.297470|2.696076|2.453553|2.593140|3.115016|2.823463|2.828427|0.091494|2.454425|4.210801|2.079228|1.827229|2.015566|2.107056|4.607419|0.066208|0.081834|0.065680|0.071232|0.053432|0.054209|0.054568|0.065132|0.063934|0.093482|0.085375|0.167591|0.111816|0.085232|0.299929|0.299268|0.500000| |2.350632|2.457160|2.110558|2.885453|4.952675|0.096093|3.921896|4.870461|7.104829|9.297109|6.549540|4.221635|5.872818|2.779384|2.712541|2.281155|2.038499|2.060165|2.361474|5.201849|4.047582|3.918195|8.918478|17.730982|8.912824|5.642137|4.953096|5.648354|4.306463|4.101603|0.127131|4.025794|6.125854|3.045924|2.650759|2.618705|3.418739|5.642401|0.058328|0.070754|0.063659|0.068609|0.056803|0.058450|0.053605|0.079894|0.076404|0.090718|0.110561|0.084127|0.060697|0.052002|0.117402|0.093637|0.097560|0.500000| |1.937668|2.072841|1.859584|2.417818|3.829462|0.072505|2.977240|3.273932|4.123416|5.167213|4.127328|2.840180|4.240761|2.110290|2.103542|1.842950|1.667011|1.666378|1.851880|4.081863|3.392534|2.632777|5.635791|8.932471|17.724512|8.912187|5.648059|4.956899|3.307616|3.056799|0.087002|3.214870|4.916413|2.606684|2.413788|2.224623|2.979196|4.445697|0.048874|0.056406|0.052849|0.057822|0.050359|0.052706|0.047361|0.069633|0.064910|0.071569|0.089103|0.064436|0.050047|0.042704|0.076920|0.065522|0.068983|0.215236|0.500000| |1.880992|2.079229|1.905045|2.405439|3.640060|0.067086|2.919652|3.006400|3.565662|4.246114|3.528993|2.543419|3.873836|1.982639|2.021007|1.799012|1.619532|1.596119|1.745897|3.799471|3.327366|2.238759|4.935661|5.643527|8.910127|17.726575|8.915045|5.646157|2.997722|2.608693|0.071764|2.644239|4.025752|2.122343|2.050243|1.840509|2.296104|3.954364|0.047899|0.053744|0.050659|0.058957|0.050942|0.055399|0.048566|0.072153|0.063432|0.071771|0.092358|0.062209|0.049561|0.040922|0.062874|0.056542|0.060206|0.124095|0.214810|0.500000| |2.163536|2.477497|2.250015|2.841466|4.249673|0.076192|3.677743|3.612728|4.109394|4.594667|3.885184|2.923682|4.430578|2.302375|2.404414|2.129312|1.880697|1.826396|1.992982|4.249258|3.842078|2.390340|5.632228|4.952580|5.646992|8.912200|17.724176|8.926164|3.264419|2.677852|0.073319|2.543981|3.851965|1.969407|1.905477|1.734406|2.041757|4.145558|0.055181|0.061604|0.056776|0.072606|0.058471|0.066684|0.057291|0.088147|0.071777|0.091604|0.124652|0.075459|0.059121|0.046295|0.064597|0.060524|0.065153|0.107540|0.124135|0.214821|0.500000| |2.783305|3.218594|2.735047|3.686905|5.950263|0.104764|6.142616|6.232110|7.010981|6.815125|5.683576|4.498141|6.393661|3.263052|3.468822|2.904995|2.470509|2.385331|2.672627|5.551331|4.882075|3.226701|8.887496|5.639876|4.956379|5.652028|8.939891|17.705745|4.192543|3.287860|0.092643|2.885339|4.347341|2.135667|2.012066|1.899671|2.164640|5.047413|0.069874|0.081677|0.070685|0.098137|0.069117|0.079404|0.069338|0.111871|0.088023|0.147502|0.220254|0.114540|0.079462|0.058845|0.083518|0.080461|0.087514|0.124071|0.107595|0.124310|0.216125|0.500000| |3.685986|4.131470|3.325240|5.831504|12.235644|0.195029|7.731049|7.163870|6.759940|6.761380|6.096325|5.129918|7.482030|3.318619|3.037501|2.502927|2.282644|2.387552|2.834925|6.455170|4.452228|3.414148|6.730716|5.882334|4.693649|4.255498|4.536801|5.584300|17.683806|8.838254|0.218726|6.637868|8.263120|3.614138|3.294977|2.976819|3.502059|10.329489|0.085249|0.108866|0.100125|0.109812|0.089369|0.091756|0.079400|0.159387|0.150830|0.150540|0.219031|0.090556|0.064507|0.060250|0.092043|0.089788