Version2.0 2020-03-04T00:45:18Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 31-Dec-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CO[C@H]1[C@@H](c2ccccc2C13CC[NH+](CC3)Cc4ccc5cccc(c5n4)F)NC(=O)c6ccco6 C12022196 RHF 6-31G(d) (6D,7F) CO[C@H]1[C@@H](c2ccccc2C13CC[NH+](CC3)Cc4ccc5cccc(c5n4)F)NC(=O)c6ccco6 C01[X(C29H29F1N3O3)] 189 C1 598 CO[C@H]1[C@H](NC(=O)c2ccco2)c2c(C31CC[NH+](CC3)Cc1ccc3c(n1)c(F)ccc3)cccc2 CO[C@H]1[C@H](NC(=O)c2ccco2)c2c(C31CC[NH+](CC3)Cc1ccc3c(n1)c(F)ccc3)cccc2 CO[C@H]1[C@H](NC(=O)c2occc2)c3ccccc3C14CC[NH+](CC4)Cc5ccc6cccc(F)c6n5 InChIKey=WCCSPNRMISKHQT-SXOMAYOGSA-O InChI=1S/C29H28FN3O3/c1-35-27-26(32-28(34)24-10-5-17-36-24)21-7-2-3-8-22(21)29(27)13-15-33(16-14-29)18-20-12-11-19-6-4-9-23(30)25(19)31-20/h2-12,17,26-27H,13-16,18H2,1H3,(H,32,34)/p+1/t26-,27+/m1/s1 InChI=1/C29H28FN3O3/c1-35-27-26(32-28(34)24-10-5-17-36-24)21-7-2-3-8-22(21)29(27)13-15-33(16-14-29)18-20-12-11-19-6-4-9-23(30)25(19)31-20/h2-12,17,26-27H,13-16,18H2,1H3,(H,32,34)/p+1/t26-,27+/m1/s1/fC29H29FN3O3/h32-33H/q+1 CO[C@H]1[C@@H](c2ccccc2C13CC[NH+](CC3)Cc4ccc5cccc(c5n4)F)NC(=O)c6ccco6 C01[X(C29H29F1N3O3)] 189 C01 598 CO[C@H]1[C@H](NC(=O)c2ccco2)c2c(C31CC[NH+](CC3)Cc1ccc3c(n1)c(F)ccc3)cccc2 CO[C@H]1[C@H](NC(=O)c2ccco2)c2c([C@@]31CC[NH](CC3)C[C@@H]1C=C[C@@H]3[C@@H](N1)[C@H](F)CC=C3)cccc2 CO[C@H]1[C@H](NC(=O)c2occc2)c3ccccc3C14CC[NH](CC4)C[C@H]5N[C@H]6[C@H](F)CC=C[C@@H]6C=C5 InChIKey=MWNJJDLJIVEAMM-BMMIIBTBSA-N InChI=1S/C29H35FN3O3/c1-35-27-26(32-28(34)24-10-5-17-36-24)21-7-2-3-8-22(21)29(27)13-15-33(16-14-29)18-20-12-11-19-6-4-9-23(30)25(19)31-20/h2-8,10-12,17,19-20,23,25-27,31,33H,9,13-16,18H2,1H3,(H,32,34)/t19-,20+,23-,25-,26-,27+/m1/s1 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CO[C@H]1[C@@H](c2ccccc2C13CC[NH+](CC3)Cc4ccc5cccc(c5n4)F)NC(=O)c6ccco6 C12022196 RHF 6-31G(d) (6D,10F) C1 486.219295 |X|Y|Z| 29.624731 56.260839 146.491340 62.501560 32 6 7 8 28 3 1 |36.858105| |13.503289|73.516695| |7.956806|24.299631|36.858105| |7.233113|16.653501|17.473997|0.500000| |6.189232|13.551671|12.309684|0.247550|36.858105| |6.049999|12.908724|8.793635|0.175932|17.610662|0.500000| |4.264982|9.345406|8.028460|0.190036|12.591169|0.245187|36.858105| |3.363543|6.835908|5.125574|0.132637|7.314727|0.171996|13.761961|36.858105| |2.785138|5.664670|4.066536|0.108018|4.969645|0.122912|7.987692|13.749076|36.858105| |2.711432|5.677943|4.065898|0.108063|4.474080|0.110828|6.911120|7.913582|13.718380|36.858105| |3.119556|6.879910|5.119216|0.132705|5.144650|0.124532|7.929299|6.818331|7.906306|13.744300|36.858105| |4.016634|9.411444|8.029501|0.190445|7.968863|0.177276|13.759816|7.908722|6.890800|7.973734|13.742404|36.858105| |5.090999|13.974742|12.246399|0.245417|7.703528|0.179883|7.952818|5.133367|4.458190|4.947191|7.260172|12.512959|36.858105| |4.535108|12.013401|7.349761|0.151883|5.851964|0.165220|5.816491|4.248791|3.822352|4.225707|5.735735|7.632346|12.290349|36.858105| |4.557106|11.633388|5.743486|0.128784|4.408275|0.126283|4.087820|3.207305|2.934692|3.193940