Version2.1 2021-01-07T02:17:31Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 12-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCOC(=O)c1cc(ccc1N2CCOCC2)NC(=S)NC(=O)c3cc(ccc3OC)Cl C20969334 RHF 6-31G(d) (6D,7F) CCCOC(=O)c1cc(ccc1N2CCOCC2)NC(=S)NC(=O)c3cc(ccc3OC)Cl C01[X(C23H26Cl1N3O5S1)] 171 C1 555 CCCOC(=O)c1cc(ccc1N1CCOCC1)NC(=S)NC(=O)c1cc(Cl)ccc1OC CCCOC(=O)c1cc(ccc1N1CCOCC1)NC(=S)NC(=O)c1cc(Cl)ccc1OC CCCOC(=O)c1cc(NC(=S)NC(=O)c2cc(Cl)ccc2OC)ccc1N3CCOCC3 InChIKey=IYACQCQIOCOSIC-UHFFFAOYSA-N InChI=1S/C23H26ClN3O5S/c1-3-10-32-22(29)17-14-16(5-6-19(17)27-8-11-31-12-9-27)25-23(33)26-21(28)18-13-15(24)4-7-20(18)30-2/h4-7,13-14H,3,8-12H2,1-2H3,(H2,25,26,28,33) InChI=1/C23H26ClN3O5S/c1-3-10-32-22(29)17-14-16(5-6-19(17)27-8-11-31-12-9-27)25-23(33)26-21(28)18-13-15(24)4-7-20(18)30-2/h4-7,13-14H,3,8-12H2,1-2H3,(H2,25,26,28,33)/f/h25-26H CCCOC(=O)c1cc(ccc1N2CCOCC2)NC(=S)NC(=O)c3cc(ccc3OC)Cl C01[X(C23H26Cl1N3O5S1)] 171 C01 555 CCCOC(=O)c1cc(ccc1N1CCOCC1)NC(=S)NC(=O)c1cc(Cl)ccc1OC CCCOC(=O)[C]1[CH][C]([CH][CH][C]1N1CCOCC1)NC(=S)NC(=O)[C]1[CH][C]([CH][CH][C]1OC)Cl CCCOC(=O)[C]1[CH][C]([CH][CH][C]1N2CCOCC2)NC(=S)NC(=O)[C]3[CH][C](Cl)[CH][CH][C]3OC InChIKey=IYACQCQIOCOSIC-UHFFFAOYSA-N InChI=1S/C23H26ClN3O5S/c1-3-10-32-22(29)17-14-16(5-6-19(17)27-8-11-31-12-9-27)25-23(33)26-21(28)18-13-15(24)4-7-20(18)30-2/h4-7,13-14H,3,8-12H2,1-2H3,(H2,25,26,28,33) InChI=1/C23H26ClN3O5S/c1-3-10-32-22(29)17-14-16(5-6-19(17)27-8-11-31-12-9-27)25-23(33)26-21(28)18-13-15(24)4-7-20(18)30-2/h4-7,13-14H,3,8-12H2,1-2H3,(H2,25,26,28,33)/f/h25-26H 3525.8218049092 -2280.7535209 1-A 28986.1001 129 426 555 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -104.83657 -91.88089 -20.61140 -20.60718 -20.55331 -20.55079 -20.54810 -15.62735 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10.87930
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|XX|YY|ZZ|XY|XZ|YZ| 1.5537 14.3832 -15.9369 -15.1471 -7.4529 -1.7408
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71.425068 22 6 7 8 18 3 1
|36.858105| |12.463595|36.858105| |7.555220|12.557249|36.858105| |5.085350|8.024384|13.380167|73.516695| |3.920143|5.263344|8.106440|25.519179|36.858105| |3.746653|4.629649|7.236345|15.346125|16.023434|73.516695| |3.132788|4.065427|5.193124|14.497048|12.721240|14.122737|36.858105| |3.052995|4.007704|4.643636|12.470508|7.697340|9.565857|13.687395|36.858105| |2.530445|3.164453|3.486470|8.329168|5.066882|7.121563|7.892255|13.819130|36.858105| |2.234684|2.710672|3.026548|6.939636|4.456483|6.649041|6.855768|7.989672|13.771873|36.858105| |2.263367|2.726107|3.161170|7.233027|5.020087|7.730353|7.948313|6.933609|7.965399|13.806991|36.858105| |2.610790|3.203905|3.939400|9.432801|7.495251|11.219976|13.586176|7.882594|6.797394|7.862502|13.665379|36.858105| |2.512814|2.980320|3.728465|8.208764|6.502813|11.735918|7.780571|5.127621|4.518636|5.126758|7.789630|13.476831|53.358707| |2.360054|2.717553|3.408041|7.065352|5.481930|11.243748|5.851361|4.236652|3.784976|4.183993|5.720131|7.841904|17.737003|36.858105| |2.273973|2.534991|3.152451|6.122858|4.437125