Version2.0 2020-01-24T06:57:47Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 14-Sep-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC(C)C[C@@H](C(=O)N1CCN(CC1)c2ccccc2F)NS(=O)(=O)c3ccc4c(c3)CCN4C(=O)C C09682227 RHF 6-31G(d) (6D,7F) CC(C)C[C@@H](C(=O)N1CCN(CC1)c2ccccc2F)NS(=O)(=O)c3ccc4c(c3)CCN4C(=O)C C01[X(C26H33F1N4O4S1)] 201 C1 610 CC(C[C@@H](C(=O)N1CCN(CC1)c1ccccc1F)NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)C)C CC(C[C@@H](C(=O)N1CCN(CC1)c1ccccc1F)NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)C)C CC(C)C[C@H](N[S](=O)(=O)c1ccc2N(CCc2c1)C(C)=O)C(=O)N3CCN(CC3)c4ccccc4F InChIKey=PRJSMAFCXIZKQZ-QHCPKHFHSA-N InChI=1S/C26H33FN4O4S/c1-18(2)16-23(26(33)30-14-12-29(13-15-30)25-7-5-4-6-22(25)27)28-36(34,35)21-8-9-24-20(17-21)10-11-31(24)19(3)32/h4-9,17-18,23,28H,10-16H2,1-3H3/t23-/m0/s1 InChI=1/C26H33FN4O4S/c1-18(2)16-23(26(33)30-14-12-29(13-15-30)25-7-5-4-6-22(25)27)28-36(34,35)21-8-9-24-20(17-21)10-11-31(24)19(3)32/h4-9,17-18,23,28H,10-16H2,1-3H3/t23-/m0/s1 CC(C)C[C@@H](C(=O)N1CCN(CC1)c2ccccc2F)NS(=O)(=O)c3ccc4c(c3)CCN4C(=O)C C01[X(C26H33F1N4O4S1)] 201 C01 610 CC(C[C@@H](C(=O)N1CCN(CC1)c1ccccc1F)NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)C)C CC(C[C@@H](C(=O)N1CCN(CC1)c1ccccc1F)N[S@](=O)(c1ccc2c(c1)CCN2C(=O)C)O)C CC(C)C[C@H](N[S](O)(=O)c1ccc2N(CCc2c1)C(C)=O)C(=O)N3CCN(CC3)c4ccccc4F InChIKey=YCMXVFKBMLDOIX-XYXXBXNNSA-N InChI=1S/C27H40N4O4S/c1-5-21-24(26(34)35-4)25(20-10-9-17(2)14-18(20)3)31-19(16-36-27(31)29-21)15-22(32)28-11-7-13-30-12-6-8-23(30)33/h9-10,14,16,21-22,24-25,27-29,32H,5-8,11-13,15H2,1-4H3/t21-,22+,24+,25+,27+/m1/s1 InChI=1/C27H40N4O4S/c1-5-21-24(26(34)35-4)25(20-10-9-17(2)14-18(20)3)31-19(16-36-27(31)29-21)15-22(32)28-11-7-13-30-12-6-8-23(30)33/h9-10,14,16,21-22,24-25,27-29,32H,5-8,11-13,15H2,1-4H3/t21-,22+,24+,25+,27+/m1/s1 4458.7699229561 -2017.9408925 1-A 18542.7792 137 473 610 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2054.21 2060.43 2066.66 2090.86 2099.73 2125.82 2134.03 2137.92 2154.13 2165.99 2166.80 2209.95 2211.83 2230.56 2236.98 2244.38 2255.05 2268.67 2272.21 2295.36 2309.22 2327.71 2333.87 2338.00 2346.52 2354.00 2354.62 2357.70 2366.30 2371.93 2373.81 2382.64 2385.29 2391.31 2394.86 2403.11 2407.41 2413.58 2560.17 2565.51 2590.64 2612.59 2721.52 2816.58 4583.02 4591.25 4592.38 4599.08 4616.29 4623.70 4633.06 4635.74 4639.36 4643.36 4650.12 4673.76 4686.86 4697.76 4698.92 4706.61 4706.74 4709.29 4726.03 4745.68 4756.61 4769.24 4806.33 4819.15 4842.70 4848.96 4868.29 4883.73 4892.11 4892.97 4900.17 4996.82 5466.35 0.615331 0.647632 0.648577 0.547464 -2017.325561 -2017.293260 -2017.292316 -2017.393429 3.391347D-04 MUNgauss RevisionA2.0 retrievium 24-Jan-2020 DUDE CC(C)C[C@@H](C(=O)N1CCN(CC1)c2ccccc2F)NS(=O)(=O)c3ccc4c(c3)CCN4C(=O)C