Version2.1 2021-01-14T19:33:15Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 23-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE C[C@@H]1CN(C[C@@H](O1)C)c2ccc(c[nH+]2)CNC(=O)CCCN3C(=O)C4(CCCC4)NC3=O C46842132 RHF 6-31G(d) (6D,7F) C[C@@H]1CN(C[C@@H](O1)C)c2ccc(c[nH+]2)CNC(=O)CCCN3C(=O)C4(CCCC4)NC3=O C01[X(C23H34N5O4)] 192 C1 548 C[C@@H]1O[C@H](C)CN(C1)c1ccc(c[nH+]1)CNC(=O)CCCN1C(=O)NC2(C1=O)CCCC2 C[C@@H]1O[C@H](C)CN(C1)c1ccc(c[nH+]1)CNC(=O)CCCN1C(=O)NC2(C1=O)CCCC2 C[C@H]1CN(C[C@@H](C)O1)c2ccc(CNC(=O)CCCN3C(=O)NC4(CCCC4)C3=O)c[nH+]2 InChIKey=SJNQQMXNGIPIQK-CALCHBBNSA-O InChI=1S/C23H33N5O4/c1-16-14-27(15-17(2)32-16)19-8-7-18(12-24-19)13-25-20(29)6-5-11-28-21(30)23(26-22(28)31)9-3-4-10-23/h7-8,12,16-17H,3-6,9-11,13-15H2,1-2H3,(H,25,29)(H,26,31)/p+1/t16-,17+ InChI=1/C23H33N5O4/c1-16-14-27(15-17(2)32-16)19-8-7-18(12-24-19)13-25-20(29)6-5-11-28-21(30)23(26-22(28)31)9-3-4-10-23/h7-8,12,16-17H,3-6,9-11,13-15H2,1-2H3,(H,25,29)(H,26,31)/p+1/t16-,17+/fC23H34N5O4/h24-26H/q+1 C[C@@H]1CN(C[C@@H](O1)C)c2ccc(c[nH+]2)CNC(=O)CCCN3C(=O)C4(CCCC4)NC3=O C01[X(C23H34N5O4)] 192 C01 548 C[C@@H]1O[C@H](C)CN(C1)c1ccc(c[nH+]1)CNC(=O)CCCN1C(=O)NC2(C1=O)CCCC2 O=C(NC[C]1=CN[C]([CH][CH]1)[N@@]1C[C@H](C)O[C@@H](C1)C)CCCN1C(=O)NC2(C1=O)CCCC2 C[C@H]1CN(C[C@@H](C)O1)[C]2[CH][CH]C(=CN2)CNC(=O)CCCN3C(=O)NC4(CCCC4)C3=O InChIKey=HZCVISIGOSCKAQ-CALCHBBNSA-N InChI=1S/C23H34N5O4/c1-16-14-27(15-17(2)32-16)19-8-7-18(12-24-19)13-25-20(29)6-5-11-28-21(30)23(26-22(28)31)9-3-4-10-23/h7-8,12,16-17,24H,3-6,9-11,13-15H2,1-2H3,(H,25,29)(H,26,31)/t16-,17+ InChI=1/C23H34N5O4/c1-16-14-27(15-17(2)32-16)19-8-7-18(12-24-19)13-25-20(29)6-5-11-28-21(30)23(26-22(28)31)9-3-4-10-23/h7-8,12,16-17,24H,3-6,9-11,13-15H2,1-2H3,(H,25,29)(H,26,31)/t16-,17+/f/h25-26H 3073.2892297882 -1462.3675739 1-A 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5583.28 5585.41 5612.01 0.612506 0.642481 0.643425 0.542779 -1461.755068 -1461.725093 -1461.724149 -1461.824795 3.375683D-04 MUNgauss RevisionA2.0 retrievium 14-Jan-2021 DUDE C[C@@H]1CN(C[C@@H](O1)C)c2ccc(c[nH+]2)CNC(=O)CCCN3C(=O)C4(CCCC4)NC3=O C46842132 RHF 6-31G(d) (6D,10F) C1 444.261080 |X|Y|Z| 162.713124 64.914571 24.693704 63.892567 27 6 7 8 21 5 1 |36.858105| |12.553226|36.858105| |8.871150|17.499377|0.500000| |7.562572|12.449705|0.248144|36.858105| |4.997178|7.710117|0.192564|12.965140|53.358707| |4.502058|6.704827|0.165386|7.705920|17.558054|36.858105| |5.223186|8.158357|0.206717|6.679163|10.486572|12.502360|36.858105| |4.848939|7.446177|0.230357|5.955526|9.443155|8.916481|17.498846|0.500000| |8.068011|13.657267|0.260290|7.942671|9.279341|7.987075|13.608669|0.259832|73.516695| |4.048112|5.227569|0.134799|4.485527|6.791456|7.571388|12.555385|0.246367|14.330581|36.858105| |3.855784|5.158999|0.138121|7.770679|19.384786|7.773307|5.169907|0.138536|8.196756|3.861263|36.858105| |3.062271|3.920039|0.108589|5.027900|10.611068|6.439989|4.461487|0.123319|6.683619|3.606273|13.403095|36.858105| |2.597894|3.150659|0.087900|3.922561|7.089151|4.429408|3.387847|0.094533|5.312343|2.875403|7.903491|14