Version2.1 2021-01-12T11:52:04Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 25-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC[C@H](C(=O)N1CC[C@@]2(CCCC[C@@H]2C1)O)Oc3ccc4c(c3)oc(=O)c5c4CCCC5 C02109992 RHF 6-31G(d) (6D,7F) CC[C@H](C(=O)N1CC[C@@]2(CCCC[C@@H]2C1)O)Oc3ccc4c(c3)oc(=O)c5c4CCCC5 C01[X(C26H33N1O5)] 189 C1 546 CC[C@H](C(=O)N1CC[C@]2([C@@H](C1)CCCC2)O)Oc1ccc2c(c1)oc(=O)c1c2CCCC1 CC[C@H](C(=O)N1CC[C@]2([C@@H](C1)CCCC2)O)Oc1ccc2c(c1)oc(=O)c1c2CCCC1 CC[C@@H](Oc1ccc2c(OC(=O)C3=C2CCCC3)c1)C(=O)N4CC[C@]5(O)CCCC[C@@H]5C4 InChIKey=MICDTNYKBXNWCV-VJBLKOIQSA-N InChI=1S/C26H33NO5/c1-2-22(24(28)27-14-13-26(30)12-6-5-7-17(26)16-27)31-18-10-11-20-19-8-3-4-9-21(19)25(29)32-23(20)15-18/h10-11,15,17,22,30H,2-9,12-14,16H2,1H3/t17-,22-,26-/m1/s1 InChI=1/C26H33NO5/c1-2-22(24(28)27-14-13-26(30)12-6-5-7-17(26)16-27)31-18-10-11-20-19-8-3-4-9-21(19)25(29)32-23(20)15-18/h10-11,15,17,22,30H,2-9,12-14,16H2,1H3/t17-,22-,26-/m1/s1 CC[C@H](C(=O)N1CC[C@@]2(CCCC[C@@H]2C1)O)Oc3ccc4c(c3)oc(=O)c5c4CCCC5 C01[X(C26H33N1O5)] 189 C01 546 CC[C@H](C(=O)N1CC[C@]2([C@@H](C1)CCCC2)O)Oc1ccc2c(c1)oc(=O)c1c2CCCC1 CC[C@H](C(=O)N1CC[C@]2([C@@H](C1)CCCC2)O)O[C]1[CH][CH][C]2[C]([CH]1)OC(=O)C1=C2CCCC1 CC[C@@H](O[C]1[CH][CH][C]2[C]([CH]1)OC(=O)C3=C2CCCC3)C(=O)N4CC[C@]5(O)CCCC[C@@H]5C4 InChIKey=MICDTNYKBXNWCV-VJBLKOIQSA-N InChI=1S/C26H33NO5/c1-2-22(24(28)27-14-13-26(30)12-6-5-7-17(26)16-27)31-18-10-11-20-19-8-3-4-9-21(19)25(29)32-23(20)15-18/h10-11,15,17,22,30H,2-9,12-14,16H2,1H3/t17-,22-,26-/m1/s1 InChI=1/C26H33NO5/c1-2-22(24(28)27-14-13-26(30)12-6-5-7-17(26)16-27)31-18-10-11-20-19-8-3-4-9-21(19)25(29)32-23(20)15-18/h10-11,15,17,22,30H,2-9,12-14,16H2,1H3/t17-,22-,26-/m1/s1 3268.8130296691 -1432.6022982 1-A 21356.5312 118 428 546 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MUNgauss RevisionA2.0 retrievium 12-Jan-2021 DUDE CC[C@H](C(=O)N1CC[C@@]2(CCCC[C@@H]2C1)O)Oc3ccc4c(c3)oc(=O)c5c4CCCC5 C02109992 RHF 6-31G(d) (6D,10F) C1 439.235873 |X|Y|Z| 39.691890 47.372586 132.426968
62.912234 27 6 7 8 24 1 2
|36.858105| |12.474578|36.858105| |7.472964|12.453695|36.858105| |6.899440|8.817759|17.603825|0.500000| |4.887477|7.565219|12.371212|0.243507|36.858105| |4.128501|5.878777|8.038111|0.166615|15.853757|73.516695| |4.157145|5.916977|7.648875|0.196970|14.030767|15.090464|53.358707| |4.164922|5.432203|6.405006|0.197672|7.569608|9.391263|17.810269|36.858105| |3.611637|4.503434|4.577763|0.132397|5.243934|7.360308|10.574640|12.461387|36.858105| |2.893294|3.552185|3.690259|0.102974|4.514937|6.895754|8.905659|7.487648|12.402207|36.858105| |2.539215|2.998259|2.965182|0.082085|3.432344|5.474208|6.002719|4.870266|7.470823|12.412792|36.858105| |2.605308|3.088151|2.910965|0.078205|3.327330|5.422891|5