Version2.1 2020-12-19T06:43:49Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 30-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCc1ccc(cc1)[C@@H](C)N(CC(=O)N)C(=O)c2cccc(c2)S(=O)(=O)N3CCCCC3 C60060586 RHF 6-31G(d) (6D,7F) CCCc1ccc(cc1)[C@@H](C)N(CC(=O)N)C(=O)c2cccc(c2)S(=O)(=O)N3CCCCC3 C01[X(C25H33N3O4S1)] 192 C1 565 CCCc1ccc(cc1)[C@H](N(C(=O)c1cccc(c1)S(=O)(=O)N1CCCCC1)CC(=O)N)C CCCc1ccc(cc1)[C@H](N(C(=O)c1cccc(c1)S(=O)(=O)N1CCCCC1)CC(=O)N)C CCCc1ccc(cc1)[C@@H](C)N(CC(N)=O)C(=O)c2cccc(c2)[S](=O)(=O)N3CCCCC3 InChIKey=UPXUSQZXCJOLDH-LJQANCHMSA-N InChI=1S/C25H33N3O4S/c1-3-8-20-11-13-21(14-12-20)19(2)28(18-24(26)29)25(30)22-9-7-10-23(17-22)33(31,32)27-15-5-4-6-16-27/h7,9-14,17,19H,3-6,8,15-16,18H2,1-2H3,(H2,26,29)/t19-/m1/s1 InChI=1/C25H33N3O4S/c1-3-8-20-11-13-21(14-12-20)19(2)28(18-24(26)29)25(30)22-9-7-10-23(17-22)33(31,32)27-15-5-4-6-16-27/h7,9-14,17,19H,3-6,8,15-16,18H2,1-2H3,(H2,26,29)/t19-/m1/s1/f/h26H2 CCCc1ccc(cc1)[C@@H](C)N(CC(=O)N)C(=O)c2cccc(c2)S(=O)(=O)N3CCCCC3 C01[X(C25H33N3O4S1)] 192 C01 565 CCCc1ccc(cc1)[C@H](N(C(=O)c1cccc(c1)S(=O)(=O)N1CCCCC1)CC(=O)N)C CCC[C]1[CH][CH][C]([CH][CH]1)[C@H](N(C(=O)[C]1[CH][CH][CH][C]([CH]1)S(=O)(=O)N1CCCCC1)CC(=O)N)C CCC[C]1[CH][CH][C]([CH][CH]1)[C@@H](C)N(CC(N)=O)C(=O)[C]2[CH][CH][CH][C]([CH]2)[S](=O)(=O)N3CCCCC3 InChIKey=UPXUSQZXCJOLDH-LJQANCHMSA-N InChI=1S/C25H33N3O4S/c1-3-8-20-11-13-21(14-12-20)19(2)28(18-24(26)29)25(30)22-9-7-10-23(17-22)33(31,32)27-15-5-4-6-16-27/h7,9-14,17,19H,3-6,8,15-16,18H2,1-2H3,(H2,26,29)/t19-/m1/s1 InChI=1/C25H33N3O4S/c1-3-8-20-11-13-21(14-12-20)19(2)28(18-24(26)29)25(30)22-9-7-10-23(17-22)33(31,32)27-15-5-4-6-16-27/h7,9-14,17,19H,3-6,8,15-16,18H2,1-2H3,(H2,26,29)/t19-/m1/s1/f/h26H2 3647.2543878731 -1826.2036757 1-A 21472.0676 126 439 565 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0.598525 0.629003 0.629947 0.531554 -1825.605151 -1825.574673 -1825.573729 -1825.672122 3.300117D-04 MUNgauss RevisionA2.0 retrievium 19-Dec-2020 DUDE CCCc1ccc(cc1)[C@@H](C)N(CC(=O)N)C(=O)c2cccc(c2)S(=O)(=O)N3CCCCC3 C60060586 RHF 6-31G(d) (6D,10F) C1 471.219179 |X|Y|Z| 122.176808 68.084631 43.695834 71.366210 22 6 7 16 19 2 1 |36.858105| |12.467926|36.858105| |7.473557|12.405391|36.858105| |4.880792|7.488976|12.588965|36.858105| |4.039799|5.672807|7.525794|13.679607|36.858105| |3.169716|4.162863|5.005085|7.882583|13.796964|36.858105| |2.882373|3.716330|4.388349|6.736219|7.873987|13.659161|36.858105| |3.155055|4.133550|4.997249|7.873044|6.922661|8.013996|13.737180|36.858105| |4.016841|5.612998|7.533991|13.752432|8.024071|6.932974|7.880683|13.714772|36.858105| |2.350095|2.884006|3.245023|4.371615|5.002494|7.547719|12.448144|7.416281|4.957425|36.858105| |2.291693|2.804452|3.044101|3.986414|4.681043|6.909362|8