.041369|36.858105| |2.542646|2.980095|0.082665|3.774395|6.217110|3.703792|2.951973|0.081952|4.863810|2.505712|6.718185|7.813766|13.339359|36.858105| |2.935180|3.425740|0.093680|4.598203|7.189215|3.944375|3.147383|0.086437|5.371442|2.599253|7.926317|6.958857|8.111265|14.191198|36.858105| |3.678573|4.522524|0.120802|6.853002|11.173338|5.221747|3.976457|0.107403|6.842322|3.116121|14.179671|8.148360|7.096319|8.048181|13.898843|53.358707| |4.167237|4.946040|0.128208|7.955964|10.333509|4.866853|3.900605|0.104031|7.121477|3.045563|9.422061|5.859967|5.179215|5.888508|9.426637|26.050976|0.500000| |2.134065|2.419471|0.067450|2.922412|4.559456|2.871558|2.395611|0.066826|3.994578|2.099891|4.376949|4.980019|7.407878|12.558162|7.596372|6.869515|0.116867|36.858105| |1.939266|2.176204|0.059847|2.591776|4.027802|2.647826|2.209807|0.060766|3.677390|1.986428|3.719246|4.288872|5.998134|7.673064|5.446978|5.553338|0.097558|13.169570|53.358707| |1.801270|2.029063|0.056045|2.362285|3.718922|2.538031|2.133329|0.058868|3.495104|1.954017|3.344299|4.033244|5.504584|5.774219|4.223262|4.688626|0.082867|7.770715|19.038581|36.858105| |1.823939|2.079903|0.058105|2.395641|3.845439|2.654103|2.235680|0.062463|3.601690|2.048637|3.457579|4.382581|6.108339|5.689500|4.073211|4.662407|0.081429|6.920856|11.614437|15.848496|73.516695| |1.620240|1.796952|0.049260|2.060630|3.174863|2.216932|1.893446|0.051807|3.129507|1.769492|2.746437|3.183090|3.954640|4.084770|3.302416|3.831744|0.069913|5.024674|10.661408|12.573904|14.108451|36.858105| |1.516975|1.684474|0.046314|1.896115|2.933290|2.105807|1.819129|0.049885|2.977307|1.730992|2.477983|2.903755|3.460814|3.346007|2.765786|3.346018|0.061416|3.820395|6.893518|7.513488|12.033242|12.480061|36.858105| |1.382264|1.514910|0.041462|1.688194|2.563347|1.854873|1.625717|0.044358|2.688941|1.565053|2.118026|2.403683|2.754735|2.708237|2.337035|2.875663|0.053814|3.032386|5.246761|4.908858|7.832140|7.566462|12.476667|36.858105| |1.299395|1.422457|0.039032|1.563595|2.371271|1.742715|1.546035|0.042282|2.546966|1.507697|1.927743|2.185620|2.443176|2.348505|2.052895|2.578505|0.048493|2.555961|4.189756|3.807004|6.535190|4.997606|7.712973|13.148309|53.358707| |1.300343|1.424889|0.038953|1.557374|2.366830|1.768118|1.571641|0.042759|2.578523|1.551969|1.901427|2.153276|2.351706|2.218218|1.960968|2.508880|0.047308|2.338894|3.752300|3.322397|5.819141|4.088939|5.775594|7.644208|19.004779|36.858105| |1.369217|1.503858|0.040842|1.650125|2.517704|1.896634|1.672204|0.045110|2.737949|1.658678|2.017999|2.284903|2.468544|2.307972|2.050245|2.645655|0.049861|2.385692|3.837618|3.350586|5.812078|4.063899|5.423837|6.578603|11.380893|15.963869|73.516695| |1.199239|1.308471|0.035934|1.412266|2.131877|1.600932|1.445532|0.039541|2.374142|1.438594|1.691967|1.900914|2.047899|1.929434|1.724202|2.225540|0.042227|2.023468|3.147561|2.724944|4.888593|3.185780|4.208426|5.087333|11.109860|12.483763|13.913179|36.858105| |1.219327|1.337480|0.036845|1.432429|2.176342|1.655659|1.502806|0.041235|2.445682|1.509611|1.714372|1.940516|2