|9.606980|4.280012|3.289780|2.958802|3.194413|4.073648|5.130153|10.706982|12.549135|36.858105| |2.056430|2.276167|2.734583|5.306135|3.663307|7.369365|3.685472|2.935944|2.732711|3.029318|3.873120|4.551126|9.275039|7.906553|13.569928|73.516695| |2.147992|2.413831|2.879916|5.711528|3.904953|7.478621|4.025983|3.173078|2.959775|3.318246|4.332293|5.120834|10.748636|6.779676|8.179164|24.231631|36.858105| |2.212070|2.560384|3.054557|6.419858|4.526022|8.093687|5.218840|3.982910|3.784648|4.485356|6.545609|7.790397|17.833694|7.929318|6.771409|14.081357|12.521207|36.858105| |2.379945|2.925881|3.052213|6.879393|3.889639|5.685627|5.132553|7.850648|13.368256|7.807314|5.148807|4.507031|4.597662|2.961771|2.426377|4.035000|2.431923|2.970861|53.358707| |2.149789|2.566413|2.659743|5.728504|3.262694|4.971516|4.060891|5.552320|7.702408|5.850136|4.192755|3.690489|3.953767|2.666672|2.209002|3.664988|2.160149|2.579120|19.174048|36.858105| |2.002695|2.343720|2.494783|5.268924|3.128420|4.939120|3.841298|4.810564|6.086273|5.335842|4.113846|3.625052|3.968203|2.803323|2.293560|3.758014|2.157954|2.559841|9.749386|11.569035|388.023441| |2.017138|2.368022|2.376773|4.958404|2.741503|4.240867|3.244549|4.199251|5.256563|4.315856|3.308304|2.973797|3.317362|2.245626|1.914895|3.215827|1.899574|2.219891|11.540696|13.747239|50.323830|53.358707| |1.870198|2.146454|2.131382|4.311503|2.372240|3.751041|2.701964|3.337381|3.882147|3.334385|2.707228|2.490605|2.865245|1.982628|1.718342|2.883653|1.683635|1.928022|7.258777|7.588660|41.423452|18.575011|36.858105| |1.859796|2.115795|2.111748|4.221818|2.333811|3.731968|2.615380|3.180794|3.570745|3.081020|2.565014|2.399524|2.786940|1.963701|1.704398|2.835268|1.636337|1.858437|6.254959|6.453782|42.429780|11.355659|16.134392|73.516695| |1.708401|1.932498|1.893537|3.769173|2.059859|3.287521|2.310515|2.767145|3.167303|2.825940|2.349405|2.163386|2.537922|1.750235|1.541954|2.619696|1.536500|1.741840|5.624419|5.082536|29.134754|10.767074|12.640779|14.282990|36.858105| |1.575053|1.774388|1.753832|3.494859|1.933718|3.104181|2.187631|2.572641|3.000592|2.790509|2.322261|2.098496|2.476978|1.702683|1.504210|2.583505|1.520520|1.727271|5.186284|4.524222|26.724855|8.728739|7.634684|9.893991|13.768805|36.858105| |1.450202|1.613677|1.584040|3.113843|1.716679|2.780101|1.912502|2.200237|2.505736|2.368721|2.023926|1.846556|2.216470|1.526913|1.366659|2.363410|1.391616|1.563152|4.146121|3.425205|21.009331|6.037536|5.048147|7.320031|7.933388|13.762223|36.858105| |1.432725|1.580428|1.532916|2.976761|1.623671|2.638039|1.778759|2.035276|2.259038|2.109607|1.830592|1.700308|2.057190|1.422318|1.283154|2.213669|1.300765|1.447099|3.687730|2.995851|18.538862|5.184436|4.453949|6.771145|6.872206|7.965789|13.832312|36.858105| |1.531550|1.689784|1.623916|3.141320|1.696143|2.747526|1.842699|2.127351|2.327077|2.123976|1.843161|1.733857|2.091226|1.449186|1.305979|2.235755|1.310518|1.455350|3.834983|3.140104|19.267016|5.526440|5.024704|7.772704|7.926568|6.888228|7.952535|13.734744|36.858105| |1.681065|1.877083|1.808236|3.532897|1.903857|3