.984898|5.876829|4.312429|17.656172|0.500000| |2.124428|2.531835|2.890519|3.719869|4.354369|6.184668|7.494013|5.216044|3.970341|12.397917|0.250982|36.858105| |2.166050|2.607696|2.879728|3.706999|3.875021|5.033822|7.622004|6.627914|4.469818|12.985090|0.258739|7.652178|53.358707| |2.041214|2.406516|2.706195|3.382181|3.399565|4.138621|5.795110|5.758928|4.136469|7.521637|0.157078|6.394417|17.879562|36.858105| |1.757456|2.023306|2.238393|2.688180|2.747532|3.272372|4.140573|3.960844|3.115445|5.410956|0.126612|5.454620|10.439684|12.463506|36.858105| |1.672935|1.918206|2.111017|2.522162|2.652054|3.200558|3.894214|3.526051|2.826108|5.313830|0.129991|5.965891|9.014178|7.961276|15.922655|73.516695| |1.640555|1.860034|2.043967|2.389447|2.383945|2.729637|3.340152|3.363669|2.769694|3.987079|0.096827|3.969001|7.181545|7.838512|14.008205|15.070252|53.358707| |2.022997|2.405130|2.557517|3.165348|3.262479|4.020746|5.416071|5.048164|3.738338|7.576209|0.206827|5.278895|19.057756|8.106875|6.442971|10.229854|6.686456|36.858105| |1.853063|2.160255|2.284711|2.741051|2.759152|3.255493|4.176536|4.138573|3.233387|5.304240|0.141575|4.225904|11.652648|7.446401|6.888363|10.272853|7.841312|15.797879|73.516695| |2.048150|2.442682|2.513807|3.072393|3.238142|3.960057|4.924015|4.428464|3.474610|6.342919|0.213032|4.514128|10.382410|5.050046|4.357003|7.530512|4.858237|12.657910|14.491111|36.858105| |2.326684|2.839785|2.850137|3.518090|3.722768|4.490682|5.374975|4.856502|3.917611|5.967032|0.206556|4.151276|8.268029|4.236027|3.524989|6.051717|4.050627|7.470193|9.715261|13.715721|36.858105| |2.237164|2.680532|2.597144|3.069731|3.269776|3.754888|4.086889|3.739940|3.256231|4.340308|0.147992|3.353825|5.783083|3.247906|2.847232|4.995487|3.372191|4.998267|7.304054|7.910386|13.747668|36.858105| |1.929961|2.248056|2.189930|2.527375|2.692630|3.067939|3.301900|3.024641|2.660579|3.656222|0.122816|3.005589|5.006708|2.915807|2.684873|4.810049|3.217362|4.444258|6.874494|6.839777|7.936854|13.773884|36.858105| |1.762661|2.036152|2.026983|2.347703|2.493152|2.884670|3.192608|2.915376|2.510313|3.743910|0.124419|3.138746|5.390068|3.148575|3.005583|5.465174|3.582723|5.080738|8.094470|7.941784|6.903841|7.966011|13.721991|36.858105| |1.803607|2.100588|2.137056|2.525355|2.668597|3.166623|3.688785|3.352462|2.773740|4.614457|0.152140|3.739432|7.193607|4.013789|3.832226|6.924348|4.430283|7.728583|11.883748|13.712978|7.938825|6.865384|7.899179|13.755323|36.858105| |1.520923|1.718069|1.707852|1.930919|2.042206|2.310262|2.492868|2.304801|2.036686|2.873834|0.091508|2.572099|4.113574|2.564051|2.562624|4.745877|3.148833|3.666258|6.279765|4.721066|4.199236|4.729162|6.947389|10.717911|6.950550|388.023441| |1.431783|1.608142|1.612943|1.819110|1.900071