.062065|1.903361|1.701253|2.222243|0.042070|1.959903|2.984273|2.575196|4.768638|2.865315|3.699027|3.993073|7.493920|7.505691|11.051398|12.296023|36.858105| |1.186916|1.295751|0.035522|1.379231|2.082255|1.600333|1.462426|0.039873|2.387548|1.486977|1.619481|1.809407|1.887552|1.744217|1.583017|2.092941|0.039907|1.769443|2.669843|2.245035|4.107248|2.471043|3.033761|3.287793|5.715923|5.710366|9.795957|7.808093|12.461165|36.858105| |1.103380|1.194358|0.032705|1.270932|1.897860|1.445505|1.326861|0.036155|2.188976|1.343736|1.474784|1.626734|1.703043|1.601916|1.465071|1.928484|0.037010|1.641369|2.482753|2.062817|3.706731|2.306664|2.781728|3.152968|5.504560|5.273757|8.662450|7.709153|7.970224|12.444097|36.858105| |1.126905|1.219596|0.033363|1.309378|1.955593|1.473335|1.340914|0.036516|2.219185|1.343613|1.535399|1.696625|1.802491|1.713368|1.557343|2.026283|0.038805|1.781888|2.744652|2.303225|4.071763|2.665047|3.288261|3.985872|7.465482|7.475793|11.016845|12.221073|7.713823|7.891822|12.395420|36.858105| |1.160174|1.263008|0.034858|1.363726|2.050593|1.521946|1.378652|0.037955|2.272822|1.360298|1.636232|1.835405|2.002450|1.911369|1.701063|2.172454|0.041228|2.045504|3.180627|2.768728|4.968336|3.262710|4.324919|5.309079|11.814848|8.351843|9.820170|13.140635|7.577106|5.153461|5.344608|7.497573|53.358707| |1.208906|1.317870|0.036376|1.435665|2.162350|1.586404|1.425444|0.039261|2.354323|1.391762|1.746272|1.966358|2.186826|2.113020|1.859945|2.340527|0.044236|2.312558|3.680386|3.275811|5.767325|4.053038|5.655127|7.611176|18.603025|8.334603|9.866433|8.102620|5.472211|4.024137|4.033772|5.425813|19.211656|36.858105| |1.182427|1.285392|0.035607|1.400544|2.099016|1.524831|1.374730|0.038033|2.280316|1.333422|1.700579|1.905499|2.136916|2.096704|1.844908|2.300896|0.043557|2.339454|3.705682|3.273954|5.734605|4.021599|5.271117|6.604230|11.292311|5.563549|7.493475|5.428598|4.183453|3.246905|3.278070|4.148109|11.304473|15.969593|73.516695| |17.574295|8.848099|0.173489|6.852561|6.343674|4.332598|4.804285|0.117698|12.907543|3.929257|3.662955|2.929695|2.504413|2.462956|2.842593|4.807790|0.111832|2.078510|2.607775|1.778121|3.172781|1.614509|1.510512|1.384825|1.770186|1.305733|2.455853|1.201229|1.217820|1.191037|1.109607|1.133855|1.575788|1.205435|2.090397|0.500000| |17.604614|8.913248|0.214369|5.517780|5.639314|3.965425|4.886191|0.130021|13.005794|4.010961|3.287406|2.723472|2.334526|2.265314|2.553655|4.221096|0.094678|1.932869|2.406056|1.659610|3.002976|1.502105|1.418985|1.298642|1.673087|1.233278|2.302963|1.144940|1.168692|1.140925|1.061044|1.078646|1.507801|1.149063|1.997988|0.301593|0.500000| |17.555417|8.814921|0.212033|6.866568|6.223040|3.896452|4.256208|0.114547|10.227187|3.361234|3.734304|2.956016|2.565029|2.574261|3.024522|5.099833|0.121297|2.175226|2.661264|1.797736|3.222021|1.612410|1.498271|1.364981|1.739295|1.270673|2.367976|1.171654|1.185729|1.149638|1.072900|1.100079|1.551229|1.192097|2.082872|0.299719|0.301119|0.500000| |7.078411|8.821232|0.174365|17.519565|12.319214|6.683097|5.670475|0.133508|12.362