.058219|2.083712|2.456591|2.704332|2.409564|2.058129|1.935990|2.304386|1.596110|1.423846|2.418165|1.415674|1.583948|4.606497|3.915862|23.367424|7.348430|7.538524|11.109361|13.608538|7.906704|6.849829|7.912123|13.734163|36.858105| |1.807998|2.014762|1.919239|3.717697|1.978596|3.175894|2.132211|2.522562|2.698664|2.354799|2.030847|1.946242|2.319054|1.613804|1.441654|2.428204|1.416269|1.576865|4.546481|3.827493|23.123615|6.830854|6.866041|11.547020|8.176595|5.290620|4.628053|5.210037|7.913019|14.242820|73.516695| |1.729314|1.890721|1.781594|3.382650|1.790671|2.905153|1.891993|2.189274|2.288625|2.023929|1.784145|1.731001|2.094310|1.466058|1.325433|2.235430|1.299911|1.430207|3.704900|3.011559|18.905249|5.004009|4.581390|8.144344|5.246717|3.981739|3.794122|4.514042|6.718859|8.009691|24.138354|36.858105| |1.320665|1.461046|1.446082|2.835405|1.579904|2.579716|1.762435|1.985190|2.264759|2.216567|1.922037|1.737142|2.109588|1.453772|1.309418|2.289156|1.349937|1.511955|3.609449|2.894286|18.369329|4.730066|3.665208|5.579927|4.759788|7.027751|10.934249|7.028295|4.759362|4.211512|5.781236|2.828831|448.794386| |17.541392|8.764454|6.832343|8.295861|3.758453|6.587246|2.990495|2.833621|2.372737|2.139151|2.201920|2.552921|3.428643|2.363682|2.328881|3.770222|2.222800|2.245427|3.003929|1.989819|13.262933|2.537906|1.725544|3.039754|1.586842|1.478119|1.367602|1.347463|1.428871|1.556411|2.945746|1.585690|10.092854|0.500000| |17.542041|8.764086|6.832671|8.290719|3.761818|6.590897|2.999526|2.918048|2.427395|2.149620|2.179762|2.511751|3.306393|2.338102|2.257506|3.586008|2.069771|2.122182|3.112302|2.100261|14.164600|2.673382|1.839534|3.291529|1.671066|1.535435|1.411858|1.396293|1.496445|1.646398|3.164190|1.708549|10.308441|0.301537|0.500000| |17.565693|8.797708|5.499226|7.469109|3.317716|5.569725|2.780611|2.781462|2.362114|2.085540|2.083515|2.350971|3.057659|2.105487|2.026107|3.302959|1.946155|2.010221|3.092577|2.066420|13.561488|2.685141|1.844564|3.252515|1.703120|1.566121|1.450990|1.444870|1.551211|1.694642|3.255711|1.769497|10.576826|0.301950|0.301960|0.500000| |8.827817|17.545349|8.932929|13.081562|4.939063|7.532064|4.019979|3.996308|3.211685|2.764964|2.770401|3.219127|4.058109|2.643119|2.469510|4.025263|2.453113|2.616811|4.056359|2.564824|16.312383|3.251337|2.143217|3.698608|1.951925|1.805136|1.648178|1.612411|1.715386|1.894264|3.581570|1.886120|12.023096|0.210152|0.172573|0.212066|0.500000| |8.830848|17.542251|8.930490|13.055733|4.945155|7.535711|4.040805|4.241554|3.349755|2.787066|2.726419|3.137555|3.859994|2.607281|2.385031|3.804037|2.252577|2.427841|4.333358|2.813431|18.070912|3.549624|2.372662|4.178316|2.114309|1.911849|1.726823|1.697518|1.835323|2.062533|3.994014|2.102189|12.389649|0.172602|0.210205|0.212162|0.303282|0.500000| |6.825922|8.803286|17.606035|16.514997|7.281253|13.031060|4.779730|4.299924|3.282145|2.866724|2.994030|3.701379|4.822768|3.412469|3.163779|4.767033|2.736605|2.874217|3.941964|2.593919|17.787767|3.142373|2.098906|3.754938|1.851625|1.707767|1.540436|1.493030|1.586465|1.771146|3.361638|1.761588