.495298|4.177208|5.928056|7.402229|12.444769|36.858105| |2.591908|3.155805|3.007684|0.078222|3.594450|6.117696|5.790103|3.969780|5.013928|6.370811|7.564189|12.456431|36.858105| |2.999903|3.871932|3.806982|0.096246|4.956437|8.420694|8.337588|5.086787|5.992478|7.451441|6.485198|7.545085|12.450949|36.858105| |2.897923|3.694221|3.927024|0.103691|5.315531|8.606388|10.475581|6.497123|7.542262|12.375234|7.521105|6.398419|7.484483|12.401408|36.858105| |2.494542|3.071959|3.282164|0.087516|4.288118|7.325314|7.678192|4.951594|5.556911|8.993872|6.851862|5.688463|6.831491|8.901993|17.518214|0.500000| |3.187650|4.194361|4.958026|0.129140|7.837573|12.417741|17.747164|7.818696|6.575563|7.543103|4.899612|4.335293|4.873412|7.486036|12.439276|0.249465|36.858105| |2.564356|3.044458|3.303700|0.095161|3.969912|6.181489|7.517675|6.469889|7.941363|13.446072|7.925752|5.043587|4.544970|5.103883|8.101462|0.215285|6.601309|73.516695| |6.532159|8.084692|13.566528|0.260846|7.901231|12.761101|7.125922|4.434735|3.435497|2.949002|2.457850|2.435282|2.552868|3.139008|3.186735|0.077214|3.955877|4.840097|73.516695| |4.709097|5.256350|8.021908|0.208145|6.208266|10.619176|6.203094|3.972246|3.064512|2.703464|2.253332|2.185435|2.279686|2.760683|2.901541|0.072171|3.651557|4.615435|24.925289|36.858105| |3.618805|4.101909|5.647090|0.142848|5.404384|10.616812|5.575183|3.444263|2.744578|2.531797|2.125888|2.063539|2.195013|2.659146|2.797266|0.071262|3.551895|4.379227|14.281834|13.687084|36.858105| |2.964384|3.221229|4.170170|0.113000|4.065642|7.734967|4.587235|2.963941|2.411831|2.261332|1.921737|1.845659|1.945343|2.303486|2.457636|0.064008|3.051157|4.014113|9.346357|7.973438|13.845193|36.858105| |2.866151|2.992866|3.806405|0.109616|3.547121|6.347500|4.178886|2.843415|2.316819|2.145402|1.833171|1.744313|1.803487|2.100360|2.261968|0.058967|2.750452|3.859864|8.158788|6.820658|7.861273|13.615346|36.858105| |3.342175|3.383626|4.369347|0.133004|3.773199|6.392273|4.446016|3.130530|2.506990|2.252839|1.917424|1.820844|1.855133|2.157045|2.323657|0.059651|2.807112|4.026768|9.332640|7.999511|6.909876|8.009858|13.738274|36.858105| |4.401450|4.464964|6.186622|0.192631|4.762407|7.733422|5.322988|3.716248|2.888972|2.519284|2.119862|2.028899|2.066728|2.438646|2.601798|0.065312|3.177220|4.393892|14.258070|13.804636|7.914867|6.883452|7.848284|13.754976|36.858105| |3.023651|2.952839|3.606965|0.112792|3.126579|5.215998|3.853392|2.830640|2.320435|2.080392|1.794927|1.696253|1.703090|1.943234|2.096389|0.054158|2.463238|3.756899|7.203704|5.305954|4.638366|5.243703|7.984052|14.098854|8.189006|73.516695| |2.491834|2.448087|2.901334|0.088478|2.623310|4.465436|3.302391|2.424572|2.039228|1.866211|1.630223|1.538153|1.545193|1.742478