008|4.195823|6.502594|4.473591|3.621359|3.556507|4.342779|8.417351|0.207153|2.805273|3.469213|2.313497|4.101971|2.049802|1.880026|1.689835|2.124586|1.559866|2.956522|1.409079|1.421818|1.376900|1.273559|1.314338|1.844250|1.426074|2.466248|0.210863|0.143012|0.176357|0.500000| |6.846011|9.003974|0.223830|17.611642|12.359080|5.631915|5.061431|0.136165|10.271096|3.646581|7.263838|4.757679|3.915475|3.967953|5.083457|10.382341|0.277064|3.079102|3.619933|2.381905|4.274896|2.061440|1.875859|1.667455|2.091086|1.516260|2.835252|1.376178|1.388448|1.329525|1.231051|1.273926|1.823110|1.417199|2.475017|0.165413|0.141394|0.203183|0.299199|0.500000| |4.266969|5.774121|0.134860|6.781280|12.398266|17.545059|8.871918|0.174379|12.604585|7.045482|6.510600|5.523649|4.054549|3.483522|3.721244|6.535542|0.127495|2.749535|3.543167|2.494338|4.554243|2.219637|2.108618|1.877114|2.397756|1.800348|3.469823|1.621611|1.670171|1.628554|1.473836|1.502762|2.082175|1.591779|2.705622|0.121321|0.104001|0.102014|0.191587|0.138911|0.500000| |3.641031|5.037859|0.134494|5.626400|12.316823|17.712098|8.926963|0.218325|10.247260|6.840348|7.311428|7.467035|4.928102|3.851643|3.873611|6.590803|0.119454|2.992790|3.782072|2.725916|5.182648|2.360322|2.272107|1.977015|2.540703|1.900411|3.626237|1.719135|1.794820|1.725599|1.542045|1.567799|2.217911|1.695835|2.885923|0.096928|0.091997|0.090418|0.138101|0.127120|0.301708|0.500000| |3.361448|4.259108|0.114629|3.885533|6.211015|6.849049|8.822910|0.212257|10.221626|17.559653|3.740583|3.703472|2.961795|2.520834|2.548325|4.068839|0.079315|2.124929|2.754212|2.021129|3.812667|1.829616|1.811582|1.630841|2.153025|1.636853|3.112075|1.521142|1.612299|1.587429|1.421336|1.413973|1.950318|1.460079|2.477034|0.090328|0.092168|0.080480|0.100553|0.090619|0.173691|0.202262|0.500000| |4.013709|4.894768|0.130260|3.956053|5.635439|5.523523|8.910296|0.214092|13.011329|17.602752|3.291288|3.070271|2.522250|2.240139|2.330376|3.746184|0.075738|1.908330|2.452753|1.772323|3.299526|1.614227|1.582475|1.440635|1.897067|1.432421|2.705173|1.338587|1.405122|1.387269|1.259889|1.255814|1.729418|1.296152|2.214930|0.106667|0.116522|0.092206|0.102644|0.092316|0.143006|0.140725|0.301024|0.500000| |3.926651|4.803944|0.117699|4.310055|6.333827|6.881576|8.846887|0.173449|12.884268|17.574522|3.667415|3.400136|2.752762|2.429110|2.531977|4.113201|0.082858|2.046703|2.670335|1.926162|3.548125|1.763659|1.723837|1.570877|2.057932|1.564279|2.994215|1.444988|1.510450|1.499070|1.358105|1.358138|1.849353|1.388576|2.356776|0.111438|0.106523|0.090280|0.118924|0.096665|0.210846|0.167195|0.299890|0.301527|0.500000| |2.949912|3.807481|0.106350|4.552997|9.522729|7.054183|4.870002|0.135950|6.842578|4.048820|8.804144|17.841977|9.073195|5.603705|5.006936|7.822765|0.127353|4.078767|5.026769|3.666828|7.286559|2.984411|2.832502|2.356938|2.975806|2.185768|4.137283|1.945250|2.019755|1.890086|1.679393|1.732822|2.534696|1.971570|3.368384|0.078304|0.074350|0.077547|0.112768|0.115446|0.162447|0.271915|0.120655|0.093893|0.103920|0.500000| |2.300332|2.746388