|2.142942|2.350920|2.208197|1.943423|2.732978|0.084269|2.478196|4.066676|2.613773|2.694853|4.980331|3.376625|3.684327|6.703961|4.398100|3.697635|3.853623|4.994375|7.355299|6.441517|94.835055|73.516695| |1.496787|1.676797|1.640399|1.826114|1.919573|2.125229|2.249745|2.108840|1.905983|2.497379|0.078659|2.237205|3.512589|2.221315|2.185603|3.992286|2.726134|3.038899|5.205358|3.836959|3.706559|4.444069|6.535807|7.375267|4.972766|94.727965|13.601572|73.516695| |1.460651|1.644043|1.648077|1.862378|2.007414|2.287870|2.415414|2.179853|1.931801|2.817857|0.090492|2.630686|3.881466|2.435985|2.476382|4.734840|3.008348|3.287400|5.516119|4.038117|3.635096|3.988750|5.319515|6.931298|5.426218|82.649125|13.722445|13.716785|53.358707| |1.428679|1.609094|1.639523|1.866138|2.022043|2.337009|2.490077|2.220412|1.943637|3.001509|0.095434|2.902866|4.154604|2.634538|2.770224|5.482428|3.324005|3.468529|5.855001|4.026021|3.448702|3.525264|4.297181|5.626160|5.295534|50.802131|11.665739|8.862986|17.678255|36.858105| |1.314768|1.464617|1.493516|1.678603|1.823140|2.078058|2.166518|1.938821|1.725847|2.550057|0.079282|2.556801|3.458590|2.260296|2.395766|4.767532|2.921602|2.769779|4.716562|3.081571|2.751630|2.823801|3.305749|3.935483|3.729372|34.421277|8.161317|6.992813|10.609575|12.483996|36.858105| |1.335212|1.484469|1.505130|1.682711|1.848287|2.093952|2.128110|1.889384|1.702096|2.452629|0.077011|2.466719|3.218272|2.088562|2.159335|4.251498|2.626284|2.520691|4.203021|2.843800|2.653718|2.793251|3.238850|3.608423|3.305158|29.991828|6.599769|6.599469|9.007628|7.550753|12.460818|36.858105| |1.367160|1.519028|1.518179|1.687537|1.844681|2.066974|2.090940|1.873835|1.702520|2.360139|0.074743|2.298560|3.102379|1.993720|2.017567|3.881448|2.469583|2.464937|4.098187|2.873615|2.762197|3.042662|3.667899|3.946964|3.371038|34.428529|6.988372|8.160660|10.610231|6.523120|7.589850|12.460537|36.858105| |1.495396|1.680745|1.671649|1.878073|2.050844|2.321225|2.378614|2.125547|1.910867|2.707970|0.087899|2.544608|3.582318|2.241370|2.232533|4.252346|2.705846|2.925752|4.793046|3.598065|3.469028|3.972892|5.181511|5.659859|4.406503|50.845963|8.867671|11.644189|17.692860|7.712496|6.523195|7.549046|12.481720|36.858105| |17.535919|8.772344|6.774130|4.512942|3.942045|3.076899|2.735158|2.913183|3.620556|2.250407|0.061004|2.076166|2.792474|1.940561|1.686802|2.877125|2.140002|1.904879|3.101543|1.925408|2.165775|2.089003|1.821234|1.671888|1.708310|10.341799|2.432901|2.541538|1.920592|1.385908|1.284766|1.311087|1.337500|1.451548|0.500000| |17.552372|8.780101|5.453450|4.047906|3.501469|2.854734|2.623096|2.838424|3.476063|2.186386|0.060021|1.970649|2.766729|1.904310|1.654335|2.808349|2.108611|1.929907|3.156579|1.980513|2.261927|2.217255|1.921789