|4.053152|4.891186|7.321548|12.487771|36.858105| |3.972610|9.474785|4.932890|0.122255|3.700698|0.100239|3.563599|2.870046|2.706369|3.021781|3.860389|4.394466|6.382751|7.638732|12.695934|53.358707| |3.355497|7.728929|4.300660|0.108391|3.397953|0.091748|3.439298|2.830043|2.746954|3.154693|4.067841|4.360882|5.851578|7.040653|9.208951|25.564185|0.500000| |4.449538|10.718780|5.929505|0.159334|4.074650|0.103928|3.897272|3.076425|2.872076|3.203255|4.156020|4.874007|7.470441|6.554753|7.679015|17.267126|0.260387|36.858105| |4.312598|10.628676|7.400785|0.201390|4.998440|0.120045|5.207027|3.915230|3.670920|4.253266|6.062850|7.454480|12.390427|7.618016|6.498667|10.470134|0.202040|12.510512|36.858105| |3.500399|7.596926|3.766571|0.096844|2.976477|0.082012|2.818099|2.358196|2.235317|2.446267|2.969169|3.280289|4.322454|4.967079|7.646352|17.423309|0.264643|7.677777|4.997868|36.858105| |2.798150|5.845476|3.069623|0.081588|2.514719|0.068481|2.463329|2.118729|2.059456|2.284890|2.733420|2.878965|3.559092|3.898085|5.089188|10.525921|0.222091|5.948444|4.294681|12.548053|36.858105| |2.470265|4.940194|2.573690|0.069472|2.160015|0.059063|2.100103|1.840164|1.790213|1.957581|2.278451|2.385454|2.852581|3.055875|3.820441|6.856727|0.139358|4.347677|3.332527|7.483531|13.454518|36.858105| |2.126078|4.202460|2.245717|0.061243|1.924989|0.052439|1.903000|1.695192|1.671782|1.835827|2.107475|2.155877|2.494694|2.631424|3.118669|5.368340|0.114390|3.563349|2.909740|5.048025|8.013721|14.033950|36.858105| |2.026094|4.051049|2.224742|0.060786|1.921923|0.052037|1.941835|1.741029|1.743015|1.943538|2.234050|2.230878|2.533732|2.656234|3.039047|5.245313|0.118466|3.517964|2.996356|4.481952|6.969344|7.916716|13.416765|36.858105| |1.770052|3.488990|1.937982|0.053311|1.707423|0.046207|1.739384|1.585031|1.602033|1.781974|2.008973|1.976439|2.183103|2.261614|2.503462|4.123525|0.092361|2.847835|2.535802|3.363402|4.592337|5.117958|7.625842|13.445031|36.858105| |1.684817|3.332042|1.884239|0.051910|1.678425|0.045268|1.737496|1.598328|1.637196|1.838689|2.058495|1.983483|2.144988|2.206986|2.372604|3.844923|0.087728|2.686442|2.485130|2.982329|3.869223|3.961619|5.116795|7.927255|14.012321|36.858105| |1.789210|3.593606|2.065317|0.056696|1.837571|0.049339|1.933318|1.775273|1.837828|2.102245|2.377463|2.247488|2.411776|2.480245|2.616703|4.273142|0.101016|2.979308|2.826997|3.168870|4.057942|3.816450|4.524935|6.823838|7.892099|13.459561|36.858105| |2.040711|4.183207|2.404368|0.065463|2.099076|0.056255|2.208794|1.991988|2.049527|2.369500|2.758353|2.624281|2.884918|3.000519|3.211217|5.483243|0.136140|3.727644|3.474416|3.995360|5.341974|4.593206|5.151412|7.876189|6.858479|7.970149|14.087438|36.858105| |2.216833|4.552075|2.541470|0.068897|2.171995|0.058509|2.226602|1.976109|1.989768|2.260753|2.657384|2.626744|3.009439|3.178197|3.613991|6.535685|0.159576|4.270440|3.659862|5.219512|8.355675|6.967604|7.921577|13.572634|7.808409|6.825144|7.885491|13.478464|36.858105| |2.610342|5.520128|3.038573|0.081020|2.520837|