Version2.1 2020-12-15T22:31:00Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 15-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC[NH+]1C[C@@H](C[C@H]1CN2CCC(CC2)C3=NC(=C(C3)c4ccncc4)c5ccc(cc5)F)O C52637463 RHF 6-31G(d) (6D,7F) CC[NH+]1C[C@@H](C[C@H]1CN2CCC(CC2)C3=NC(=C(C3)c4ccncc4)c5ccc(cc5)F)O C01[X(C27H34F1N4O1)] 195 C1 563 CC[NH+]1C[C@@H](C[C@H]1CN1CCC(CC1)C1=NC(=C(C1)c1ccncc1)c1ccc(cc1)F)O CC[NH+]1C[C@@H](C[C@H]1CN1CCC(CC1)C1=NC(=C(C1)c1ccncc1)c1ccc(cc1)F)O CC[NH+]1C[C@H](O)C[C@H]1CN2CCC(CC2)C3=NC(=C(C3)c4ccncc4)c5ccc(F)cc5 InChIKey=UGUWHCFCDSCFNF-BJKOFHAPSA-O InChI=1S/C27H33FN4O/c1-2-32-18-24(33)15-23(32)17-31-13-9-20(10-14-31)26-16-25(19-7-11-29-12-8-19)27(30-26)21-3-5-22(28)6-4-21/h3-8,11-12,20,23-24,33H,2,9-10,13-18H2,1H3/p+1/t23-,24+/m0/s1 InChI=1/C27H33FN4O/c1-2-32-18-24(33)15-23(32)17-31-13-9-20(10-14-31)26-16-25(19-7-11-29-12-8-19)27(30-26)21-3-5-22(28)6-4-21/h3-8,11-12,20,23-24,33H,2,9-10,13-18H2,1H3/p+1/t23-,24+/m0/s1/fC27H34FN4O/h32H/q+1 CC[NH+]1C[C@@H](C[C@H]1CN2CCC(CC2)C3=NC(=C(C3)c4ccncc4)c5ccc(cc5)F)O C01[X(C27H34F1N4O1)] 195 C01 563 CC[NH+]1C[C@@H](C[C@H]1CN1CCC(CC1)C1=NC(=C(C1)c1ccncc1)c1ccc(cc1)F)O CC[NH]1C[C@@H](C[C@H]1CN1CC[C@H](CC1)C1=NC(=C(C1)[C]1[CH][CH][N][CH][CH]1)[C]1[CH][CH][C]([CH][CH]1)F)O CC[NH]1C[C@H](O)C[C@H]1CN2CC[C@H](CC2)C3=NC(=C(C3)[C]4[CH][CH][N][CH][CH]4)[C]5[CH][CH][C](F)[CH][CH]5 InChIKey=YRNVIGDWCUIXSS-BJKOFHAPSA-N InChI=1S/C27H34FN4O/c1-2-32-18-24(33)15-23(32)17-31-13-9-20(10-14-31)26-16-25(19-7-11-29-12-8-19)27(30-26)21-3-5-22(28)6-4-21/h3-8,11-12,20,23-24,32-33H,2,9-10,13-18H2,1H3/t23-,24+/m0/s1 InChI=1/C27H34FN4O/c1-2-32-18-24(33)15-23(32)17-31-13-9-20(10-14-31)26-16-25(19-7-11-29-12-8-19)27(30-26)21-3-5-22(28)6-4-21/h3-8,11-12,20,23-24,32-33H,2,9-10,13-18H2,1H3/t23-,24+/m0/s1 3209.3716405222 -1434.1118328 1-A 26134.2023 120 443 563 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4642.87 4659.11 4661.29 4664.08 4679.55 4683.28 4697.93 4710.72 4717.59 4730.82 4736.91 4738.49 4764.20 4797.93 4816.39 4823.07 4832.94 4841.16 4852.11 4873.47 4880.72 4883.31 4897.54 4903.95 4905.88 5340.03 5904.90 0.621498 0.649635 0.650579 0.557469 -1433.490335 -1433.462198 -1433.461254 -1433.554364 3.122925D-04 MUNgauss RevisionA2.0 retrievium 15-Dec-2020 DUDE CC[NH+]1C[C@@H](C[C@H]1CN2CCC(CC2)C3=NC(=C(C3)c4ccncc4)c5ccc(cc5)F)O C52637463 RHF 6-31G(d) (6D,10F) C1 449.271665 |X|Y|Z| 145.506334 62.501893 32.479532 66.598065 29 6 7 25 4 |36.858105| |12.534697|36.858105| |7.554514|12.626168|53.358707| |7.212801|9.352729|25.747221|0.500000| |4.922977|7.573575|17.133646|0.256706|36.858105| |4.126899|5.740428|10.845543|0.166466|12.501447|36.858105| |3.365225|4.413254|7.755556|0.132116|8.794564|17.597484|0.500000| |4.221620|5.286169|10.671883|0.173109|8.056107|12.534924|0.242614|36.858105| |6.096611|7.431790|16.829221|0.253439|7.767161|7.907702|0.156949|12.445658|36.858105| |6.703478|7.676299|12.341250|0.189183|6.154081|6.660105|0.136048|8.854776|17.683548|0.500000| |5.319539|5.366537|10.272623|0.216427|5.319153|5.089279|0.116093|7.402808|12.438119|0.243650|36.858105| |4.044662|4.007009|6.833070|0.137030|4.068219|4.296641|0.103058|6.381866|7.817322|0.191852|13.216908|53.358707| |3.248830|3.192449|5.315251|0.112117|3.367436|3.465787|0.087617|4.713381|5.157397|0.126548|7.857850|17.734934|36.858105| |2.676609|2.643958|4.216821|0.086433|2.792949|2.983374|0.077558|3.908847|3.968825|0.103272|5.066655|10.544152|12.499487|36.858105| |2.648038|2.542466|3.877243|0.078344|2.525357|2.702150|0.069478|3.436459|3.621685|0.100231|4.419954|8.872384|7.553959|12.446471|36.858105| |3.085079|2.947957|4.432013|0.086835|2.816281|3.077531|0.077055|3.997408|4.350513|0.127772|5.067772|10.538148|6.586636|7.616235|12.380679|36.858105| |4.036220|3.752511|5.754853|0.113057|3.410198|3.614337|0.087003|4.872972|6.060687|0.179715|7.875503|17.771604|7.895587|6.591222|7.537171|12.491229|36.858105| |2.220263|2.157777|3.230998|0.064825|2.170854|2.348966|0.061689|2.877020|2.911782|0.081394|3.325127|6.027103|4.921600|7.543772|12.636640|7.591551|4.933264|36.858105| |2.043815|2.029031|3.063522|0.061218|2.111825|2.316957|0.061967|2.814676|2.734644|0.075461|3.039322|5.360709|4.390677|6.684870|7.806234|5.684308|4.077904|15.078589|53.358707| |1.803054|1.785298|2.643849|0.052792|1.838684|2.007205|0.054084|2.360426|2.297746|0.064118|2.492906|4.180257|3.319376|4.484384|5.230431|4.284656|3.238591|8.736509|18.179992|36.858105| |1.783756|1.738337|2.534098|0.050729|1.740784|1.877606|0.050140|2.188028|2.184489|0.061747|2.378403|3.940593|3.084753|3.993144|5.029093|4.215064|3.179355|8.223765|11.328885|14.234615|36.858105| |2.024227|1.940260|2.827940|0.056794|1.900265|2.033320|0.053463|2.410025|2.474833|0.070419|2.764287|4.708157|3.691964|4.847682|7.156732|5.645095|3.995589|12.656098|11.235978|8.326363|12.641251|36.858105| |1.596885|1.551633|2.231212|0.044732|1.540580|1.649176|0.044213|1.880666|1.884043|0.053471|2.024539|3.244207|2.506106|3.063881|3.683958|3.268753|2.609871|5.079743|6.932644|7.436702|12.877167|7.282469|36.858105| |1.450407|1.415597|2.038635|0.041077|1.420180|1.511737|0.040848|1.706286|1.698831|0.047767|1.823452|2.874003|2.248908|2.710271|3.090352|2.719553|2.253537|4.036064|5.759956|5.930008|7.591934|5.085337|13.693537|36.858105| |1.334499|1.299986|1.855076|0.037391|1.295348|1.372040|0.037120|1.529013|1.527426|0.043086|1.625780|2.517286|1.947174|2.277001|2.564683|2.324478|1.975131|3.169558|4.424487|4.182320|5.061988|3.893385|7.968150|13.772438|36.858105| |1.323752|1.283667|1.814928|0.036485|1.263192|1.336596|0.036