|1.740826|1.760716|10.734743|2.517387|2.666671|1.965960|1.401243|1.290653|1.314284|1.355888|1.484342|0.301701|0.500000| |17.536456|8.772797|6.775382|4.512540|3.630322|2.921220|2.734472|3.065326|3.926014|2.246745|0.060167|2.039392|2.866767|2.019136|1.739753|2.922735|2.232525|1.965963|3.235602|1.962291|2.197848|2.093018|1.818851|1.679117|1.730492|10.350300|2.457421|2.539888|1.896041|1.367875|1.259298|1.270696|1.296301|1.414803|0.301680|0.301725|0.500000| |8.847226|17.526958|8.850509|6.886463|5.101530|4.008551|3.782772|4.390038|5.979680|2.950995|0.079830|2.525048|3.721867|2.511657|2.093013|3.492920|2.629546|2.559315|4.098565|2.608212|3.071418|2.886196|2.389630|2.152364|2.223972|12.794926|2.999049|3.127860|2.310037|1.651661|1.490694|1.500911|1.543036|1.722407|0.172804|0.212437|0.210402|0.500000| |8.848858|17.525319|8.846456|6.886591|6.085622|4.437522|3.784152|3.977315|5.044790|2.958985|0.081792|2.595068|3.564415|2.365959|2.003210|3.416251|2.482837|2.429556|3.837526|2.523931|2.986154|2.875650|2.394910|2.137240|2.177733|12.778601|2.955062|3.130839|2.354408|1.683366|1.533048|1.568124|1.613286|1.789350|0.210428|0.212478|0.172823|0.304157|0.500000| |6.887936|8.850714|17.528332|8.914842|7.098928|4.717578|3.953160|4.217600|5.687021|3.016355|0.079032|2.790744|3.593738|2.498107|2.107570|3.579415|2.619405|2.339959|3.729185|2.303888|2.576399|2.377338|2.037726|1.895602|1.988223|11.500799|2.713472|2.763591|2.150636|1.578675|1.452381|1.472983|1.479520|1.612995|0.204426|0.140630|0.169495|0.173801|0.211671|0.500000| |6.884783|8.851790|17.532547|8.916906|5.656442|4.212376|3.952780|4.721650|7.147501|3.008653|0.077278|2.704630|3.756280|2.672041|2.213290|3.668457|2.793872|2.455895|3.968371|2.368170|2.631479|2.384070|2.035051|1.906632|2.023763|11.515303|2.748002|2.762166|2.117089|1.552728|1.416445|1.417079|1.425017|1.563752|0.169341|0.140609|0.204354|0.211889|0.173776|0.304035|0.500000| |4.161016|5.590196|6.978274|8.903059|17.693852|8.965154|5.626582|4.976049|5.678061|4.097836|0.110530|3.779851|4.420067|2.890121|2.422715|4.222880|2.893526|2.812941|4.300090|2.843289|3.247115|2.972907|2.500191|2.302877|2.415585|13.672028|3.164063|3.244781|2.603232|1.919720|1.754767|1.802150|1.802707|1.981715|0.118187|0.100272|0.100871|0.131204|0.177810|0.211498|0.143128|0.500000| |2.830494|3.565525|4.096513|5.637161|8.987762|17.707067|8.881798|5.670437|4.982615|7.032879|0.197545|6.545484|6.263871|3.768928|3.133075|5.646844|3.536280|3.778985|5.460937|3.830912|4.259830|3.694100|3.098588|2.924341|3.164957|16.840064|3.865103|3.859492|3.273201|2.474822|2.219618|2.269185|2.222414|2.478253|0.077761|0.072004|0.072136|0.094434|0.108101|0.112218|0.097159|0.218392|0.500000| |2.815654|3.538440|4.095347|5.640903|4.981000|5.669558|