0.068002|2.553696|2.210792|2.192230|2.491391|3.013090|3.064447|3.690219|4.004119|4.834146|9.876233|0.257878|5.814948|4.595452|7.992518|14.775906|7.985234|6.875820|7.884869|5.155495|4.595665|5.241706|7.972532|14.064387|53.358707| |2.150023|4.486772|2.647431|0.071576|2.320261|0.061829|2.504665|2.254575|2.355063|2.800436|3.323095|3.059857|3.301326|3.426123|3.503515|5.886262|0.153140|4.020174|3.995832|3.929746|4.784554|3.882979|4.012173|5.270973|4.643743|5.274855|8.190948|14.379053|8.129711|9.630675|97.533100| |5.865177|10.359735|7.567125|0.204533|13.185114|0.259643|7.727352|6.251112|4.349180|3.747135|3.997729|5.342804|5.087974|4.081638|3.393442|4.077965|0.076825|3.344730|3.909913|2.530380|2.184575|1.925067|1.733153|1.721903|1.547889|1.521054|1.646854|1.850369|1.910981|2.957832|4.533431|53.358707| |5.412389|8.637778|5.347173|0.141220|7.742670|0.212132|5.315062|4.808800|3.567340|3.073728|3.191848|3.998032|3.914516|3.437198|2.991115|3.565243|0.067164|2.828418|3.138839|2.285913|1.977840|1.771064|1.597884|1.575162|1.423551|1.394050|1.495041|1.664581|1.725467|2.649025|4.031041|19.116423|36.858105| |5.469714|8.659148|4.923803|0.122479|6.761173|0.224032|4.706875|4.224693|3.237949|2.844612|2.977205|3.695213|3.732156|3.495659|3.095402|3.582878|0.067149|2.749894|2.968707|2.321188|1.986332|1.781969|1.599581|1.567469|1.413008|1.378146|1.473236|1.641794|1.712031|2.638325|3.959705|11.494180|15.835723|73.516695| |4.175818|6.546973|3.984481|0.112369|5.068480|0.134208|4.070621|3.978402|3.126940|2.690025|2.716488|3.225261|3.113355|2.744797|2.453145|3.023754|0.057589|2.413057|2.647794|1.981013|1.750261|1.591234|1.451537|1.432118|1.307495|1.283420|1.368279|1.505866|1.552968|2.348008|3.621051|10.839193|12.927025|14.504020|36.858105| |3.489276|5.428203|3.169519|0.088535|3.818541|0.105702|3.206853|3.194064|2.627173|2.291290|2.295287|2.647630|2.582256|2.353438|2.152642|2.665828|0.050972|2.093498|2.246793|1.781147|1.585462|1.458613|1.336748|1.314273|1.206721|1.183082|1.252935|1.368560|1.412123|2.118076|3.265849|7.029323|7.448855|11.415830|14.191491|36.858105| |2.946497|4.665162|2.757095|0.079160|3.203189|0.086065|2.826431|2.875682|2.440940|2.139561|2.118424|2.386429|2.305458|2.082242|1.915111|2.422426|0.046678|1.918517|2.061817|1.628647|1.470801|1.362178|1.258734|1.241644|1.147893|1.128933|1.193009|1.294091|1.328418|1.973571|3.080321|5.710687|5.185645|7.851564|8.594726|13.285792|36.858105| |3.054152|4.911889|2.997983|0.088578|3.481989|0.089746|3.123949|3.199278|2.703175|2.354748|2.323156|2.618981|2.494257|2.191069|1.992268|2.546792|0.049191|2.052483|2.243705|1.695042|1.536354|1.415766|1.310222|1.298881|1.200514|1.184319|1.256817|1.365467|1.396210|2.074219|3.264902|6.424565|5.354209|7.527331|8.800593|8.607761|14.194333|36.858105| |3.711552|5.990838|3.780848|0.112588|4.597726|0.114279|3.972711|3.989287|3.208555|2.755921|2.748533|3.198401|3.022900|2.587749|2.307185|2.919274|0.056064|2.377325|2.648400|1.909137|1.711004|1.558131|1.431777|1.421115|1.303731|1.285465|1.372604