|1.880519|0.049291|2.179341|3.408803|5.689540|4.009084|3.806888|4.530701|6.780575|8.023012|5.297494|25.118840|36.858105| |2.307228|2.233040|2.575382|0.078878|2.330035|3.938991|2.987083|2.234996|1.913018|1.749713|1.544996|1.456390|1.450412|1.616324|1.740643|0.045758|1.981877|3.205441|4.926766|3.308854|3.105020|3.536243|4.769231|5.556582|4.233203|15.557584|16.052171|73.516695| |2.255792|2.269240|2.694275|0.079681|2.526143|4.426095|3.166629|2.266068|1.919607|1.793346|1.569099|1.483474|1.507818|1.703652|1.837843|0.048687|2.140945|3.287619|5.346282|3.801947|3.931529|5.108925|7.859909|6.865380|4.581364|14.034207|12.937698|14.385730|36.858105| |2.369570|2.439571|2.960853|0.085673|2.826373|5.067593|3.468392|2.409884|2.020200|1.900318|1.648833|1.563792|1.609219|1.840801|1.984969|0.052577|2.355097|3.466606|6.031718|4.475022|5.021619|7.501537|12.995400|7.792750|5.092501|12.190844|7.797360|9.573253|14.218924|36.858105| |2.075735|2.165103|2.575454|0.072715|2.550377|4.703307|3.157807|2.162115|1.847911|1.775909|1.554388|1.479368|1.537104|1.749931|1.878964|0.050478|2.212516|3.248168|5.181236|3.656854|4.347424|6.337212|7.417115|4.982320|3.814052|7.892765|4.946684|6.995017|7.649040|12.587127|36.858105| |1.808607|1.869045|2.173416|0.061919|2.159076|3.935050|2.742221|1.913777|1.664814|1.611551|1.426793|1.353175|1.396199|1.566823|1.685252|0.045685|1.945443|2.975555|4.247379|2.874091|3.241547|4.228454|4.898325|3.831351|3.044895|6.628234|4.428108|6.738666|6.702810|7.501549|12.458647|36.858105| |1.766195|1.787839|2.049235|0.058905|1.988174|3.572201|2.529995|1.794825|1.570960|1.505041|1.342414|1.276949|1.306506|1.454418|1.554142|0.041916|1.771917|2.766764|4.005157|2.681593|2.899057|3.635944|4.405086|3.716321|2.935455|6.889740|4.958005|7.886264|7.568029|6.634205|7.577127|12.491327|36.858105| |1.919582|1.923906|2.222257|0.065196|2.116704|3.728061|2.702567|1.948205|1.688542|1.596572|1.416243|1.339699|1.358514|1.514804|1.628895|0.043601|1.862496|2.942983|4.318268|2.924589|3.040108|3.766946|4.943157|4.450367|3.365315|9.028355|7.562899|12.054323|12.604877|7.554043|6.389509|7.607540|12.478121|36.858105| |17.598715|8.797587|6.784085|0.171162|4.494146|7.104180|5.034345|3.588834|3.086162|2.565109|2.260119|2.309245|2.332388|2.693755|2.615365|0.063641|2.920426|4.125597|12.923936|5.235477|3.948260|3.208416|3.099156|3.638038|4.872762|5.776042|2.652887|4.328874|2.400930|2.533242|2.203734|1.901771|1.866630|2.026590|0.500000| |17.525466|8.769747|6.749406|0.203684|4.512420|6.620162|5.512845|4.347415|3.726055|2.913893|2.547988|2.554235|2.479188|2.833921|2.823310|0.067752|3.096829|4.669472|10.125183|4.494212|3.420024|2.885748|2.881230|3.455486|4.536873|5.729572|2.629970|4.377805|2.327176|2.401447|2.075