8.908028|17.751647|8.969969|6.826824|0.150129|4.847850|10.316298|7.079638|4.518253|6.787710|5.287521|5.811911|8.711594|4.697204|4.866028|3.669191|3.019677|2.981180|3.520397|16.758172|4.088943|3.803528|2.985029|2.242039|1.942222|1.863857|1.845329|2.098507|0.071927|0.071492|0.077448|0.106753|0.093605|0.097410|0.112545|0.107969|0.124128|0.500000| |4.111954|5.481027|6.979271|8.928358|5.675458|4.981415|5.633777|8.944542|17.694019|4.055709|0.099665|3.350679|5.334736|3.798899|2.917632|4.642190|3.645539|3.406737|5.438978|3.144011|3.486309|2.954808|2.454824|2.327614|2.560022|13.615446|3.280465|3.208086|2.449469|1.803937|1.607236|1.577661|1.582631|1.769781|0.100260|0.098806|0.117122|0.171695|0.128778|0.144089|0.214337|0.124359|0.107996|0.218246|0.500000| |1.905641|2.232118|2.492265|3.092367|3.516122|4.658866|5.481362|4.211733|3.309123|8.808266|0.213683|17.640016|9.719847|6.188277|6.119077|13.624461|5.837878|5.386440|7.901273|4.559245|3.947717|3.243396|3.018264|3.270706|3.970151|19.426540|4.747520|4.138441|3.867868|3.251036|2.851986|2.691040|2.448716|2.694020|0.051737|0.049607|0.051011|0.062232|0.063549|0.066973|0.065448|0.087246|0.138370|0.114350|0.080201|0.500000| |2.167391|2.580756|2.942710|3.756489|4.667147|6.764998|6.802535|4.664347|3.777599|8.838012|0.221603|17.585896|7.610650|4.722215|4.176047|8.134389|4.417022|4.290942|6.231246|3.989042|3.860851|3.255659|2.922354|2.979997|3.401260|17.591259|4.159370|3.878826|3.514656|2.824590|2.538753|2.518124|2.345653|2.568647|0.059521|0.055814|0.057159|0.070244|0.074726|0.080592|0.075059|0.116493|0.229549|0.115292|0.087802|0.300378|0.500000| |2.129448|2.517394|2.947390|3.767751|4.261574|5.668468|6.833786|5.248502|4.072472|8.701308|0.174594|17.584586|9.034697|6.681580|5.638383|10.429942|5.708867|4.591047|6.909220|3.808083|3.544169|2.907104|2.614113|2.717266|3.200494|16.184846|3.956078|3.565194|3.139463|2.529157|2.266332|2.181801|2.038268|2.226875|0.057996|0.054366|0.057406|0.069376|0.070409|0.079482|0.078013|0.102479|0.156437|0.137170|0.096561|0.301443|0.303412|0.500000| |2.129096|2.513498|2.913412|3.686141|3.710014|4.512654|6.278613|6.219067|4.494866|7.399784|0.147282|7.097376|12.501070|17.631872|8.984930|12.056339|8.794643|5.838711|9.343829|4.174918|3.735597|2.947390|2.630524|2.773636|3.390853|16.331331|4.109338|3.592684|3.023590|2.397139|2.101994|1.973233|1.878283|2.083896|0.056625|0.054523|0.058652|0.071801|0.068197|0.075331|0.080290|0.086912|0.112540|0.199423|0.112882|0.175120|0.144117|0.240815|0.500000| |2.068560|2.428730|2.708808|3.327616|3.205028|3.725197|5.095683|5.682421|4.210326|5.785965|0.129604|4.788631|12.467040|17.614919|8.848111|10.461620|10.356374|7.309275|13.466772|4.722498|4.069364|3.147602|2.813415|3.007461|3.777875|17.494469