|0.083517|0.153141|0.111501|0.098524|0.106637|0.140488|0.500000| |4.115196|4.839054|4.051884|7.886181|12.347389|0.190263|6.039507|4.816227|4.260599|4.713202|4.538216|3.868807|6.290564|2.909589|2.633801|2.244049|2.106037|2.233655|2.613065|6.116301|4.164547|2.721772|4.258018|3.918948|3.502093|3.367488|3.568676|4.013771|17.646312|8.827039|0.174000|7.011737|8.541235|3.742295|3.675975|3.051400|3.380052|12.585599|0.093221|0.113059|0.117145|0.118662|0.113557|0.112417|0.092189|0.218157|0.237454|0.133845|0.173307|0.075872|0.057799|0.057497|0.073153|0.074267|0.067857|0.103732|0.087541|0.082839|0.089874|0.107203|0.301845|0.500000| |2.832340|2.911094|2.534577|3.681676|6.132735|0.120847|3.786967|3.889352|4.024478|4.955724|4.590287|3.465808|5.477444|2.522980|2.291796|1.966738|1.851899|1.962756|2.282083|5.394555|3.693649|2.888337|4.087143|4.514306|3.969105|3.356279|3.165736|3.422345|6.800590|8.858320|0.216822|17.541667|16.409443|6.847983|5.549522|4.641313|6.932213|10.145397|0.067812|0.082433|0.082265|0.075064|0.071967|0.068791|0.062291|0.097552|0.108880|0.087838|0.103120|0.066331|0.050998|0.050929|0.083206|0.077619|0.070139|0.136904|0.107707|0.083218|0.076684|0.085157|0.194556|0.172874|0.500000| |3.115489|3.235415|2.897628|4.217175|6.376214|0.124282|3.630714|3.417836|3.291984|4.004249|3.868320|3.057284|5.084572|2.385428|2.148963|1.871068|1.790138|1.915953|2.213660|5.321809|3.591894|2.466620|3.300889|3.404555|3.130656|2.846385|2.781439|2.968219|6.963171|8.883757|0.174733|17.541916|16.471307|6.857533|7.001556|4.667488|5.482768|12.604602|0.073794|0.087045|0.094009|0.080161|0.085246|0.078337|0.069765|0.110672|0.136023|0.086654|0.099321|0.061103|0.048383|0.050283|0.069150|0.068009|0.060909|0.097290|0.084057|0.072410|0.069915|0.076781|0.165140|0.213518|0.299981|0.500000| |2.510949|2.465145|2.329199|2.875256|4.042784|0.083762|2.453752|2.368305|2.288378|2.947091|2.934401|2.262002|3.942127|1.925222|1.736105|1.557209|1.527182|1.648593|1.861670|4.565040|3.120403|1.986890|2.254449|2.340558|2.213644|2.041248|1.981498|2.070875|3.569882|4.430326|0.106711|5.909968|12.798828|8.805523|17.559699|6.879092|5.494041|8.200682|0.062151|0.069238|0.078080|0.061307|0.070482|0.062028|0.058255|0.074887|0.092347|0.062266|0.066185|0.048384|0.040396|0.044307|0.056294|0.056039|0.049744|0.068037|0.061427|0.053633|0.051160|0.054685|0.089134|0.104028|0.134589|0.188350|0.500000| |2.076885|2.053542|1.942777|2.358986|3.375241|0.069391|2.140604|2.119151|2.112465|2.763957|2.708493|2.032684|3.492704|1.724459|1.578488|1.424045|1.390306|1.484697|1.659427|4.012173|2.859473|1.860432|2.118901|2.263917|2.182874|1.990794|1.888668|1.940281|2.962193|3.537975|0.090139|4.731717|10.061755|8.840818|17.574192|6.990745|6.784706|6.112023|0.052217|0.057970|0.062863|0.052306|0.057617|0.052407|0.049259|0.062726|0.072883|0.054332|0.058382|0.044311|0.037249|0.039888|0.053571|0.051908|0.046881|0.066556|0.062124|0.052943|0.048685|0.050650|0.077782|0.084831|0.121933|0.140305|0.301342|0.500000| |2.327232|2.364414|2.220345|2.829561|4.070449|0.081507|2.527895|2.458558|2.450677|3.117942|3.008284|2.287846|3.865090|1.883250|1.725861|1.540416|1.488964|1.583813|1.784605|4.282078|3.041811|2.009116|2.502820|2.680254|2.591432|2.362995|2.236825|2.293044|3.788537|4.472782|0.107486|6.715425|12.098626|8.720200|17.561016|5.492619|6.920122|7.337386|0.057517|0.064640|0.070159|0.059849|0.065773|0.060485|0.055238|0.076083|0.088493|0.062