681|1.823480|1.794473|1.978348|0.301137|0.500000| |17.556442|8.817128|5.465068|0.140617|4.074377|6.339119|4.921328|3.649193|3.365436|2.734822|2.475095|2.601183|2.571253|2.895303|2.721942|0.065529|2.886603|4.265031|8.720869|3.753611|3.052861|2.560689|2.473684|2.817363|3.530778|4.618247|2.196561|3.662961|2.006156|2.094406|1.863873|1.643725|1.610602|1.736875|0.301504|0.301836|0.500000| |8.827578|17.560443|8.974681|0.174715|7.003728|11.079223|7.209302|4.531057|3.954810|3.313662|2.858870|3.031243|3.217371|3.970689|3.600467|0.084161|4.038698|5.022564|13.263795|4.880994|4.060075|3.152984|2.846814|3.109453|3.972702|4.784513|2.272005|3.676407|2.148471|2.335458|2.112315|1.819146|1.730984|1.835698|0.211002|0.172583|0.212012|0.500000| |8.843992|17.547927|8.875439|0.208737|7.064591|9.472899|8.855084|6.428964|5.667344|4.187568|3.519914|3.663726|3.644110|4.471527|4.208453|0.094387|4.542946|6.102464|10.281506|4.258231|3.489013|2.842272|2.671426|2.987869|3.776811|4.749209|2.253891|3.700280|2.092214|2.228104|1.996694|1.748455|1.671240|1.797361|0.173101|0.210376|0.213194|0.303363|0.500000| |5.128901|6.555018|7.582906|0.265092|7.146754|8.769485|12.355070|17.683147|8.913015|5.498615|4.071074|3.677439|3.461294|4.247317|4.878598|0.108538|5.650561|8.632301|8.796619|4.305653|3.535192|3.016455|2.947731|3.364247|4.144366|5.451764|2.570583|4.225398|2.349358|2.472242|2.177263|1.921705|1.825655|2.003240|0.118206|0.156465|0.120494|0.139338|0.217913|0.500000| |3.548449|4.326141|5.276503|0.170323|6.093662|8.200879|12.455544|17.549354|8.848555|6.728501|4.473779|3.671635|3.477913|4.276403|5.714132|0.131119|7.045218|12.664165|7.066625|3.803232|3.365645|2.998238|2.934788|3.220038|3.690585|5.247569|2.551548|4.188283|2.384035|2.519502|2.253900|2.009725|1.877463|2.052117|0.087898|0.104802|0.086729|0.102964|0.133176|0.303367|0.500000| |3.992696|5.077966|4.686049|0.129733|5.169743|7.343522|9.398045|8.884473|17.573832|8.785258|6.908402|6.633753|5.523065|6.470758|6.679109|0.137520|5.685047|10.139585|6.216907|3.012232|2.679416|2.324870|2.217445|2.402979|2.803143|3.943784|1.945110|3.247615|1.830181|1.927735|1.766605|1.587885|1.505634|1.611825|0.092282|0.111720|0.106185|0.124768|0.192485|0.218962|0.174237|0.500000| |3.353094|3.914120|3.939612|0.118471|4.209161|6.080069|7.667804|8.881071|17.500352|8.846683|6.794585|5.216876|4.183803|4.573165|5.503032|0.125057|4.932927|12.913901|5.440909|2.788212|2.487700|2.230268|2.186576|2.387527|2.714609|4.018165|1.999350|3.376907|1.863649|1.932479|1.760714|1.603742|1.526528|1.651546|0.079903|0.099287|0.087759|0.094790|0.133128|0.214002|0.217014|0.303356|0.500000| |2.475433|2.840536|2.788027|0.078842|3.100233|4.896178|5.298474|4.563049|7.009132|8.835741|17.483683|8.797