032|1.481847|1.489818|0.042368|1.575234|2.423331|1.845344|2.123382|2.421706|2.255919|1.926714|2.927343|3.974811|3.620782|4.455115|3.648912|6.810789|7.981949|14.417671|53.358707| |1.427032|1.377668|1.940527|0.038858|1.341693|1.424305|0.038170|1.586649|1.604405|0.046012|1.693965|2.624179|1.974631|2.276039|2.668939|2.529117|2.126364|3.252363|4.299697|3.898298|5.066978|4.241489|7.960514|7.065244|8.449870|19.653917|36.858105| |1.578931|1.523774|2.160570|0.043162|1.485567|1.586706|0.042343|1.792371|1.813210|0.052104|1.927154|3.046172|2.294329|2.709341|3.289984|3.087502|2.501309|4.223378|5.482073|5.165876|7.619239|6.009118|13.694764|8.031721|7.073027|10.874131|13.761436|36.858105| |1.636762|1.642962|2.434678|0.048520|1.727393|1.896366|0.051918|2.189493|2.083317|0.057741|2.213581|3.604015|2.837463|3.653082|3.885228|3.369809|2.703175|5.377489|10.465531|12.876990|7.420183|5.074595|5.806181|5.480275|4.046523|4.659135|3.507288|4.282493|36.858105| |1.605878|1.627682|2.441469|0.048889|1.753587|1.923468|0.053275|2.217222|2.076375|0.056597|2.211760|3.568028|2.871378|3.679752|3.613160|3.094521|2.575577|4.610993|8.902534|7.671272|5.125654|4.057128|4.208135|4.210117|3.313421|3.843817|2.829986|3.298660|13.674017|36.858105| |1.466933|1.497546|2.236074|0.044733|1.628329|1.785779|0.050040|2.015717|1.870577|0.050929|1.960187|3.079081|2.438935|2.972788|2.882299|2.565459|2.206115|3.464509|6.080144|5.062814|3.863907|3.161984|3.448505|3.586166|2.991309|3.501468|2.527160|2.829971|7.881532|13.775932|36.858105| |1.378455|1.405147|2.072709|0.041286|1.510497|1.657905|0.046424|1.846590|1.721700|0.047375|1.781234|2.767797|2.144419|2.555271|2.554101|2.341419|2.017767|3.062244|5.147425|4.490978|3.640181|2.925762|3.443173|3.638291|3.131705|3.688183|2.634971|2.889623|6.895502|8.022169|13.820893|36.858105| |1.395204|1.412696|2.065159|0.040991|1.491819|1.638726|0.045484|1.827714|1.722335|0.047946|1.777868|2.776384|2.123139|2.535858|2.632275|2.444314|2.070604|3.238159|5.366023|5.039008|4.204369|3.223928|4.132548|4.328956|3.703521|4.365808|3.137588|3.460769|7.883425|6.872316|7.901139|13.822481|36.858105| |1.513320|1.520593|2.224306|0.044134|1.586830|1.743565|0.047885|1.974521|1.879446|0.052590|1.960048|3.120440|2.392320|2.936501|3.155498|2.888696|2.367320|4.116013|7.026019|7.589470|6.007725|4.189860|5.673952|5.580975|4.368998|5.081709|3.775222|4.438099|13.679093|7.955161|6.870159|8.020168|13.772767|36.858105| |1.275426|1.305464|1.918752|0.038241|1.410261|1.543086|0.043516|1.692975|1.573896|0.043238|1.614790|2.466833|1.899315|2.204992|2.181874|2.029926|1.787940|2.530182|4.097667|3.420865|2.911805|2.430836|2.822020|3.004397|2.706164|3.248395|2.299523|2.454035|4.658126|5.316040|8.173348|14.356157|8.171767|5.314749|97.533100| |4.237681|5.924714|8.924