C09682227 RHF 6-31G(d) (6D,10F) C1 516.220656 |X|Y|Z| 77.922687 104.985435 38.063119 67.779618 25 6 7 16 20 4 1 |36.858105| |12.421814|36.858105| |7.589304|12.425864|36.858105| |7.415410|12.361997|7.604354|36.858105| |5.609493|7.212124|4.886512|12.334166|36.858105| |4.425057|5.418826|4.157410|8.967745|17.648497|0.500000| |5.759178|5.872825|4.038682|7.352139|12.401607|0.245730|36.858105| |5.521222|5.362461|3.747656|5.674371|8.054973|0.168079|15.773520|73.516695| |4.961420|4.678118|3.501481|5.815663|7.645323|0.197544|14.106457|15.115056|53.358707| |4.234748|3.731427|2.928212|4.154023|4.958800|0.129012|7.846809|12.430527|17.775970|36.858105| |3.189538|2.949424|2.430322|3.332164|3.971214|0.111146|5.401647|8.714892|10.597097|12.515673|36.858105| |2.994500|2.821670|2.387622|3.284111|3.764771|0.110652|4.648281|7.066918|9.199890|7.827684|13.056594|53.358707| |3.200642|3.153581|2.655996|3.916644|4.591485|0.144885|5.311212|7.449423|10.606006|6.654015|7.878651|17.828468|36.858105| |4.262865|4.178573|3.355015|5.514746|6.381459|0.194152|7.581548|9.389521|17.829396|7.831702|6.649841|10.655022|12.497569|36.858105| |2.450599|2.335229|2.035569|2.663777|2.989697|0.088482|3.489937|5.545713|6.146831|5.104528|7.816405|18.230629|7.828743|5.104271|36.858105| |2.263604|2.128259|1.892436|2.374277|2.564061|0.074735|2.931388|4.738079|5.001844|4.168263|5.543246|10.688265|5.503793|4.148700|13.718912|36.858105| |1.943569|1.846197|1.667512|2.037566|2.186475|0.063779|2.440315|4.015920|3.980518|3.239116|4.111354|6.990533|4.093746|3.228867|7.868202|13.746337|36.858105| |1.805008|1.741199|1.574066|1.928583|2.099959|0.061770|2.319393|3.844099|3.699629|2.956420|3.783875|6.140394|3.783729|2.955112|6.801303|7.947192|13.760256|36.858105| |1.891460|1.845367|1.650411|2.070004|2.310559|0.068747|2.562300|4.230286|4.087121|3.231958|4.306989|6.922246|4.328043|3.239536|7.845106|6.890589|7.945626|13.752376|36.858105| |2.181941|2.125440|1.866600|2.423373|2.765480|0.082901|3.144387|5.092673|5.211104|4.151052|6.046931|10.460959|6.104982|4.167653|13.728958|8.052817|6.948573|8.007790|13.836319|36.858105| |2.239261|2.223524|1.932511|2.567278|3.039798|0.092524|3.445579|5.582784|5.553981|4.248678|6.063538|9.170212|6.179380|4.286494|8.111470|5.304143|4.670009|5.306211|8.183031|14.240081|97.533100| |4.698596|6.209246|4.508796|7.748581|13.085212|0.257448|7.853393|12.868661|7.091186|3.945141|3.313602|4.172699|3.552843|4.374068|2.548085|2.208526|1.929669|1.883552|2.077523|2.433198|6.100462|53.358707| |3.353309|4.128457|3.407664|5.014649|7.095456|0.200221|5.275651|8.849908|5.568563|3.280936|2.976464|3.815129|3.262136|3.680598|2.416252|2.082716|1.853751|1.848122|2.066467|2.392416|6.156004|15.837787|388.023441| |3.017955|3.637923|3.107899|3.989447|5.006765|0.132551|4.160613