605|5.495219|4.852004|5.487341|0.140383|4.077595|12.434930|4.125741|2.140317|1.999745|1.822882|1.762785|1.860454|2.050155|3.136516|1.605792|2.727551|1.533196|1.594988|1.495685|1.381537|1.309429|1.389090|0.060999|0.070218|0.067387|0.074082|0.092654|0.110195|0.119277|0.178595|0.209034|0.500000| |2.247641|2.623718|2.641756|0.073007|3.078536|5.052220|5.254451|4.089074|5.523043|8.972151|17.527513|8.870186|6.825737|5.700374|6.791814|0.202562|4.526813|13.504135|3.989029|2.091176|2.006906|1.835938|1.748934|1.807644|1.969426|3.013349|1.555228|2.622603|1.510121|1.588503|1.512477|1.396706|1.308764|1.372713|0.056500|0.062495|0.060758|0.070372|0.083083|0.095649|0.109209|0.139887|0.143255|0.303045|0.500000| |2.922440|3.460939|3.133946|0.084105|3.470612|5.537904|5.639649|4.405473|6.400188|6.585140|8.798127|17.520557|8.845729|6.755786|5.591827|0.131001|4.129807|8.044712|4.592626|2.278175|2.114667|1.875779|1.779291|1.878579|2.119252|3.115450|1.577298|2.658349|1.508677|1.585524|1.487652|1.356393|1.287363|1.356929|0.070577|0.079496|0.082229|0.093493|0.118069|0.111713|0.103897|0.227879|0.157488|0.213397|0.173493|0.500000| |2.312830|2.662069|2.505170|0.067706|2.798269|4.637065|4.469751|3.408216|4.558422|5.450618|8.860962|17.539971|8.811772|5.493399|4.817964|0.127649|3.513363|7.467565|3.812427|1.944500|1.847168|1.670469|1.586986|1.651299|1.821289|2.756996|1.417867|2.400389|1.369831|1.436916|1.365983|1.258757|1.191919|1.247034|0.057532|0.063203|0.064819|0.073006|0.085851|0.085569|0.085767|0.137857|0.118886|0.212216|0.216550|0.304367|0.500000| |2.562042|3.081909|2.851138|0.073273|3.312957|5.743579|5.058037|3.445589|4.168248|4.783705|5.500674|8.816896|17.537602|8.825780|5.469852|0.140118|4.055747|6.457129|4.378905|2.180431|2.101559|1.858430|1.719065|1.766855|1.970879|2.885322|1.474242|2.463498|1.439524|1.535615|1.470139|1.335416|1.254280|1.299963|0.064275|0.067157|0.071893|0.089425|0.097902|0.086609|0.083787|0.132010|0.099408|0.123143|0.139865|0.215220|0.210797|0.500000| |2.284693|2.730776|2.671579|0.070102|3.196971|5.565678|5.099850|3.489200|4.238041|5.640866|6.814924|8.864270|17.501428|8.851968|6.751765|0.201481|4.500415|7.848402|4.120216|2.112212|2.066495|1.856688|1.721408|1.752388|1.924077|2.868248|1.477481|2.468562|1.452600|1.551022|1.495414|1.366396|1.273718|1.317463|0.057994|0.061090|0.062640|0.077317|0.085217|0.084293|0.088308|0.121988|0.101643|0.139629|0.201356|0.173863|0.215518|0.303410|0.500000| |3.565243|4.822343|4.480628|0.110147|5.738312|9.329069|9.300072|5.616152|6.489886|6.626059|5.655893|6.762878|8.852571|17.533693|8.790904|0.173833|6.885015|8.129449|6.340194|3.018568|2.833959|2.406247|2.194374|2.285835|2.641444|3.645248|1.816827|2.991599|1.760108|1.899872|1.785883