186|0.136470|7.935831|13.604473|0.256338|8.051834|6.579946|0.187895|4.321367|5.179239|3.039956|2.699648|2.553415|2.993348|3.464184|2.253077|3.004590|1.942433|1.837798|1.988233|1.628047|1.484146|1.355027|1.812186|1.427327|1.586488|1.832957|1.830044|1.703392|1.603869|1.604299|1.708819|3.363550|73.516695| |17.600908|8.738921|9.107566|0.172777|4.451759|4.028007|0.091137|4.399726|6.624475|0.224213|5.996796|6.391036|3.614893|2.974409|3.015601|3.642397|4.990531|2.484565|3.064359|1.972128|1.962031|2.261023|1.743553|1.567621|1.435820|1.942190|1.549555|1.728608|1.767604|1.718657|1.555877|1.461339|1.487938|1.628532|3.021755|7.433839|0.500000| |17.555514|8.779011|9.316699|0.212882|4.587529|3.723082|0.086607|3.865806|5.446235|0.151780|5.329090|5.389972|3.309813|2.675457|2.610594|2.946015|3.845561|2.177161|2.723458|1.763131|1.745522|1.984098|1.564364|1.429037|1.315064|1.769566|1.394773|1.539331|1.599692|1.578181|1.441153|1.348417|1.359077|1.472513|2.809376|6.455785|0.300214|0.500000| |17.586920|8.963928|7.542384|0.146537|4.114516|3.550592|0.082716|3.513155|4.639518|0.143862|4.103036|4.543855|2.766026|2.352640|2.362853|2.735586|3.424760|2.023884|2.543535|1.672381|1.665825|1.877165|1.508207|1.373085|1.272637|1.727774|1.368720|1.503644|1.525449|1.490787|1.369671|1.296458|1.316720|1.423326|2.710095|6.732491|0.302924|0.302609|0.500000| |8.759944|17.665811|12.427605|0.182624|6.962060|6.170361|0.129518|5.407294|6.951841|0.224904|4.760671|5.190530|3.008413|2.567696|2.504270|2.961464|3.675066|2.154745|2.772276|1.801613|1.752608|1.944705|1.566743|1.424260|1.309405|1.765564|1.396817|1.545860|1.663936|1.640064|1.512755|1.427712|1.441292|1.550179|2.986173|13.297688|0.209344|0.171980|0.210829|0.500000| |8.871874|17.620827|12.433252|0.223729|7.226384|5.098249|0.115185|4.413694|5.516863|0.150314|4.343406|4.564107|2.799462|2.350169|2.245518|2.537339|3.121059|1.936070|2.499349|1.631206|1.587867|1.754411|1.429151|1.314344|1.213167|1.630111|1.278383|1.403479|1.514911|1.508876|1.399574|1.315998|1.318116|1.408454|2.768637|9.168779|0.172707|0.210984|0.216640|0.301566|0.500000| |4.769993|7.552516|12.159238|0.200796|17.661090|8.653288|0.197204|5.706636|5.712357|0.140067|4.220049|4.572016|2.847766|2.419828|2.230984|2.479472|2.944973|1.948475|2.581290|1.675619|1.597332|1.733534|1.428914|1.322057|1.214359|1.618332|1.261180|1.386715|1.582596|1.601637|1.498658|1.401295|1.386992|1.467770|2.961890|12.882629|0.115046|0.122441|0.116425|0.198352|0.235489|0.500000| |4.208321|5.722306|12.275158|0.241242|17.618630|8.798695|0.217083|6.988694|6.471683|0.138887|5.148409|5.391293|3.441690|2.825067|2.489511|2.692673|3.220039|2.141763|2.855634|1.821813|1.715252|1.864716|1.516879|1.407832|1.282312|1.693063|1.313717|1.452180|1.719478|1.765282|1.643038|1.513319|1.482