|7.600015|4.501288|2.812524|2.564048|3.242500|2.663884|2.947793|2.096401|1.837254|1.657237|1.657735|1.838297|2.088527|5.316334|10.632310|94.821551|73.516695| |3.104577|3.882212|3.394817|4.973277|6.262451|0.203464|4.440067|7.023171|5.059104|2.959186|2.742694|3.677283|3.242261|3.624960|2.359254|2.050086|1.834649|1.830300|2.037598|2.339509|5.960416|10.494751|94.582249|13.567528|73.516695| |2.957377|3.349215|2.768755|4.032563|5.832515|0.177561|5.326518|8.978880|6.027280|3.659085|3.513659|4.408436|3.748731|3.929946|2.808566|2.343798|2.083514|2.114317|2.433885|2.869310|7.774748|9.449483|76.515908|12.996379|13.150748|36.858105| |2.856349|3.096017|2.544673|3.511183|4.868435|0.135713|5.113233|9.610933|5.825442|3.805031|3.678813|4.361567|3.486154|3.592777|2.798086|2.335134|2.082172|2.119943|2.445629|2.875969|7.822142|7.775074|49.472174|10.988385|8.783939|13.725385|36.858105| |2.508507|2.626631|2.203634|2.946849|3.870084|0.110403|4.280190|7.948626|5.355579|3.741672|3.901815|4.554932|3.501003|3.382561|3.016684|2.482246|2.235349|2.321309|2.738901|3.220408|9.105249|5.638236|33.556601|7.659195|6.789243|7.893408|13.757500|36.858105| |2.314301|2.426985|2.073460|2.786609|3.583237|0.107751|3.846465|6.685080|5.119518|3.548618|3.934378|4.845892|3.801294|3.449673|3.317388|2.675636|2.431371|2.584945|3.149791|3.720496|11.238859|4.957888|29.964152|6.562095|6.609571|6.925564|8.016182|13.717164|36.858105| |2.363292|2.539637|2.186928|3.021340|3.910457|0.125103|3.923397|6.445333|5.237621|3.419034|3.721819|4.894589|4.134307|3.732867|3.325696|2.682819|2.429116|2.570453|3.118778|3.696099|11.060861|5.311023|33.762077|6.923661|7.974517|8.007965|6.910681|7.870600|13.703854|36.858105| |2.644299|2.950676|2.515047|3.628388|4.923855|0.164989|4.520375|7.224558|5.662434|3.464352|3.524630|4.653581|4.101769|4.012539|3.038295|2.499772|2.236346|2.304796|2.704262|3.198070|8.948444|6.933825|49.456293|9.022371|11.793754|13.699408|7.891697|6.778921|7.926082|13.844409|36.858105| |2.079333|2.205456|1.946584|2.600415|3.174729|0.101570|3.184876|5.198002|4.464348|3.002748|3.401538|4.735349|3.961759|3.369752|3.426908|2.780742|2.585189|2.824063|3.514186|4.030230|12.273887|4.179091|25.348029|5.386004|6.385144|4.972278|4.482822|5.147355|8.009277|12.627480|7.311583|36.858105| |1.897033|1.970548|1.744057|2.252552|2.702871|0.082841|2.818742|4.766229|3.976323|2.823057|3.288291|4.430539|3.433695|2.913812|3.340079|2.738847|2.611313|2.939188|3.735431|4.108404|12.682617|3.601950|21.209623|4.727660|5.143951|4.053598|4.067696|5.134481|8.085992|7.981719|5.093863|12.369253|36.858105| |2.035532|2.096715|1.824483|2.369507|2.909110|0.086918|3.146585|5.477448|4.370494|3.172106|3.697477|4.654678|3.493981|3.039944|3.392081|2.751060|2.570260|2.828505|3.546684|4.043775|12.558443|3.935