|1.588503|1.483641|1.553524|0.086904|0.091790|0.095912|0.138715|0.162100|0.135265|0.123278|0.219143|0.134224|0.126437|0.131291|0.197593|0.138882|0.215546|0.173835|0.500000| |2.825053|3.623053|3.626266|0.089868|4.799572|8.879175|7.399455|4.283969|4.603821|5.474602|4.864956|5.498444|8.830375|17.542206|8.876596|0.217001|6.897804|7.558501|5.530058|2.755609|2.727856|2.357692|2.113152|2.134011|2.393853|3.387375|1.717114|2.817398|1.698704|1.853165|1.782675|1.589775|1.465725|1.512375|0.072081|0.073143|0.075591|0.106949|0.110669|0.102102|0.103556|0.134606|0.102435|0.106940|0.127762|0.138947|0.123307|0.211926|0.215359|0.304842|0.500000| |2.870892|3.603434|4.356223|0.119687|6.235431|10.055610|12.468187|7.079831|5.798567|6.802932|4.510110|3.788456|4.065941|5.493695|8.853830|0.222950|17.560377|13.061996|6.415028|3.509079|3.465251|3.088106|2.827709|2.860799|3.147309|4.499891|2.262272|3.657045|2.234418|2.453449|2.310933|2.046088|1.849398|1.948911|0.074069|0.079192|0.072026|0.094866|0.106232|0.144026|0.211423|0.132408|0.130401|0.107821|0.120571|0.099134|0.088133|0.094953|0.108946|0.139372|0.143606|0.500000| |3.063957|4.029486|4.757069|0.118204|7.718072|15.025507|12.542391|5.693061|4.923622|5.499394|4.070517|3.838563|4.575646|7.032776|8.821338|0.210333|17.698926|8.753924|7.157648|3.724446|3.790365|3.213052|2.801937|2.787299|3.132680|4.281347|2.142303|3.438410|2.139139|2.390874|2.283110|1.988645|1.794165|1.861437|0.079714|0.080815|0.077380|0.113072|0.116231|0.127366|0.144523|0.127486|0.108410|0.095151|0.107635|0.101600|0.088749|0.110129|0.120008|0.178640|0.212707|0.302098|0.500000| |2.460568|2.844549|3.036250|0.089021|3.480151|5.410969|6.286356|5.729940|7.278069|9.766391|7.518056|4.737402|4.030739|4.272459|5.957093|0.158969|5.059012|35.714590|4.485401|2.415836|2.272386|2.103577|2.053286|2.160680|2.344747|3.641355|1.867025|3.152768|1.786307|1.860953|1.736870|1.605155|1.505243|1.609180|0.061730|0.071002|0.064386|0.072717|0.089247|0.127183|0.178283|0.148132|0.217348|0.215412|0.198203|0.120624|0.113747|0.091885|0.108558|0.109936|0.099937|0.153183|0.110684|0.500000| |3.496357|4.111332|5.428921|0.129156|5.680760|12.647268|5.705178|3.374680|2.745320|2.580087|2.174533|2.138012|2.322750|2.849568|2.938155|0.075029|3.744300|4.399224|13.116396|8.957796|17.780205|8.886334|5.599960|4.976460|5.658522|6.540874|3.143072|4.703444|3.274962|4.071467|3.788558|2.915079|2.589520|2.649556|0.104664|0.089340|0.083573|0.118794|0.097632|0.094077|0.089860|0.075257|0.068125|0.056147|0.057209|0.060578|0.053050|0.062120|0.060807|0.084203|0.083113|0.098967|0.116004|0.062781|0.500000| |2.591448|2.825326|3.518484|0.094175|3.581810|7.035373|4.142781|2.662337|2.218262|2.125357|1.824258|1.756719|1.867578|2.196