|11.271168|0.167839|0.201976|0.139864|0.173762|0.212193|0.500000| |6.833510|8.806003|17.609195|16.530038|7.248401|12.995191|4.738925|4.039829|3.148762|2.840221|3.050016|3.833672|5.223350|3.491771|3.368344|5.224790|3.121041|3.202291|3.726670|2.393252|16.089969|2.927652|1.933772|3.393008|1.738622|1.629546|1.483125|1.433501|1.506378|1.660277|3.102798|1.627755|10.988300|0.202224|0.168081|0.139951|0.212105|0.173760|0.302456|0.500000| |3.445477|4.698261|5.219793|14.073406|7.202410|9.037515|8.931142|17.763821|8.976380|5.678302|4.987063|5.627248|5.664135|3.606875|2.932544|4.643258|2.788866|3.336860|9.846228|5.407914|32.338156|5.832349|3.473876|5.945168|2.861485|2.591122|2.218718|2.083406|2.216449|2.586321|4.836225|2.365377|15.794173|0.086174|0.091371|0.087386|0.127540|0.146316|0.134007|0.118977|0.500000| |2.001114|2.378482|2.595347|5.719806|3.561777|5.502671|4.944727|5.673335|8.938116|17.738892|8.928277|5.614503|5.664198|3.551992|2.815890|4.856884|2.968869|3.889243|9.747141|5.924998|38.634254|6.139373|3.467049|5.594958|2.979195|3.032441|2.557257|2.231189|2.208619|2.490258|4.231711|2.032865|19.513437|0.053336|0.053604|0.052470|0.067587|0.068121|0.068760|0.068159|0.124756|0.500000| |2.036107|2.394807|2.745699|6.007511|4.078968|6.640957|5.649713|4.986670|5.674899|8.994942|17.757397|8.920185|9.726291|5.563551|4.102684|7.312593|4.614138|7.185026|5.691948|3.594159|25.747934|4.000179|2.458460|4.149574|2.173943|2.185051|1.927026|1.737794|1.731503|1.909725|3.321441|1.652904|14.965883|0.055565|0.054636|0.052356|0.067716|0.066054|0.072792|0.074983|0.108157|0.216850|0.500000| |2.102843|2.397860|2.905870|5.980447|4.383001|8.463961|4.958204|3.882540|3.678399|4.246633|5.808410|6.765226|12.284185|17.439197|8.871192|12.501886|5.882708|7.088953|3.969211|2.679369|20.564025|3.061262|1.991289|3.511581|1.757619|1.723676|1.543764|1.429021|1.447539|1.591894|2.840963|1.447556|11.879179|0.058165|0.058053|0.052824|0.065041|0.064876|0.081187|0.081462|0.091575|0.103169|0.169614|0.500000| |2.546016|2.949587|3.796006|7.875430|6.374052|13.951052|6.384792|4.585704|3.922242|4.105793|5.252937|7.328187|12.435181|17.673289|8.908212|10.168596|5.055253|5.714433|4.186781|2.794445|21.180017|3.175968|2.069739|3.684433|1.806291|1.736457|1.549610|1.449370|1.488694|1.651401|2.996345|1.530951|11.721372|0.070008|0.071042|0.062480|0.077849|0.079256|0.109167|0.105489|0.110387|0.095780|0.133366|0.300105|0.500000| |2.114297|2.315097|2.833158|5.374488|3.770956|8.108350|3.629259|2.913458|2.657671|2.848260|3.504072|4.184902|7.699200|8.850162|17.605299|16.904577|5.885766|5.050096|3.030659|2.067760|15.529846|2.453361|1.636489|2.908987|1.469923|1.433552|1.305638|1.228326|1.250554|1.361103|2.453087|1.273550|10.055541|0.059969|0.059068|0.052593|0.062048|0.061049|0.080773|0.083106|0.073361|0.071043|0.098844|0.216462|0.210117|0.500000| |2.531335|2.809293|3.587643|6.769003|4.902151|11.389082|4.341234|3.302516|2.882561|3.011709|3.732342|4.839639|9.598508|8.909395|17.535455|16.513522|7.262647|5.878145|3.239920|2.152052|15.644084|2.557617|1.689736|2.980244|1.519304|1.