|1.504796|1.541434|2.313514|3.624000|9.558050|7.813546|9.586716|14.071566|8.601470|8.615074|14.211184|73.516695| |17.641122|16.406127|6.807282|0.166570|6.535259|0.192797|4.313054|3.486262|2.825189|2.675781|2.997697|3.833948|4.529429|4.177532|4.032966|4.657840|0.082625|3.678427|3.702023|3.036191|2.478119|2.207715|1.925547|1.846658|1.630537|1.561958|1.658808|1.875883|2.013828|3.184269|4.463014|9.038919|6.896816|13.482719|4.957149|4.116876|3.306874|3.339921|7.293595|0.500000| |17.546838|16.409367|7.298619|0.222251|5.712376|0.143034|4.109835|3.303223|2.751921|2.672698|3.046938|3.862250|4.719020|3.952442|3.898798|4.930872|0.086609|4.282741|4.238160|3.216181|2.656749|2.370512|2.064534|1.975949|1.738370|1.659327|1.759081|1.993408|2.152062|3.403402|4.714719|8.141059|5.332980|8.783336|4.382533|3.604853|3.128005|3.330525|7.253146|0.298783|0.500000| |17.620692|16.861049|5.832217|0.150101|4.668588|0.131516|3.503187|2.854171|2.435740|2.403670|2.752987|3.411872|4.318862|4.112428|4.482833|5.403440|0.091815|4.291390|3.876942|3.698335|2.907345|2.607914|2.215103|2.072104|1.800850|1.694744|1.780563|2.027300|2.236937|3.592122|4.731402|6.008886|4.264942|7.942850|3.490877|3.062424|2.629693|2.678668|5.567013|0.300434|0.299903|0.500000| |3.256136|6.308256|4.495277|0.118081|6.622433|0.164745|8.890318|17.719127|8.896892|5.630836|4.923692|5.628750|4.199259|3.616269|2.855432|3.471262|0.069206|2.716658|3.308957|2.147587|1.930093|1.699359|1.568049|1.598809|1.462832|1.470083|1.616318|1.796419|1.791475|2.709253|4.508620|9.009850|5.457644|8.322419|4.622090|3.672145|3.276000|3.640205|8.153155|0.096668|0.089223|0.076843|0.500000| |2.450894|4.849432|3.344543|0.090121|4.029338|0.102882|5.666853|8.923101|17.726253|8.917271|5.637238|4.961964|3.563028|3.166017|2.528707|3.201003|0.066422|2.474413|3.051599|1.987559|1.851256|1.630265|1.534948|1.601015|1.486344|1.524429|1.701931|1.872311|1.809010|2.675608|4.797142|5.096330|3.220738|5.228460|2.932400|2.520164|2.380094|2.625939|5.397239|0.069635|0.067600|0.060296|0.214640|0.500000| |2.363393|4.864114|3.343985|0.090176|3.573020|0.090757|4.972362|5.639967|8.916961|17.724755|8.927584|5.662172|4.014191|3.585384|2.834726|3.731316|0.080775|2.871282|3.678251|2.265895|2.163650|1.869964|1.777644|1.902570|1.766200|1.845261|2.123065|2.361744|2.208863|3.246612|6.321703|4.225410|2.629772|4.370248|2.358484|2.049665|1.939028|2.123000|4.318094|0.064660|0.064956|0.059190|0.124013|0.215559|0.500000| |2.882018|6.347428|4.469832|0.117746|4.192395|0.104497|5.625550|4.923069|5.638510|8.937582|17.708739|8.844624|6.532800|5.540825|4.122866|5.643786|0.127439|4.408477|6.407659|3.162641|2.992294|2.459611|2.293951|2.480623|2.225519|2.306457|2.725805|3.214732|3.022735|4.648795|9.085539|4.573032|2.761458|4.643423|2.389140|2.053980|1.910743|2.081634|4.300285|0.075733|0.078256|0.072278|0.107018|0.124256|0.216227|0.500000| |3.611987|8.716648|5.466729|0.123590|4.774277|0.133455|5.265973|4.114986|3.941502|4.606647|6.404004|7.273106|8.866133|17.531469|8.916509|9.246