|0.077128|3.268615|5.710731|3.838835|3.045405|0.085638|4.735624|2.679127|5.629808|9.051572|17.741700|8.838060|5.743185|6.899357|0.111361|6.916011|8.434089|6.500384|14.729134|4.459778|4.017751|3.068778|3.712554|2.610094|4.833485|2.261166|2.290858|2.061970|1.841404|1.954120|3.017548|2.434118|4.215266|0.061757|0.058383|0.062846|0.084732|0.089872|0.098804|0.122106|0.078250|0.065761|0.071204|0.219384|0.500000| |2.810872|3.149485|0.085881|4.121132|5.920840|3.347500|2.782262|0.076344|4.887201|2.331372|5.749241|5.007669|5.664899|8.918017|17.766509|12.583530|0.234127|6.841635|6.871379|3.829914|6.378369|3.102932|2.574117|2.218826|2.644795|1.845151|3.411348|1.629110|1.594131|1.487159|1.389962|1.482305|2.200915|1.771870|3.147758|0.076108|0.068008|0.082211|0.111036|0.130601|0.089294|0.089853|0.062995|0.058928|0.063536|0.108625|0.124167|0.500000| |2.108773|2.345808|0.065302|2.828635|4.241324|2.641560|2.244548|0.062544|3.820978|1.964971|3.953218|4.170157|5.531359|8.926700|7.328847|6.536659|0.116757|17.600448|12.583596|5.822536|9.060097|4.307991|3.310176|2.745898|3.165066|2.127053|3.844564|1.858055|1.788549|1.627711|1.526642|1.657532|2.568645|2.127440|3.859073|0.057136|0.052948|0.060513|0.076012|0.084526|0.070649|0.074802|0.054640|0.050041|0.053383|0.096132|0.139768|0.217430|0.500000| |2.026852|2.301779|0.065208|2.710990|4.239150|2.714888|2.308093|0.065424|3.815445|2.034281|3.965077|4.637980|6.758436|8.939886|5.926656|5.916829|0.102055|17.619316|12.552613|7.366742|13.525972|4.750742|3.796074|2.977344|3.473491|2.318947|4.139875|2.032835|1.983966|1.773095|1.639948|1.774597|2.830320|2.352039|4.274714|0.054334|0.051534|0.057362|0.071186|0.079311|0.071151|0.079709|0.057662|0.051688|0.054523|0.109698|0.193832|0.148834|0.303164|0.500000| |1.873466|2.070860|0.056491|2.462152|3.732070|2.458947|2.070987|0.056518|3.495777|1.872331|3.364864|3.699670|4.796901|6.118479|4.936553|5.127079|0.093014|9.037931|26.069240|9.346989|10.890589|7.497794|4.725369|3.835330|4.100409|2.689002|4.903987|2.249129|2.100624|1.896398|1.786335|1.988917|3.094647|2.638498|4.738856|0.051835|0.047404|0.052651|0.068339|0.070327|0.068107|0.070552|0.052597|0.047383|0.051806|0.089401|0.132666|0.135252|0.232156|0.184932|0.500000| |1.657238|1.830078|0.049649|2.114234|3.237761|2.263226|1.919848|0.051944|3.194100|1.797213|2.790237|3.168892|3.841930|4.018745|3.353800|3.922015|0.072115|4.713183|9.940560|8.953961|10.781901|17.513517|8.795183|6.942083|6.321408|3.990374|7.396546|3.063784|2.739396|2.427982|2.282418|2.638803|4.142414|3.676070|6.324637|0.046254|0.042506|0.045726|0.059227|0.058453|0.063922|0.066272|0.051319|0.045395|0.050246|0.081977|0.115391|0.088177|0.115492|0.117200|0.218423|0.500000| |1.530079|1.680017|0.046211|1.914332|2.899634|2.009763|1.741270|0.047850|2.906396|1.625915|2.484400|2.808121|3.438755|3.682096|3.057269|3.525271|0.065223|4.710646|9.458535|9.011085|11.193370|17.506799|8.810454|6.868283|6.299412|3.681974|6.305770|2.973567|2.638470|2.281290|2.173915|2.525132|4.286976|3.979603|7.408084|0.042301|0.039501|0.042573|0.052876