339|1.570901|3.185485|10.157074|0.106864|0.115567|0.098726|0.141487|0.158535|0.299987|0.500000| |3.745001|4.442166|7.784257|0.131509|5.723378|8.784128|0.198752|17.660154|8.777623|0.223420|6.157221|8.532748|4.601543|4.089310|3.688917|4.450541|5.122613|3.136983|4.216963|2.584239|2.374975|2.604145|2.023751|1.819351|1.622308|2.141633|1.694158|1.928683|2.395251|2.403483|2.173236|1.997033|1.989358|2.161782|4.091388|13.291249|0.112073|0.094130|0.089183|0.132313|0.103801|0.125779|0.140391|0.500000| |3.676463|4.399641|8.808676|0.161539|6.965719|8.852622|0.217984|17.570117|8.802693|0.175310|7.223284|8.771820|5.223603|4.245714|3.510284|3.853982|4.566728|2.934863|3.968821|2.417138|2.210764|2.419266|1.890556|1.729534|1.542740|2.017897|1.575814|1.779368|2.256819|2.329926|2.117162|1.912148|1.868235|2.010567|3.943568|10.268049|0.105141|0.097875|0.085835|0.119374|0.107056|0.139777|0.199152|0.301991|0.500000| |4.561126|4.782801|9.550238|0.224742|5.454920|4.956597|0.117882|6.836102|8.934296|0.174027|17.539955|12.563090|7.724165|4.874079|3.986535|4.217960|5.743524|3.085409|3.931038|2.378124|2.245404|2.563094|1.921101|1.754241|1.565810|2.051417|1.604653|1.812717|2.143359|2.182054|1.948092|1.756387|1.732057|1.891455|3.601657|7.069110|0.132553|0.133224|0.100608|0.115873|0.114391|0.118513|0.161006|0.151137|0.215267|0.500000| |6.343717|5.587598|9.418179|0.213369|4.664679|4.237011|0.098024|5.428760|8.779488|0.210525|17.433383|12.241019|6.472615|4.415342|4.104267|4.680612|7.374570|3.110657|3.794710|2.332501|2.273601|2.671078|1.960209|1.766227|1.586380|2.105092|1.666281|1.885360|2.059862|2.038810|1.812014|1.659591|1.666682|1.838786|3.394983|6.760935|0.206130|0.187845|0.131265|0.131797|0.125310|0.108707|0.124316|0.131189|0.143858|0.302297|0.500000| |3.101064|3.149552|5.425100|0.116613|3.571418|3.633359|0.093744|4.908161|5.050969|0.117874|7.328982|12.486427|17.573545|8.896905|5.514945|4.927778|5.703808|4.091247|5.291073|3.016131|2.756770|3.159338|2.279335|2.085287|1.817879|2.334789|1.814757|2.080756|2.675191|2.787272|2.411572|2.104114|2.048724|2.266572|4.235485|5.449520|0.092605|0.088689|0.073393|0.081729|0.078123|0.082847|0.105342|0.127677|0.163992|0.241525|0.161436|0.500000| |3.257532|3.077895|4.964133|0.107939|3.084745|3.057441|0.077248|3.932979|4.522147|0.113602|6.937242|12.256819|17.412653|8.814981|6.759580|5.741137|7.042905|4.512721|5.308566|3.066077|2.943344|3.581513|2.435076|2.196966|1.917059|2.481442|1.947728|2.246485|2.608563|2.616638|2.238747|1.985898|1.975578|2.222662|3.979219|4.853048|0.100617|0.094817|0.077376|0.079224|0.075695|0.073953|0.087757|0.104862|0.117669|0.191563|0.184683|0.301815|0.500000| |2.567098|2.608422|4.198171|0.084347|2.869478|3.175105|0.083884|4.215765|3.986620|0.103351|4.736510|9.487495|8.889210|17.596