473116|1.341489|1.267134|1.295913|1.412895|2.558751|1.328996|10.266489|0.072977|0.069716|0.061792|0.075590|0.071992|0.099842|0.110155|0.083456|0.073276|0.100914|0.174104|0.218247|0.299827|0.500000| |1.948329|2.162672|2.510824|4.913905|3.233388|6.054099|3.368313|2.776386|2.657868|3.000092|3.790381|4.173524|7.718777|5.043604|5.878191|16.919913|17.595796|8.843096|3.039763|1.999345|14.158950|2.422978|1.585439|2.730520|1.461488|1.457584|1.343242|1.254924|1.257227|1.348690|2.385891|1.235240|10.554609|0.056108|0.052060|0.049600|0.061514|0.056311|0.066249|0.075208|0.068495|0.076642|0.115535|0.131784|0.110578|0.132271|0.147367|0.500000| |2.355510|2.642718|3.188663|6.211707|4.191968|8.153210|4.072661|3.183626|2.887054|3.123888|3.944363|4.841352|9.657743|5.905646|7.273276|16.541386|17.506201|8.879805|3.250700|2.106467|14.760054|2.538909|1.656261|2.861447|1.514777|1.490062|1.366988|1.285604|1.301279|1.405360|2.513241|1.302794|10.589484|0.068698|0.062511|0.058803|0.075040|0.067205|0.082849|0.099080|0.079090|0.076992|0.111049|0.134959|0.132561|0.147481|0.216680|0.299924|0.500000| |2.251243|2.629235|3.072448|6.529242|4.405097|7.479232|5.161852|4.075942|3.923359|4.639954|6.488868|7.250244|12.453675|5.702582|5.035598|10.160860|8.869579|17.571230|4.212862|2.629017|17.983349|3.110562|1.967015|3.331466|1.791196|1.783105|1.617600|1.496184|1.500817|1.628947|2.871823|1.463034|12.582981|0.063550|0.059141|0.057225|0.076329|0.069043|0.078373|0.089526|0.094906|0.112191|0.191593|0.143813|0.127541|0.110418|0.131547|0.210323|0.216502|0.500000| |1.988128|2.277710|2.661029|5.535687|3.807823|6.770427|4.505661|3.651630|3.651714|4.537380|6.636826|6.650555|12.188242|7.040117|5.888039|12.603656|8.925007|17.453015|3.958934|2.573197|18.503200|3.011194|1.926044|3.300638|1.742765|1.744609|1.578453|1.451446|1.449965|1.574445|2.765867|1.407623|12.364220|0.055670|0.053376|0.050679|0.064365|0.060900|0.070628|0.076166|0.085042|0.113707|0.236787|0.209097|0.143106|0.132318|0.134729|0.217946|0.174424|0.300276|0.500000| |2.479298|3.071494|3.098318|6.922254|3.728497|5.422282|4.679951|6.908648|9.235288|6.094390|4.417334|4.033684|4.244347|2.710398|2.273532|3.809642|2.317874|2.787067|26.006793|9.477025|38.395078|11.048260|5.231631|7.776729|4.265858|3.881262|3.145315|2.837742|2.978845|3.575473|6.302799|2.883912|21.685196|0.063550|0.065318|0.066519|0.088654|0.093609|0.080217|0.076968|0.194585|0.157438|0.102016|0.073140|0.077822|0.057838|0.062755|0.059474|0.064090|0.082071|0.074808|0.500000| |2.005722|2.357391|2.339452|4.878832|2.668308|4.111719|3.151991|4.039545|5.058868|4.230253|3.250098|2.909306|3.259695|2.172412|1.867865|3.169314|1.893503|2.213837|10.973810|9.382146|38.442484|26.022435|9.385863|10.907186|7.767522|6.848075|4.809807|4.073979|4.245403|5.440135|8.615414|3.607396|30.170518|0.051715|0.053678|0.054814|0.067164|0.071605|0.062242|0.059218|0.113873|0.124193|0.080669|0.060154|0.062000|0.048566|0.051074|0.049567|0.051828|0.064238|0.061090|0.248474|0.500000| |1.568894|1.775937|1.778455|3.578100|2.007046|3.220389|2.308813|2.714069|3.258052|3.102