901|0.069887|0.048860|0.040277|0.042161|0.057405|0.055489|0.050457|0.077720|0.073055|0.062404|0.057244|0.059295|0.098816|0.112488|0.170750|0.229261|0.300455|0.303080|0.500000| |2.343852|2.189028|1.970938|2.444004|3.729150|0.081666|2.387625|2.508292|2.488866|3.434850|3.504619|2.560092|4.465169|2.150914|1.912177|1.701387|1.671065|1.819954|2.080674|5.158664|3.387866|2.500686|2.337962|2.472455|2.238057|1.978870|1.906384|2.044987|3.144831|4.163292|0.121278|4.888207|13.244736|8.831300|5.515269|17.574755|6.952111|7.194373|0.058718|0.068769|0.070569|0.056330|0.057204|0.051714|0.050708|0.062346|0.073224|0.060716|0.062107|0.053038|0.043806|0.048797|0.073925|0.071632|0.060922|0.076402|0.062767|0.051159|0.048335|0.053713|0.082959|0.081661|0.125111|0.116254|0.141123|0.141744|0.122819|0.500000| |2.066881|1.967471|1.821623|2.194536|3.231220|0.068950|2.078688|2.130498|2.123386|2.881489|2.890632|2.127530|3.706746|1.825358|1.650284|1.488502|1.464677|1.580452|1.774819|4.352527|3.004906|2.050119|2.055425|2.187256|2.046006|1.836066|1.754765|1.841327|2.731445|3.413934|0.093818|4.186178|10.286726|8.814831|6.870203|17.576000|6.889587|5.991454|0.052330|0.059177|0.062435|0.050545|0.053402|0.048294|0.046913|0.057020|0.066423|0.053225|0.055222|0.045902|0.038682|0.042645|0.060002|0.058110|0.051079|0.066182|0.058081|0.048261|0.044964|0.048352|0.072178|0.073935|0.108434|0.108790|0.167911|0.207896|0.140813|0.300783|0.500000| |2.486277|2.311850|2.123850|2.579297|3.775616|0.082425|2.344666|2.364396|2.281746|3.062949|3.143081|2.375604|4.228623|2.056657|1.822286|1.634296|1.620375|1.775624|2.019760|5.066391|3.299538|2.205534|2.159540|2.235589|2.054158|1.861544|1.815343|1.936867|3.159461|4.154250|0.111722|4.889473|13.175337|8.825609|6.965387|17.567229|5.514298|7.877721|0.062211|0.071041|0.077157|0.058277|0.063092|0.055368|0.054385|0.065377|0.079867|0.060234|0.061248|0.050155|0.042031|0.048026|0.063370|0.063620|0.054449|0.066974|0.057042|0.048449|0.046586|0.051454|0.080233|0.085057|0.115757|0.126391|0.207399|0.174268|0.140940|0.300983|0.301019|0.500000| |2.159887|2.179451|1.980486|2.581973|3.981090|0.080331|2.603396|2.701254|2.855806|3.739281|3.490109|2.532628|4.125759|1.987303|1.836899|1.621644|1.545139|1.628178|1.843949|4.358590|3.140436|2.343014|2.955196|3.395409|3.241069|2.758564|2.505028|2.574010|3.744836|4.478882|0.120090|6.689325|12.148722|8.723910|6.909838|5.493956|17.558834|6.553491|0.053554|0.062121|0.063107|0.056818|0.056770|0.054001|0.049886|0.069515|0.076449|0.063618|0.071662|0.052786|0.042547|0.042883|0.069255|0.063257|0.058192|0.104676|0.095209|0.071859|0.062211|0.064540|0.106434|0.101883|0.229737|0.167468|0.141356|0.168744|0.208325|0.140917|0.140915|0.122809|0.500000| |1.948094|1.921973|1.768120|2.201723|3.317938|0.068537|2.185852|2.273639|2.366387|3.188334|3.058110|2.204025|3.685384|1.804718|1.664268|1.488945|1.436264|1.520907|1.706769|4.071862|2.941745|2.127002|2.385184|2.668921|2.550688|2.222610|2.049556|2.109190|2.937438|3.535814|0.097367|4.717099|10.070163|8.836580|6.795901|6.974916|17.573314|5.608654|0.049020|0.055980|0.057365|0.050114|0.050999|0.047818|0.045162|0.058697|0.065371|0.054760|0.059410|0.047268|0.039070|0.040477|0.063247|0.058337|0.053146|0.082120|0.074862|0.058663|0.051775|0.053933|0.081445|0.079750|0.139657|0.121079|0.139076|0.199517|0.169589|0.173120|0.208018|0.141670|0.303089|0.500000| 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