108|0.203066|5.645513|6.773953|4.588834|3.856622|3.007490|2.648250|2.746418|2.353565|2.334646|2.679352|3.272899|3.361596|5.690882|8.738513|4.779411|2.997965|5.382435|2.463587|2.138456|1.917990|2.020486|4.185661|0.094261|0.090485|0.092627|0.095927|0.090899|0.110734|0.184191|0.500000| |4.651051|11.797585|6.948758|0.139736|6.463539|0.206750|6.075660|4.488696|3.886849|4.067084|5.121763|6.837061|8.727284|17.589916|8.993137|7.609183|0.143259|4.931593|5.521046|4.139491|3.299782|2.693270|2.341829|2.342751|2.027124|1.979645|2.196657|2.593179|2.728992|4.524252|6.553285|5.962862|3.792978|7.122153|2.943178|2.526036|2.192904|2.277831|4.800321|0.125931|0.109060|0.115940|0.108526|0.090106|0.095318|0.130239|0.304782|0.500000| |3.771061|8.778977|4.428436|0.102662|3.710705|0.109276|3.529878|2.891909|2.698573|2.933920|3.602293|4.110973|5.415030|8.837556|17.610199|12.426610|0.224588|5.621186|4.924825|7.132890|5.014901|3.829495|3.147135|3.065989|2.530680|2.395097|2.632137|3.215372|3.621193|6.492225|7.820812|4.010254|2.671645|4.990940|2.223746|1.984659|1.770437|1.824128|3.704584|0.096326|0.090516|0.105360|0.072357|0.065641|0.073783|0.103057|0.220930|0.212021|0.500000| |5.659079|14.751119|6.089128|0.135266|4.562181|0.133196|3.924224|3.080655|2.749214|2.897600|3.561080|4.396427|6.468895|8.782071|17.708073|12.416694|0.180819|6.955590|5.644965|7.060660|4.585569|3.642357|2.944383|2.789209|2.318407|2.175074|2.349159|2.814819|3.191424|5.618276|6.726683|4.880430|3.218364|6.017146|2.613163|2.295971|2.021271|2.087289|4.305992|0.134673|0.127100|0.161425|0.077940|0.066390|0.071308|0.097786|0.174033|0.216916|0.300142|0.500000| |3.696606|8.160717|4.565057|0.129163|3.374887|0.086301|3.305022|2.716379|2.596145|2.913436|3.673212|4.047895|5.459422|4.897097|5.618499|12.408598|0.226196|17.642231|8.810879|7.278167|6.724681|4.924648|4.079432|4.065178|3.229977|3.015156|3.333323|4.220181|4.971924|9.143418|9.898496|3.933985|2.483304|4.270993|2.175300|1.910220|1.776324|1.903499|3.860849|0.086582|0.101994|0.101054|0.067249|0.063129|0.074351|0.111169|0.126211|0.108174|0.127140|0.143653|0.500000| |5.564811|13.421492|6.524113|0.178534|4.275035|0.109250|3.817641|3.001990|2.727133|2.936318|3.679450|4.466380|6.770549|5.872630|7.082455|12.426178|0.182388|17.655654|8.774151|6.983172|5.123185|4.042631|3.279515|3.123425|2.569355|2.399317|2.593218|3.133514|3.595349|6.337741|7.400791|4.881589|3.055973|5.293179|2.592784|2.244085|2.042293|2.177675|4.502301|0.120157|0.148632|0.152261|0.075131|0.065725|0.072710|0.103797|0.133203|0.132133|0.144171|0.211383|0.299713|0.500000| |4.221931|9.661706|6.963202|0.225987|4.838025|0.111783|5.035852|3.892235|3.647055|4.144730|5.596602|6.668566|8.777020|5.512862|4.855600|7.614403|0.147385|8.950330|17.574731|4.146420|3.715847|3.024243|2.694393|2.770858|2.392853|2.355417|2.650722|3.165925|3.289343|5.345295|8.031304|5.480042|3.177997|5.190129|2.741296|2.308286|2.148561|2.378917|5.008394|0.100365|0.122301|0.103954|0.092292|0.084923|0.100126|0.158831|0.138977|0.123093|