771|22.930538|5.174346|5.277058|4.602508|5.111662|7.555873|13.572278|8.336334|5.312348|7.977234|12.955006|53.358707| |1.911111|1.933079|1.688782|2.131953|2.561400|0.074441|2.834085|5.076919|3.957053|3.007051|3.534827|4.319837|3.076766|2.708021|3.216857|2.670744|2.535942|2.808759|3.474454|3.823531|11.138275|3.474572|19.592763|4.562643|4.465590|3.693099|4.288755|6.196820|7.737112|5.292236|3.945663|5.138232|7.582523|18.960967|36.858105| |1.974165|1.978663|1.716137|2.146816|2.583753|0.073323|2.921169|5.408206|4.012661|3.118691|3.579794|4.184384|2.926829|2.656016|3.036549|2.552636|2.398308|2.591697|3.106519|3.448492|9.570923|3.549969|19.654456|4.668153|4.364525|3.651836|4.504656|6.639822|6.733786|4.571953|3.661135|4.126197|5.275989|11.512380|15.894858|73.516695| |1.689214|1.699382|1.509039|1.862136|2.173307|0.063314|2.370647|4.204048|3.363351|2.576140|3.049922|3.881194|2.727102|2.371322|3.033520|2.596801|2.562425|2.936946|3.634650|3.713090|10.234004|2.918206|16.301249|3.820985|3.820010|2.912245|3.214672|4.166728|5.022202|4.054985|3.160075|4.376418|6.622157|10.586375|12.584664|14.312710|36.858105| |17.546208|8.802395|7.030391|5.438432|4.381322|0.099714|4.492543|8.141532|5.371036|3.572868|2.784870|3.543694|2.723543|3.446524|2.184428|2.045206|1.780683|1.658283|1.726328|1.963790|4.516954|5.416978|21.114582|4.932433|4.879454|2.621047|2.572086|2.278665|2.093256|2.116478|2.343320|1.876003|1.732326|2.531240|1.765301|3.259754|1.571064|0.500000| |17.606694|8.701886|5.489478|6.629030|5.964239|0.127832|7.187467|13.067363|8.173606|5.251273|3.709267|4.541650|3.485796|4.667711|2.676184|2.439211|2.073104|1.924536|2.030078|2.369183|5.497228|6.733280|24.821317|5.565411|5.552452|3.193022|3.168715|2.789222|2.533257|2.541050|2.815038|2.209047|2.031395|3.015403|2.090771|3.878648|1.828654|0.303304|0.500000| |17.510909|8.767602|6.831092|6.759297|4.997626|0.116495|5.140409|8.279029|6.674841|4.224117|3.219226|4.252758|3.344648|4.523820|2.550570|2.390400|2.038197|1.868534|1.937690|2.232944|5.068920|5.466785|21.443660|4.766716|5.129337|2.726441|2.609215|2.340412|2.206065|2.271833|2.512857|2.036707|1.855332|2.677063|1.846328|3.360283|1.649427|0.301961|0.300637|0.500000| |8.897229|17.546892|8.952193|8.874517|6.956407|0.142366|5.717652|10.162088|5.865228|3.529572|2.824430|3.593914|2.912199|3.708491|2.209930|2.002699|1.752416|1.669893|1.780965|2.043581|4.870109|9.857833|32.578699|7.490755|7.240968|3.565451|3.344379|2.768756|2.498299|2.583170|3.025110|2.206822|1.983768|2.906381|1.973595|3.624120|1.720905|0.212623|0.212481|0.173397|0.500000| |6.808476|8.757056|17.513691|6.913383|4.446805|0.109914|3.765892|6.048166|4.682013|2.887749|2.418475|3.306840|2.715545|3.444504|2.075514|1.949377|1.714446|1.606007|1.671098|1.885880|4.341716|5.298245|21.753084