|0.053713|0.055711|0.058842|0.046455|0.041532|0.044951|0.072880|0.105007|0.082043|0.118410|0.126255|0.200551|0.303764|0.500000| |1.470615|1.633909|0.045314|1.823736|2.818821|2.021072|1.764554|0.048877|2.881076|1.677943|2.373506|2.792194|3.333821|3.205736|2.640114|3.195435|0.058660|3.706577|6.337880|6.855140|12.428454|8.870423|17.593521|8.870966|9.570507|5.200469|8.211476|4.132411|3.724371|2.969153|2.715348|3.166391|6.129131|5.995788|10.571277|0.040423|0.038373|0.040437|0.049762|0.050362|0.055548|0.060815|0.048938|0.042835|0.046041|0.076201|0.109297|0.068328|0.089293|0.107105|0.117605|0.173268|0.212483|0.500000| |1.587436|1.777887|0.048747|2.002058|3.142779|2.292164|1.960956|0.053547|3.173589|1.877298|2.651346|3.172017|3.731942|3.442256|2.836714|3.498155|0.063756|3.727185|6.504403|6.896608|12.085686|8.858312|17.576966|8.879899|9.562011|6.168205|11.158774|4.375661|4.033873|3.319575|2.932339|3.388128|5.711807|5.059981|7.938275|0.043954|0.041239|0.043237|0.055133|0.054412|0.063994|0.069596|0.055026|0.047324|0.052009|0.087591|0.122727|0.071973|0.088293|0.102060|0.120978|0.209587|0.173269|0.303161|0.500000| |1.404879|1.534891|0.041700|1.716953|2.596882|1.884159|1.644493|0.044499|2.731758|1.587189|2.137548|2.398805|2.714805|2.682381|2.349266|2.909242|0.054715|2.947250|5.122644|4.559461|7.084281|6.872649|8.813388|17.605692|12.648406|7.232997|12.812344|4.700329|3.719134|3.226116|3.124720|3.947478|6.183546|5.790211|8.900577|0.039340|0.036578|0.038461|0.048183|0.046907|0.053567|0.055434|0.045761|0.040484|0.044604|0.065120|0.082358|0.062144|0.074782|0.078393|0.106932|0.207145|0.168780|0.173576|0.212383|0.500000| |1.321237|1.438484|0.039467|1.599453|2.403232|1.723339|1.522303|0.041679|2.536762|1.460048|1.982284|2.219481|2.547427|2.564353|2.232724|2.726357|0.051362|2.936152|5.038628|4.545468|7.147098|6.878944|8.811296|17.625172|12.678468|5.786398|8.793673|4.400651|3.469798|2.899348|2.864467|3.607229|6.727435|7.351847|13.301271|0.036727|0.034515|0.036432|0.044444|0.044213|0.048273|0.050635|0.042044|0.037539|0.040634|0.059955|0.077843|0.059728|0.075378|0.080595|0.104573|0.171802|0.204805|0.211826|0.173645|0.301249|0.500000| |1.165107|1.275122|0.035289|1.358271|2.055362|1.558864|1.426887|0.039382|2.325989|1.432279|1.614799|1.821242|1.934616|1.793020|1.606484|2.097626|0.039799|1.854267|2.789502|2.391846|4.466410|2.623018|3.319981|3.530202|6.422616|5.644722|8.310997|8.859374|17.539643|8.837020|6.910672|6.376471|10.096960|5.168116|7.369876|0.032222|0.031116|0.031538|0.037304|0.036704|0.043408|0.046871|0.042475|0.037239|0.039615|0.052637|0.059635|0.041952|0.047224|0.052631|0.054456|0.068851|0.068285|0.095961|0.097763|0.089807|0.088363|0.500000| |1.301544|1.439010|0.039699|1.546165|2.374760|1.813101|1.633694|0.044890|2.635651|1.638298|1.880589|2.161118|2.303288|2.091559|1.849536|2.416692|0.045413|2.140930|3.261304|2.861123|5.409335|3.132736|4.132165|4.192539|7.560023|7.319056|11.481932|8.641242|17.578352|8.643426|5.655659|5.646692|8.574057|5.204998|7.241381|0.036025|0.034589|0.035091|0.042467|0.041528