0.107834|0.125863|0.214349|0.210914|0.500000| |3.486385|8.103696|5.446172|0.147008|4.201913|0.103905|4.695270|3.734895|3.706454|4.558450|6.726072|6.938190|8.795463|6.798030|5.745831|9.554800|0.218018|8.938955|17.533882|4.707230|4.359937|3.343656|2.998507|3.207709|2.726701|2.730408|3.210885|4.042114|4.076198|6.874243|11.134434|4.575900|2.761919|4.676679|2.372500|2.041118|1.890544|2.051485|4.241177|0.086108|0.094947|0.088961|0.086878|0.086015|0.112768|0.228934|0.197389|0.138645|0.130630|0.131867|0.216104|0.173742|0.304497|0.500000| |3.330338|7.102643|3.469701|0.087366|2.845188|0.080512|2.679961|2.266222|2.144626|2.323816|2.774496|3.056455|3.913562|4.787300|7.606736|12.375552|0.209897|5.664779|4.180886|17.602212|8.898099|6.494034|4.582814|4.044346|3.123354|2.780570|2.927114|3.600124|4.553184|8.677316|7.983456|3.293919|2.225606|4.088691|1.923805|1.744739|1.586120|1.634536|3.258506|0.082250|0.083211|0.098956|0.057783|0.053293|0.059946|0.081176|0.123992|0.116039|0.232737|0.198828|0.144676|0.150088|0.097388|0.110903|0.500000| |3.844636|8.069570|3.827524|0.100490|2.977324|0.081551|2.740155|2.290913|2.143673|2.307400|2.766263|3.109774|4.105998|4.436733|6.439513|12.342816|0.185257|7.467814|4.725446|17.623998|8.776038|6.837453|4.650023|3.974858|3.073948|2.711238|2.819674|3.427744|4.354427|8.107957|7.520561|3.515875|2.347124|4.227936|2.043318|1.839725|1.682676|1.749790|3.499408|0.090263|0.098741|0.116872|0.058558|0.053128|0.059125|0.080244|0.109851|0.106000|0.158356|0.190236|0.199498|0.221839|0.114113|0.117785|0.302389|0.500000| |2.521448|4.937862|2.511853|0.067792|2.113653|0.058171|2.019579|1.770497|1.705585|1.839925|2.123420|2.253867|2.700681|2.890727|3.649136|6.213809|0.119885|4.010120|3.074143|6.912201|8.781898|17.731621|8.961271|5.613454|4.125784|3.291431|3.147984|3.648995|5.003471|7.762276|7.212796|2.588247|1.767563|3.179905|1.591398|1.466489|1.366960|1.413156|2.756095|0.062495|0.066975|0.075477|0.045798|0.043268|0.048601|0.062637|0.077420|0.072108|0.101528|0.100720|0.121963|0.109160|0.078362|0.083446|0.177392|0.198803|0.500000| |1.955563|3.794366|2.022082|0.055411|1.754428|0.047914|1.727337|1.552308|1.529847|1.665024|1.885933|1.929158|2.203734|2.308590|2.696929|4.457502|0.093252|3.025879|2.524205|4.090058|5.659296|8.998502|17.722484|8.816913|6.955938|4.660316|3.920280|4.166814|5.629841|6.742757|7.505440|2.175943|1.486499|2.648479|1.361147|1.261990|1.192812|1.237667|2.388187|0.049506|0.052974|0.056874|0.040180|0.039280|0.044918|0.056479|0.064218|0.058002|0.075751|0.072033|0.094618|0.079354|0.065949|0.071591|0.106581|0.109259|0.214699|0.500000| |1.664254|3.237633|1.785547|0.049244|1.582660|0.042955|1.600393|1.465112|1.475025|1.623904|1.813270|1.795469|1.977004|2.043316|2.263941|3.655855|0.079955|2.544086|2.264697|3.019178|3.966402|4.664125|6.959974|8.830162|17.729803|8.982605|5.613319|4.945427|5.589703|5.677915|8.279840|1.970468|1.341070|2.370641|1.238522|1.149270|1.095821|1.142540|2.194334|0.042710|0.045491|0.047306|0.037817|0.038200|0.044675|