123|2.540829|2.247672|2.636003|1.808247|1.585385|2.730620|1.608641|1.844406|5.634020|5.000997|29.826356|9.237389|7.097200|9.386819|8.931636|17.734165|8.935360|5.665335|4.961330|5.630496|7.592491|3.326258|53.801489|0.041067|0.042478|0.043023|0.050196|0.052820|0.048082|0.046051|0.074360|0.096410|0.066781|0.051252|0.050967|0.041916|0.042834|0.042869|0.043483|0.052850|0.052186|0.113300|0.198314|0.500000| |1.342826|1.469398|1.423056|2.742866|1.496714|2.446065|1.627861|1.838771|2.021635|1.908043|1.677682|1.564459|1.910832|1.323600|1.202838|2.083742|1.224081|1.352914|3.228558|2.573576|16.210582|4.286480|3.560508|5.594359|4.953786|5.660569|8.949076|17.745486|8.925576|5.640545|7.468311|3.911903|53.641974|0.035229|0.036340|0.037716|0.041716|0.043583|0.038491|0.037171|0.052148|0.055949|0.044542|0.036941|0.037349|0.032039|0.033019|0.032940|0.033633|0.038877|0.037713|0.068924|0.093333|0.124516|0.500000| |1.494648|1.632939|1.557177|2.978633|1.599656|2.604057|1.715896|1.961338|2.108390|1.926265|1.694326|1.610686|1.958969|1.361861|1.236080|2.115953|1.238253|1.364573|3.405019|2.736557|17.072978|4.631190|4.082919|6.629352|5.631103|4.964536|5.674140|8.974459|17.772550|8.888956|12.578359|7.457443|31.641882|0.038725|0.040617|0.042316|0.046001|0.049253|0.042321|0.040188|0.057097|0.055127|0.044290|0.037665|0.038903|0.032942|0.034194|0.033030|0.034275|0.039057|0.037646|0.073645|0.098072|0.107745|0.217150|0.500000| |1.583297|1.717354|1.633188|3.089595|1.652337|2.703175|1.745957|1.996727|2.096022|1.883612|1.670658|1.614898|1.967180|1.385965|1.257226|2.125444|1.230992|1.349643|3.348071|2.743765|17.743382|4.489893|4.144378|7.546800|4.832716|3.839648|3.779430|4.603750|6.734931|7.130850|16.448460|17.577491|22.863221|0.040584|0.043634|0.044859|0.047481|0.052549|0.045056|0.041719|0.059201|0.052925|0.043338|0.038208|0.040117|0.033701|0.034904|0.032594|0.034161|0.038221|0.037079|0.071215|0.089222|0.089220|0.113223|0.219697|0.500000| |1.720710|1.874713|1.749004|3.307500|1.739401|2.819528|1.830608|2.107053|2.194564|1.948571|1.725465|1.677273|2.037015|1.417477|1.288062|2.182453|1.275245|1.399378|3.528506|2.788073|17.262024|4.599578|3.985027|6.796596|4.676979|3.741910|3.706621|4.547569|6.687227|6.926270|16.424412|17.564983|22.517310|0.043932|0.046880|0.049284|0.052438|0.057647|0.047668|0.044575|0.063180|0.054338|0.044495|0.038758|0.040930|0.034289|0.035973|0.033754|0.035614|0.039981|0.038158|0.077525|0.095304|0.086998|0.112727|0.227354|0.298499|0.500000| |1.827462|1.989081|1.862734|3.506898|1.844386|2.997574|1.926122|2.224970|2.283838|2.002605|1.778140|1.745201|2.115543|1.487821|1.346696|2.257739|1.308274|1.434383|3.650776|2.949154|18.782940|4.736757|4.231423|7.876459|4.421536|3.415838|3.189927|3.620814|4.905807|5.898531|17.016216|17.663624|19.849432|0.046201|0.050484|0.052085|0.054593|0.062033|0.051503|0.046980|0.067633|0.055224|0.045566|0.040636|0.043440|0.036001|0.037651|0.034406|0.036534|0.040610|0.039054|0.078612|0.093137|0.082165|0.089037|0.145846|0.299891|0.299919|0.500000|
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