851|2.334417|0.061766|2.865800|3.790685|7.560268|5.677021|9.021956|17.752859|8.884067|5.674632|4.960356|7.494126|3.907379|5.590037|4.641677|6.848583|7.157222|4.585152|3.731347|3.641286|0.077192|0.069684|0.063486|0.078282|0.070427|0.073939|0.074992|0.059437|0.056993|0.047891|0.048894|0.049189|0.044411|0.049678|0.050003|0.062911|0.063260|0.081006|0.085333|0.055078|0.215557|0.500000| |5.046451|4.755149|6.217079|0.211243|4.477435|6.973156|5.182588|3.813955|2.984137|2.533818|2.146539|2.056036|2.059940|2.402723|2.550739|0.063551|3.036952|4.389129|12.825437|8.873672|5.621622|4.960506|5.622948|8.948305|17.748756|13.385781|4.912575|7.434239|4.012232|4.165498|3.215026|2.683592|2.650811|3.073402|0.154470|0.153879|0.109799|0.112524|0.112035|0.123715|0.104149|0.081017|0.079182|0.058340|0.054886|0.060343|0.051328|0.054661|0.052896|0.073022|0.064523|0.082991|0.081412|0.065883|0.124137|0.107701|0.500000| |2.056821|2.133704|2.503282|0.069522|2.462441|4.603534|3.010109|2.044741|1.762147|1.692865|1.492007|1.434474|1.498035|1.702098|1.801497|0.048331|2.106254|3.060745|5.134715|3.578733|4.332375|6.187208|6.567180|4.559608|3.633599|7.127568|4.327663|6.269377|6.127202|8.970339|17.501809|8.817838|6.574720|5.326471|0.061306|0.056522|0.051549|0.058522|0.054275|0.057407|0.058365|0.047260|0.046492|0.039807|0.040283|0.040163|0.036862|0.040074|0.040432|0.048431|0.048443|0.060229|0.060940|0.045422|0.107117|0.204571|0.085370|0.500000| |2.092996|2.228599|2.681739|0.075076|2.736350|5.121977|3.394420|2.287113|1.946295|1.890988|1.643402|1.558350|1.631014|1.871227|2.025144|0.054695|2.415779|3.474967|5.339281|3.756527|4.656225|6.848340|6.957147|4.688531|3.756725|7.149450|4.237839|6.115148|5.842109|8.936208|17.558334|8.854598|5.536312|4.927497|0.061153|0.057832|0.052164|0.060649|0.057345|0.063063|0.066511|0.051409|0.051121|0.043637|0.044596|0.043278|0.039845|0.043142|0.044247|0.052676|0.053275|0.070710|0.069931|0.051200|0.115180|0.237396|0.087285|0.304312|0.500000| |1.682036|1.743113|2.003285|0.056440|2.009765|3.702927|2.556970|1.773873|1.560076|1.523084|1.357883|1.293685|1.341214|1.498589|1.601809|0.043684|1.834975|2.804976|3.906212|2.591253|2.950442|3.741951|4.052762|3.236603|2.676684|5.530356|3.560013|5.577977|4.908309|5.514219|8.866347|17.548863|8.793107|5.511267|0.049077|0.046790|0.042783|0.047555|0.045426|0.049218|0.051447|0.041490|0.041667|0.036440|0.037080|0.035917|0.033542|0.035745|0.036612|0.042037|0.042483|0.053409|0.052498|0.041979|0.075720|0.116595|0.066058|0.220558|0.207909|0.500000| |1.776703|1.847858|2.156896|0.061990|2.166762|3.918233|2.794993|1.964591|1.708276|1.662324|1.467590|1.379920|1.418847|1.590699|1.730291|0.047128|1.998892|3.105961|4.132670|2.777223|3.090738|3.937493|4