0.055122|0.058482|0.051467|0.063647|0.059153|0.079346|0.065111|0.059913|0.066551|0.078993|0.078512|0.110002|0.208469|0.500000| |1.541337|3.018767|1.710935|0.047283|1.541207|0.041607|1.597320|1.483800|1.524996|1.702719|1.879523|1.804491|1.926032|1.971321|2.095015|3.318676|0.074649|2.343243|2.199768|2.555639|3.185500|3.296320|4.134664|5.631422|9.006263|17.741314|8.861119|5.683306|4.929186|4.968650|9.587076|1.916942|1.297131|2.278286|1.202003|1.112913|1.066352|1.117477|2.144851|0.039926|0.042300|0.043028|0.038101|0.039734|0.047756|0.058048|0.057789|0.049669|0.058775|0.053827|0.072169|0.058928|0.058537|0.066654|0.066957|0.065524|0.078792|0.110252|0.215901|0.500000| |1.690588|3.384688|1.968856|0.054152|1.776273|0.047618|1.891624|1.758355|1.843205|2.119816|2.363601|2.193094|2.298716|2.346000|2.413026|3.837455|0.090221|2.710396|2.657600|2.773459|3.380802|3.157579|3.605804|4.928711|5.626683|8.767839|17.746622|9.068084|5.629046|5.775722|16.710103|2.174570|1.450365|2.533675|1.332828|1.221534|1.167079|1.231436|2.385546|0.043843|0.046295|0.046410|0.044453|0.047713|0.060329|0.075604|0.071010|0.058179|0.067348|0.060242|0.082783|0.065902|0.069853|0.084479|0.071879|0.069214|0.074537|0.089370|0.123570|0.212848|0.500000| |4.926149|8.717709|6.457055|0.198023|9.041908|0.181180|7.152939|6.297378|4.500113|3.840181|4.004626|5.136241|4.687160|3.654983|3.069193|3.825835|0.072970|3.207978|3.816428|2.386100|2.099353|1.858974|1.688689|1.687677|1.526539|1.507243|1.633603|1.825656|1.870673|2.866081|4.477587|26.027758|9.419093|10.862774|7.639325|4.969976|4.347711|5.282396|14.870426|0.145217|0.149163|0.107097|0.185643|0.108660|0.088773|0.093436|0.089829|0.104989|0.074365|0.088551|0.078600|0.094439|0.113815|0.092166|0.062747|0.067695|0.050796|0.043350|0.039668|0.038876|0.044210|0.500000| |3.381283|5.238224|2.972683|0.081153|3.543037|0.102121|2.966879|2.933577|2.439153|2.147619|2.160141|2.483370|2.451658|2.293446|2.120851|2.600963|0.049661|2.010069|2.128188|1.752369|1.554645|1.435078|1.313073|1.286129|1.180508|1.154580|1.219272|1.330847|1.377532|2.067102|3.165582|6.122074|6.488702|11.667382|8.856440|17.816079|8.437804|5.853994|10.441021|0.112944|0.094039|0.084243|0.092641|0.065090|0.053631|0.054061|0.057886|0.069162|0.054848|0.063196|0.050894|0.059895|0.059910|0.053903|0.048132|0.050251|0.040240|0.034503|0.031292|0.030182|0.032974|0.115530|0.500000| |2.574404|4.099470|2.392687|0.068452|2.720135|0.073874|2.444560|2.497702|2.170239|1.921939|1.897028|2.105785|2.042286|1.868800|1.736878|2.209316|0.042725|1.737713|1.849828|1.500200|1.363903|1.272115|1.180621|1.163605|1.080593|1.062882|1.118803|1.207177|1.238136|1.828574|2.860935|4.626562|4.064669|6.491017|5.852261|8.459694|17.810670|8.822879|10.445990|0.079295|0.075396|0.065187|0.078096|0.059366|0.048941|0.047992|0.048180|0.054511|0.044969|0.050808|0.045041|0.051211|0.053387|0.047494|0.040713|0.043046|0.035528|0.031210|0.028751|0.027979|0.030437|0.097161|0.192558|0.500000| 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