589|8.868804|6.835982|5.760033|6.973935|9.881325|4.718056|3.960756|4.499353|3.029928|2.691890|2.257000|2.855151|2.241344|2.664824|3.993500|4.127093|3.313547|2.805978|2.752533|3.171589|5.411864|5.073938|0.078485|0.070276|0.062950|0.071447|0.064560|0.068724|0.080551|0.127118|0.129349|0.127751|0.110719|0.217433|0.173590|0.500000| |2.393987|2.358509|3.722692|0.077495|2.506138|2.629365|0.069490|3.308137|3.338364|0.086530|4.184003|7.652264|8.893867|17.566858|8.819292|5.521606|4.928966|6.824580|8.721873|4.475777|3.965940|4.657273|3.077451|2.794152|2.335046|2.919583|2.262680|2.667399|3.699961|3.843675|3.086542|2.605065|2.547871|2.930389|5.056557|4.225646|0.072639|0.067384|0.059098|0.063243|0.059256|0.061077|0.071474|0.094240|0.101045|0.117184|0.104960|0.214050|0.215620|0.303396|0.500000| |2.641651|2.471427|3.709729|0.076259|2.383869|2.482205|0.063635|3.079823|3.360289|0.093158|4.197808|7.823515|6.858618|8.883593|17.481646|8.905308|6.861309|9.017972|8.056826|4.487568|4.620852|6.819415|3.552868|3.013866|2.535823|3.279522|2.651579|3.226676|3.402030|3.171258|2.583807|2.314540|2.388402|2.830786|4.501973|4.184695|0.083656|0.073492|0.065765|0.066767|0.060973|0.059055|0.065502|0.089211|0.087120|0.105957|0.114285|0.140437|0.201082|0.174263|0.215111|0.500000| |2.943653|2.917481|4.423499|0.084755|2.897011|3.297173|0.083253|4.336331|4.399399|0.129802|4.738723|9.487870|5.757677|6.842516|8.844189|17.552324|8.890457|7.014306|8.137949|4.476670|4.189308|5.153624|3.238875|2.701313|2.305555|3.038414|2.496367|3.044739|3.615885|3.317858|2.754156|2.517957|2.631428|3.109192|4.890024|5.745894|0.094930|0.076903|0.072898|0.083196|0.069882|0.070612|0.076417|0.142726|0.114825|0.111463|0.116358|0.129035|0.132430|0.201045|0.139793|0.174428|0.500000| |2.949928|2.758510|3.988478|0.078087|2.537560|2.743983|0.068913|3.403941|3.746108|0.113577|4.191084|7.657769|4.928064|5.515017|8.752830|17.550265|8.909001|6.858318|6.868010|4.139693|4.350249|6.069744|3.455286|2.806832|2.421645|3.258971|2.744367|3.387349|3.228636|2.880659|2.411675|2.247181|2.391256|2.845413|4.395519|4.877762|0.097402|0.077775|0.074289|0.077646|0.066363|0.063301|0.066897|0.104395|0.089756|0.098064|0.113265|0.108307|0.128793|0.139521|0.123235|0.215403|0.302130|0.500000| |4.107536|3.600060|5.335520|0.108823|3.119013|3.163021|0.076805|4.029287|5.128970|0.149956|6.955111|12.291115|7.061397|5.752623|6.758240|8.825739|17.407976|4.526059|4.992950|3.000405|3.030734|3.874298|2.535727|2.202183|1.945552|2.594212|2.101299|2.451120|2.499106|2.378046|2.047340|1.879884|1.931449|2.202173|3.766058|5.406505|0.142346|0.112452|0.097448|0.095422|0.084313|0.076250|0.082709|0.112844|0.106875|0.148054|0.214017|0.143942|0.209307|0.132624|0.128941|0.201589|0.173657|0.216235|0.500000| |4.616461|4.278913|6.293