|4.496475|3.840623|3.111652|2.424646|2.084652|1.927825|1.864672|2.100262|0.054081|0.053712|0.057427|0.071544|0.065404|0.068467|0.075627|0.075730|0.092470|0.214945|0.112390|0.127614|0.105878|0.139096|0.303684|0.500000| |1.671663|1.893959|2.068785|2.405063|2.353821|2.655319|3.267127|3.417304|2.833815|3.763319|0.092081|3.563895|6.902386|7.350793|9.393589|10.997115|26.042604|4.928055|10.821797|3.576749|3.010303|2.500976|2.371640|2.622663|3.232105|16.296845|4.382696|3.558522|2.920729|2.325867|2.034193|1.835777|1.749759|1.929978|0.044197|0.043932|0.046663|0.055182|0.051252|0.053600|0.058155|0.058081|0.069225|0.112933|0.077552|0.103576|0.082319|0.103662|0.164594|0.236839|0.500000| |1.513531|1.700370|1.852826|2.136903|2.148576|2.443176|2.905801|2.882330|2.427306|3.458448|0.086627|3.532872|5.924724|5.727644|9.556551|13.901407|25.992531|4.226216|8.819680|3.236594|2.700022|2.299797|2.237485|2.517218|3.071957|16.170796|4.401134|3.490664|2.984240|2.452689|2.178842|1.936409|1.804934|1.957296|0.040457|0.039887|0.041985|0.048873|0.046523|0.048826|0.051570|0.053935|0.065611|0.090110|0.065286|0.108746|0.082276|0.102169|0.137950|0.152317|0.315238|0.500000| |2.648462|3.339746|3.377132|4.340630|4.511035|5.448773|6.828126|6.377635|4.988645|6.615036|0.211237|4.349897|8.714730|4.481947|3.526182|5.910317|4.060013|6.851464|8.977244|8.899353|17.741359|8.948840|5.656472|4.969994|5.643942|24.146289|5.466269|5.481372|4.132460|2.935020|2.425263|2.363340|2.435224|2.952233|0.067730|0.070734|0.069283|0.101802|0.097087|0.082844|0.085750|0.105064|0.134482|0.171170|0.119721|0.109343|0.112343|0.105239|0.112806|0.121333|0.084390|0.074004|0.500000| |2.429552|2.928097|2.749498|3.195201|3.389358|3.739993|3.888266|3.626092|3.300728|3.861634|0.127278|3.050764|4.990582|2.901456|2.530833|4.420741|3.038576|4.070884|6.109592|5.637375|8.924681|17.731016|8.929731|5.657206|4.949535|27.786295|5.754402|6.918882|4.646689|3.019685|2.514162|2.543255|2.795981|3.538370|0.062644|0.067673|0.062348|0.088100|0.088930|0.069651|0.069273|0.086803|0.101507|0.096426|0.083407|0.080476|0.083994|0.074745|0.074936|0.078877|0.062783|0.057611|0.216282|0.500000| |1.850029|2.124516|2.041538|2.306254|2.451687|2.725961|2.851794|2.640011|2.386573|3.075016|0.100748|2.614822|4.155679|2.505502|2.335883|4.199355|2.844626|3.555466|5.676845|4.938158|5.640788|8.896886|17.758362|8.920484|5.637768|47.271908|8.227796|13.459190|7.106201|3.995406|3.200036|3.226812|3.837782|5.475729|0.048653|0.051676|0.048301|0.062453|0.063211|0.053143|0.052703|0.064385|0.077023|0.072691|0.061711|0.072878|0.071736|0.064067|0.063781|0.067549|0.058258|0.055430|0.124250|0.214284|0.500000| |1.665773|1.917780|1.968839|2.305378|2.420409|2.850460|3.321279|3.053625|2.538309|4.203786|0.131464