|4.886221|5.563360|2.571282|2.355904|2.077350|1.986468|2.108032|2.397581|1.906901|1.705970|2.405216|1.635716|2.935474|1.473837|0.170892|0.138782|0.200659|0.173842|0.500000| |5.498178|8.752864|17.554356|6.918030|4.712509|0.115027|3.712238|6.125715|4.353443|2.666690|2.268339|3.049724|2.518831|3.107026|1.932773|1.789987|1.590572|1.515417|1.596281|1.796808|4.220616|6.273817|25.703680|5.906971|6.601412|2.828553|2.551159|2.189628|2.068120|2.205759|2.571802|1.961619|1.744340|2.467480|1.666917|2.997050|1.490006|0.143030|0.122424|0.139237|0.215213|0.301217|0.500000| |7.001934|8.770616|17.549748|5.502252|4.011388|0.095617|3.528962|6.077585|4.209236|2.689343|2.242567|2.967261|2.368351|2.917317|1.879147|1.762961|1.564211|1.476451|1.539818|1.727600|4.006235|5.253814|21.359481|5.049374|5.214902|2.487706|2.339657|2.045443|1.912041|1.988286|2.252407|1.777852|1.614929|2.309258|1.587831|2.886988|1.424893|0.214455|0.142626|0.171026|0.212808|0.301699|0.301588|0.500000| |5.503255|8.859951|7.473730|17.574572|9.088044|0.227253|5.500936|8.013155|6.229428|3.435565|2.903013|3.967079|3.501158|4.594782|2.435037|2.183707|1.903516|1.819093|1.953120|2.256721|5.403217|9.819886|37.091933|7.342659|10.124721|3.947938|3.324352|2.782388|2.667944|2.955453|3.619361|2.566889|2.196786|3.095056|2.030867|3.603279|1.785819|0.123822|0.135830|0.143684|0.204101|0.189657|0.223666|0.147286|0.500000| |7.089192|8.829303|6.591292|17.518475|8.796894|0.216526|6.681728|8.908813|8.447428|4.389573|3.519845|4.909331|4.387934|6.605785|2.884194|2.592486|2.196449|2.049158|2.179526|2.563071|5.987169|7.643647|29.210061|5.902892|7.472037|3.577873|3.157308|2.751602|2.664893|2.898015|3.376378|2.564205|2.223961|3.146758|2.086726|3.707655|1.843464|0.143040|0.175134|0.211567|0.174761|0.194049|0.159799|0.137431|0.303762|0.500000| |4.413544|3.677601|2.945640|3.952018|4.325676|0.112015|6.167527|9.946370|12.457345|17.532911|8.887047|9.576571|5.816100|7.024588|4.822385|4.251995|3.270889|2.887353|3.039713|3.781363|8.266795|4.709834|20.411720|4.448982|4.707901|3.075382|3.148322|3.084605|2.959090|2.890874|2.941947|2.613492|2.469223|3.688779|2.601526|4.775606|2.293651|0.104138|0.150324|0.128236|0.094181|0.082258|0.073235|0.075868|0.090773|0.120255|0.500000| |4.240512|3.703652|2.877879|3.927671|4.753283|0.118783|7.700209|15.010091|12.523995|17.702264|8.848175|7.688834|4.983908|5.694636|4.176452|3.511289|2.853595|2.660328|2.910212|3.615141|8.534236|5.494655|23.677049|5.214149|5.157271|3.714701|4.068438|3.983115|3.583232|3.325334|3.372139|2.857380|2.740152|4.313413|3.069773|5.854755|2.588468|0.101924|0.151870|0.112015|0.100990|0.077082|0.072899|0.074663|0.090699|0.109907|0.300716|0.500000| |2.894853|2.630893|2.208991|2.871038|3.300089|0.091047|4.319805|7.382998|7.684235|8.909298|17.586