095|0.118061|3.648120|3.929781|0.092163|5.203438|6.789429|0.234092|7.310584|12.427180|5.688186|4.924099|5.506695|8.907518|17.560092|4.105603|4.801882|2.914714|2.877162|3.501592|2.419234|2.093202|1.858796|2.494849|2.030483|2.364694|2.488993|2.361196|2.057545|1.909329|1.969406|2.230677|3.839032|7.016677|0.166996|0.115672|0.108606|0.120331|0.095836|0.088179|0.092225|0.155167|0.126107|0.144859|0.194717|0.127553|0.143475|0.128830|0.108237|0.140683|0.217351|0.215433|0.302165|0.500000| |1.974045|1.871289|2.716911|0.055183|1.816485|1.911835|0.050238|2.247386|2.341850|0.066190|2.657358|4.433186|3.568208|4.526177|6.374910|4.881423|3.726259|8.834925|8.516749|6.252669|8.775890|17.512800|6.503182|4.945791|3.885031|4.943529|4.127715|5.515198|4.262824|3.590992|2.868974|2.649390|2.868763|3.591412|5.038566|3.308077|0.061003|0.054353|0.050963|0.051603|0.047251|0.046196|0.049789|0.066215|0.063001|0.069087|0.072615|0.085071|0.100158|0.111909|0.126614|0.194433|0.119057|0.145215|0.105006|0.090055|0.500000| |2.104341|2.000668|2.873296|0.057254|1.915855|2.054711|0.053605|2.423065|2.518869|0.073173|2.768747|4.669266|3.479788|4.307239|6.396015|5.969391|4.162746|8.809326|8.491333|6.253943|8.735259|17.510751|6.374259|4.433319|3.608898|4.850679|4.340082|6.213086|4.282620|3.461988|2.805165|2.661745|2.967112|3.778489|5.060225|3.629313|0.065960|0.056741|0.054527|0.056127|0.049993|0.048760|0.051651|0.073202|0.066309|0.070023|0.075086|0.082314|0.094021|0.112140|0.110480|0.171496|0.150251|0.201175|0.112355|0.104297|0.302719|0.500000| |1.436780|1.409309|2.045752|0.041355|1.432066|1.523408|0.041356|1.722761|1.703453|0.047462|1.837412|2.898602|2.306226|2.808947|3.107453|2.670484|2.229951|4.054192|6.041537|6.233198|6.944224|4.755272|8.863631|17.750076|8.926453|7.759228|5.055375|5.670017|6.174257|4.921038|4.138614|4.079411|4.667830|5.892320|7.446434|2.636092|0.042959|0.039472|0.037642|0.039253|0.036424|0.036937|0.039672|0.050855|0.048967|0.049555|0.049161|0.059982|0.062377|0.077935|0.082154|0.083663|0.073914|0.074801|0.060345|0.057103|0.129648|0.111173|0.500000| |1.252169|1.223110|1.746480|0.035293|1.225574|1.293790|0.035148|1.433278|1.427512|0.040078|1.517533|2.328785|1.809298|2.095827|2.307762|2.089844|1.805225|2.787259|3.933461|3.608098|4.106400|3.282154|5.654272|8.924879|17.709716|12.717348|5.926682|5.054781|3.637948|3.118173|2.902412|3.058298|3.523919|3.928636|6.080615|2.265072|0.037212|0.034378|0.033212|0.034156|0.031851|0.031989|0.033822|0.042031|0.040327|0.040880|0.041138|0.047385|0.049585|0.057831|0.060228|0.063544|0.057656|0.059836|0.049483|0.047255|0.092030|0.084305|0.215229|0.500000| |1.399518|1.346813|1.881045|0.037606|1.299043|1.376013|0.036808|1.522209|1.546404|0.044602|1.621519|2.487313|1.849546|2.094530|2.448942|2.376571|2.027138