|3.598719|6.819873|4.050841|4.139267|7.621653|4.834924|7.239561|12.828124|8.921935|5.652066|4.953376|5.630864|8.904977|17.765182|47.074853|13.040276|8.136618|7.303635|5.724974|3.959470|3.328477|3.281381|4.112400|0.044018|0.045070|0.044713|0.056111|0.054763|0.051198|0.052308|0.061159|0.079328|0.090400|0.065760|0.110067|0.089609|0.086956|0.093736|0.105516|0.097029|0.095139|0.124183|0.107567|0.124122|0.500000| |1.525658|1.734297|1.781766|2.056021|2.257886|2.666386|2.852040|2.481529|2.140639|3.551986|0.115983|3.455889|4.813056|2.970172|3.103391|6.260361|3.613257|3.969147|6.449333|4.639473|3.900679|3.870517|4.555193|5.898749|5.945544|43.553677|9.735473|7.842747|12.301837|17.469034|8.833527|6.766289|5.699580|6.906221|0.041148|0.041341|0.040465|0.049302|0.050540|0.047667|0.046633|0.059239|0.079420|0.069107|0.054548|0.109476|0.093505|0.081419|0.075032|0.074347|0.069487|0.073256|0.091715|0.090829|0.113067|0.173245|0.500000| |1.390316|1.562439|1.596847|1.815676|1.942074|2.235646|2.424449|2.196142|1.914504|2.933753|0.091086|2.826723|4.217841|2.724495|2.934294|5.797873|3.566375|3.602713|6.322641|4.045729|3.344672|3.329839|3.999703|5.420102|5.462172|49.868711|14.146768|8.448408|12.476824|17.673638|8.851696|5.511045|4.911105|5.640051|0.037353|0.037837|0.037195|0.044759|0.045031|0.042548|0.042326|0.050868|0.064781|0.062554|0.049743|0.088648|0.074742|0.069325|0.067900|0.070143|0.069400|0.073989|0.079363|0.078931|0.101889|0.181009|0.300825|0.500000| |1.289480|1.434729|1.476388|1.661976|1.807047|2.066932|2.160317|1.927812|1.710826|2.566425|0.078594|2.645541|3.482632|2.311764|2.501702|5.081636|3.046306|2.740389|4.693104|2.944034|2.601219|2.599414|2.944605|3.476550|3.464660|28.480404|7.073064|5.840548|7.680018|8.908439|17.542519|8.797741|5.508168|4.888546|0.035097|0.035005|0.034404|0.040422|0.041550|0.040013|0.039009|0.048279|0.061466|0.053719|0.044235|0.083518|0.072765|0.065441|0.060000|0.058702|0.058201|0.063735|0.064606|0.064550|0.078005|0.104209|0.216527|0.212316|0.500000| |1.240157|1.372450|1.392912|1.552069|1.668316|1.877668|1.960269|1.781873|1.599057|2.270530|0.069620|2.258915|3.122920|2.070984|2.199531|4.314701|2.733723|2.516766|4.370356|2.779406|2.498773|2.584089|3.040127|3.596168|3.365957|33.284484|8.252193|7.006410|9.528788|8.915561|17.545337|8.840101|6.811483|5.717853|0.033626|0.033932|0.033091|0.038901|0.039771|0.037592|0.036861|0.044662|0.055132|0.049861|0.041704|0.069243|0.061973|0.056452|0.053465|0.053751|0.053285|0.056969|0.061496|0.064478|0.083239|0.100144|0.174105|0.218245|0.302198|0.500000| |1.407193|1.572937|1.604200|1.806213|2.011259|2.304437|2.319019|2.023602|1.815400|2.694971|0.085569|2.752415|3.450510|2.217541|2.278026|4.527142|2.730620|2.653832|4.342100|2.988033|2.805