.548268|3.677207|2.953364|6.448247|4.296904|6.661604|6.159416|6.542056|8.858717|17.518563|8.878063|6.993894|0.051354|0.050060|0.044856|0.049671|0.048441|0.054418|0.058021|0.044888|0.045865|0.039527|0.040045|0.038275|0.035655|0.037492|0.038696|0.044547|0.044679|0.059162|0.056366|0.046613|0.077479|0.116467|0.072923|0.174234|0.221246|0.303233|0.500000| |1.770955|1.779945|2.023249|0.057641|1.946473|3.517920|2.452229|1.730904|1.520186|1.452403|1.300514|1.246474|1.278797|1.422335|1.504905|0.040479|1.710212|2.645320|4.009602|2.673423|2.899531|3.613945|4.289225|3.626733|2.902592|6.627751|4.613881|7.341349|6.615508|6.128007|6.957886|8.871016|17.510385|8.850923|0.052469|0.049672|0.044975|0.048168|0.045935|0.049132|0.049770|0.040772|0.040933|0.035202|0.035145|0.035008|0.032347|0.034273|0.034557|0.040467|0.039926|0.049085|0.048346|0.039937|0.072265|0.103504|0.072828|0.195838|0.140362|0.210769|0.173933|0.500000| |1.611560|1.629055|1.845804|0.053064|1.801129|3.230014|2.317467|1.654454|1.463812|1.409993|1.266560|1.203906|1.228638|1.357437|1.449865|0.039304|1.636104|2.601297|3.558854|2.334070|2.497540|3.030256|3.543219|3.102233|2.534589|5.811394|4.091107|6.896716|5.531937|4.867736|5.503426|8.813260|17.550298|8.847651|0.047019|0.045558|0.041129|0.043862|0.042626|0.046593|0.048152|0.038960|0.039694|0.034409|0.034427|0.033641|0.031351|0.032782|0.033390|0.038315|0.037967|0.047523|0.045905|0.039470|0.063003|0.086667|0.064708|0.137776|0.123653|0.213267|0.211338|0.303106|0.500000| |1.844008|1.857340|2.143455|0.063420|2.062101|3.604701|2.676111|1.949688|1.695002|1.609111|1.427552|1.340162|1.352347|1.502644|1.629760|0.043804|1.856867|2.998074|4.077058|2.724967|2.804603|3.394349|4.328016|4.018554|3.125898|8.234124|6.643915|11.513151|8.936384|6.078451|5.351188|6.619629|8.822775|17.513217|0.053439|0.053139|0.046465|0.048992|0.048695|0.055391|0.057708|0.044625|0.046328|0.039021|0.038552|0.037589|0.034699|0.035797|0.036538|0.042596|0.041512|0.054508|0.051167|0.045732|0.068544|0.091232|0.080483|0.121810|0.124439|0.138243|0.197912|0.174024|0.219540|0.500000| |1.877621|1.852890|2.107859|0.061912|1.981100|3.471568|2.530557|1.838887|1.606525|1.510889|1.349774|1.282371|1.295009|1.435210|1.532244|0.040915|1.734415|2.769632|4.094722|2.726682|2.771038|3.317519|4.252503|4.064092|3.164578|8.587221|7.199203|13.160106|8.965470|5.794929|4.910538|5.533166|8.807538|17.585808|0.055282|0.053951|0.047430|0.049070|0.048074|0.052949|0.053445|0.042841|0.043864|0.036929|0.036257|0.036219|0.033256|0.034552|0.034811|0.041041|0.039695|0.050036|0.048012|0.042270|0.067538|0.088165|0.082339|0.123280|0.109392|0.123297|0.140769|0.218862|0.206476|0.305680|0.500000|
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