|2.890728|3.778666|3.290700|4.111947|3.673839|5.650191|5.050432|5.924774|12.723063|17.705598|8.916982|2.988434|2.471396|2.238947|2.339610|2.751070|3.214849|4.675231|2.468344|0.042196|0.037907|0.037507|0.038026|0.034762|0.034071|0.035206|0.045081|0.041742|0.042535|0.044548|0.047256|0.050840|0.057225|0.057393|0.067941|0.065094|0.072365|0.055884|0.054385|0.099777|0.108294|0.109255|0.129990|0.500000| |1.687581|1.620634|2.284542|0.045422|1.559786|1.670559|0.044283|1.892759|1.929286|0.056052|2.041707|3.240000|2.393843|2.803044|3.498997|3.412773|2.725445|4.407710|5.494552|4.874359|6.964656|6.368498|8.844932|5.664299|5.057977|7.768792|8.938385|17.728607|3.938893|3.082586|2.642814|2.676981|3.163405|4.007461|5.154161|2.993202|0.051730|0.045426|0.044693|0.045865|0.041237|0.040433|0.042070|0.056879|0.051690|0.052727|0.055657|0.059665|0.065005|0.076346|0.074990|0.095078|0.093210|0.107756|0.074056|0.072228|0.155786|0.209399|0.123699|0.109306|0.215635|0.500000| |1.690764|1.714217|2.601549|0.052416|1.863957|2.035105|0.056308|2.376343|2.224466|0.059902|2.410768|3.931230|3.269860|4.324386|4.027583|3.311124|2.774571|5.022114|9.918298|7.123478|4.860193|4.137026|3.858046|3.800980|3.017644|3.538213|2.621908|3.061868|8.920372|17.749326|8.953340|5.689240|4.954248|5.656422|9.624792|3.393856|0.050247|0.046413|0.043297|0.047638|0.044080|0.046946|0.052526|0.070986|0.070449|0.066730|0.061299|0.088980|0.082045|0.136319|0.130125|0.097367|0.097484|0.083514|0.071095|0.069445|0.103515|0.096349|0.122829|0.079121|0.064143|0.080615|0.500000| |1.430911|1.468351|2.203296|0.044239|1.618069|1.767917|0.049939|1.982650|1.827856|0.049329|1.914616|2.971584|2.370450|2.836345|2.669717|2.379754|2.092796|3.089768|5.263434|4.112152|3.261874|2.787579|2.931990|3.056304|2.614562|3.095234|2.226874|2.459937|5.606375|8.858394|17.742576|8.962070|5.644952|4.952791|16.724343|2.972216|0.041887|0.039194|0.037080|0.041061|0.038308|0.041386|0.045696|0.058820|0.058432|0.053469|0.049054|0.066291|0.060480|0.087859|0.082716|0.067016|0.070578|0.061669|0.054101|0.054244|0.071573|0.069190|0.097326|0.071470|0.055459|0.064362|0.213735|0.500000| |1.319551|1.335663|1.937116|0.038390|1.402151|1.537398|0.042703|1.695650|1.602652|0.044829|1.641009|2.533185|1.915927|2.242989|2.341626|2.216309|1.899981|2.818222|4.490820|4.090532|3.635714|2.863549|3.742413|3.946873|3.580398|4.335466|3.087997|3.289292|5.608653|4.954131|5.644299|8.959782|17.744923|8.862533|16.711120|2.696700|0.038997|0.035641|0.034782|0.037963|0.034725|0.036431|0.038587|0.051160|0.047825|0.044332|0.042964|0.051390|0.049838|0.067005|0.062249|0.059679|0.066050|0.060920|0.049465|0.050712|0.071566|0.074952|0.113801|0.095837|0.076365|0.083720|0.107589|0.124628|0.500000| 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