420|2.919553|3.299808|3.613306|3.382764|27.804882|6.080299|6.074754|7.842454|6.776861|8.850153|17.495859|8.849176|6.773828|0.038496|0.038321|0.037077|0.043950|0.046347|0.043763|0.041735|0.054613|0.070525|0.054939|0.046339|0.083643|0.079375|0.066750|0.058618|0.056212|0.052687|0.055576|0.069794|0.073918|0.089743|0.093186|0.198463|0.139102|0.215057|0.173622|0.500000| |1.252524|1.381542|1.401240|1.552795|1.699607|1.904325|1.922522|1.720155|1.564042|2.185531|0.067451|2.225908|2.869142|1.894644|1.967968|3.865601|2.420798|2.220458|3.739550|2.452805|2.307885|2.415256|2.744037|3.000127|2.789950|24.682513|5.621725|5.623904|6.725621|5.498501|8.815928|17.550001|8.817414|5.498134|0.034291|0.034272|0.033170|0.038664|0.040455|0.038276|0.036754|0.046326|0.057217|0.047116|0.040449|0.067144|0.063364|0.055473|0.050132|0.048787|0.046995|0.049842|0.058010|0.062041|0.076572|0.078562|0.138921|0.123543|0.209824|0.214466|0.303193|0.500000| |1.377516|1.525548|1.517830|1.676861|1.843347|2.048312|2.036486|1.822047|1.672422|2.259339|0.071432|2.208489|2.921029|1.880746|1.882873|3.602947|2.307016|2.283554|3.769509|2.649824|2.616437|2.908183|3.411176|3.489916|3.003262|28.485664|5.837963|7.068181|7.679718|4.888333|5.507725|8.796605|17.538060|8.904153|0.037584|0.038040|0.036127|0.042817|0.045281|0.041296|0.039408|0.050557|0.061596|0.049391|0.043113|0.064470|0.063516|0.054589|0.049721|0.048926|0.045469|0.046634|0.065022|0.076064|0.100839|0.079906|0.127834|0.107926|0.123177|0.139268|0.215005|0.209860|0.500000| |1.286331|1.419444|1.413946|1.559487|1.685663|1.869010|1.900783|1.728355|1.579427|2.126550|0.066326|2.066093|2.840411|1.850421|1.882970|3.596351|2.336483|2.270464|3.842072|2.616115|2.507024|2.758406|3.331608|3.605185|3.082422|33.288523|6.993236|8.263840|9.528250|5.716689|6.811448|8.840530|17.545569|8.916737|0.034913|0.035544|0.034006|0.040167|0.041672|0.038233|0.037067|0.045736|0.055190|0.047603|0.041114|0.061031|0.058053|0.051525|0.048341|0.048523|0.046209|0.047686|0.061716|0.070859|0.098213|0.084675|0.131821|0.128864|0.139277|0.199936|0.173619|0.214519|0.302203|0.500000| |1.497898|1.676871|1.647302|1.833889|1.985040|2.212075|2.257630|2.047537|1.862351|2.508887|0.080691|2.323089|3.336598|2.098221|2.065781|3.869926|2.531430|2.734717|4.510594|3.385125|3.374758|4.032227|5.411199|5.468228|4.076896|49.921071|8.446156|14.114680|12.483236|5.639516|4.911931|5.510935|8.853234|17.669790|0.040268|0.041594|0.039311|0.047940|0.049690|0.044032|0.042808|0.053436|0.064901|0.056170|0.048204|0.067222|0.065070|0.057089|0.054276|0.055336|0.050654|0.050695|0.080083|0.102203|0.175119|0.103770|0.142028|0.127550|0.107941|0.128923|0.139050|0.123561|0.212251|0.218409|0.500000| 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