|0.050627|0.055151|0.048915|0.042126|0.045373|0.063007|0.072123|0.047705|0.053626|0.060411|0.062915|0.082303|0.078409|0.116248|0.130965|0.107230|0.098595|0.302587|0.500000| |1.165010|1.271758|0.034948|1.343441|2.026145|1.567049|1.444459|0.039490|2.352884|1.479179|1.564100|1.743624|1.801446|1.656478|1.510325|2.010792|0.038412|1.667846|2.481585|2.068839|3.823459|2.228607|2.680331|2.821182|4.716586|4.386288|7.632471|5.603596|8.713445|17.572915|8.670283|5.625856|5.745943|3.397686|5.061439|0.032417|0.031233|0.031284|0.037149|0.035913|0.044161|0.047016|0.044049|0.038484|0.041320|0.050955|0.054524|0.039376|0.042687|0.046621|0.048778|0.060628|0.057378|0.073844|0.081345|0.076592|0.070180|0.217016|0.197518|0.500000| |1.245285|1.362126|0.037158|1.454776|2.203105|1.703382|1.546676|0.041893|2.520730|1.578124|1.711757|1.913560|1.985302|1.825715|1.659604|2.203557|0.041985|1.835455|2.782630|2.333080|4.240348|2.570535|3.134024|3.378306|5.692977|5.898849|11.410388|6.748742|8.830063|17.555247|8.815884|6.868580|6.130767|3.766298|5.430311|0.034834|0.033177|0.033401|0.040517|0.038762|0.048522|0.051059|0.046835|0.040685|0.044460|0.055645|0.060042|0.043168|0.046777|0.050635|0.054993|0.071308|0.065020|0.082977|0.097514|0.094828|0.081220|0.173951|0.214782|0.301488|0.500000| |1.052041|1.136459|0.031229|1.204105|1.792378|1.361937|1.258270|0.034439|2.078828|1.273558|1.390147|1.529671|1.601328|1.510395|1.383674|1.820715|0.035001|1.552412|2.328648|1.927910|3.484182|2.135286|2.552214|2.856662|4.926538|4.398254|7.033101|6.442265|6.926726|8.835288|17.528652|8.780585|7.005273|3.814329|5.671634|0.029315|0.028175|0.028465|0.033413|0.032491|0.038382|0.040316|0.037405|0.033320|0.035617|0.043857|0.048073|0.036556|0.040246|0.043361|0.046473|0.058120|0.056530|0.070589|0.073688|0.077252|0.073678|0.197594|0.139241|0.215979|0.173787|0.500000| |1.081257|1.165789|0.031821|1.237459|1.838661|1.404756|1.293747|0.035117|2.142557|1.316421|1.420200|1.553683|1.613941|1.522511|1.404195|1.858114|0.035821|1.550272|2.335902|1.915341|3.418535|2.130885|2.508111|2.830193|4.726488|4.412736|7.710829|5.613207|5.659538|8.669003|17.583688|8.697424|5.713382|3.385615|5.034888|0.030303|0.028915|0.029164|0.034584|0.033225|0.039992|0.041426|0.038577|0.034341|0.037138|0.044525|0.048038|0.037099|0.040247|0.042781|0.046944|0.059349|0.055872|0.067254|0.073468|0.079753|0.071935|0.139214|0.124440|0.197632|0.214795|0.302635|0.500000| |1.153087|1.245993|0.033924|1.342769|2.002178|1.508743|1.367208|0.037026|2.269113|1.370146|1.571814|1.729179|1.833443|1.749274|1.596449|2.079054|0.039885|1.813019|2.813632|2.343373|4.081549|2.741815|3.330776|4.121502|7.351009|7.580015|12.605204|8.757057|6.041901|6.571358|8.818262|17.582667|7.990558|4.868278|6.764117|0.032356|0.030588|0.031241|0.037647|0.036217|0.043045|0.044429|0.039923|0.035481|0.038686|0.048875|0.054844|0.042264|0.046933|0.049640|0.057112|0.077165|0.071715|0.086311|0.095898|0.119546|0.102294|0.136314|0.136740|0.134858|0.185400|0.175125|0.221957|0.500000| 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