529|12.493510|5.700565|4.979136|7.339076|5.798364|4.364246|3.943677|4.330808|5.726392|12.009552|3.879701|18.372616|4.067158|4.239068|2.998457|3.198904|3.448476|3.446264|3.190460|2.989549|2.984389|2.992049|4.582675|3.371960|6.178496|2.993828|0.071923|0.093010|0.081409|0.070399|0.061165|0.057177|0.057496|0.070257|0.083904|0.218195|0.210554|0.500000| |2.970507|2.837386|2.338817|3.228831|4.014485|0.114101|5.370612|8.912797|9.412246|8.872567|17.493748|12.214013|6.988542|5.770479|6.719325|4.706210|3.744172|3.660151|4.393833|6.218817|16.336771|4.724204|22.952819|4.930253|5.193516|4.048869|4.381339|4.903401|5.000417|4.504397|4.085113|3.996440|3.929345|6.325695|4.392025|7.908877|3.604511|0.072602|0.095381|0.081359|0.077152|0.063826|0.061538|0.059933|0.079411|0.091884|0.174119|0.217011|0.300891|0.500000| |2.909797|2.889705|2.518113|3.564765|3.939699|0.125423|4.242466|6.127673|7.691512|4.979765|5.695644|12.502803|17.578256|8.907307|7.342198|5.712389|4.323286|3.939574|4.363607|5.804422|12.308466|4.247059|20.757613|4.289252|5.333887|3.256248|2.987999|2.998276|3.296275|3.656754|3.632175|3.691158|3.184975|4.236904|2.755022|4.605689|2.518083|0.069632|0.085480|0.086037|0.073493|0.072780|0.066771|0.062406|0.091185|0.113096|0.130738|0.109439|0.127908|0.142534|0.500000| |2.982965|3.034495|2.555477|3.802218|4.722973|0.156044|5.285861|7.512115|9.439113|5.779528|6.991304|12.224057|17.489508|8.886678|6.716427|4.674908|3.725814|3.655555|4.411243|6.274270|16.790247|5.138870|25.860992|5.178715|6.422372|4.456013|4.051375|4.135029|4.721035|5.373713|5.174322|5.105206|4.202477|5.768757|3.553250|5.865971|3.073906|0.071154|0.090176|0.084217|0.079715|0.071388|0.068540|0.063302|0.096674|0.112926|0.133285|0.130019|0.142616|0.204998|0.300580|0.500000| |4.254707|4.511928|3.664208|6.607887|7.536992|0.262204|7.156911|8.765526|12.354122|5.656500|4.970364|7.713548|8.911169|17.685889|4.193152|3.506961|2.853113|2.668102|2.928836|3.645313|8.652302|6.638046|29.314161|5.667335|7.584441|4.208415|3.633647|3.313524|3.403186|3.849947|4.365128|3.454678|2.883720|4.013758|2.578578|4.457183|2.260843|0.095124|0.123349|0.124319|0.109804|0.104970|0.096254|0.086025|0.157757|0.226358|0.143065|0.127344|0.109268|0.129412|0.213639|0.218100|0.500000| |4.444790|4.123808|3.403807|5.136794|5.223270|0.149567|6.028693|8.111416|12.472750|7.023947|5.813868|9.582080|8.888397|17.538321|4.824177|4.231919|3.260853|2.886866|3.047135|3.795687|8.326342|5.106610|22.322220|4.623026|5.543140|3.238217|3.019729|2.865794|2.898746|3.082242|3.272114|2.856732|2.532318|3.570351|2.393095|4.199743|2.139955|0.099903|0.132067|0.139817|0.098732|0.100166|0.085611|0.082835|0.118773|0.182608|0.208449|0.143654|0.130749|0.133156|0.218299|0.174335|0.302672|0.500000| |2.403630|2.219087|1.977857|2.452047|2.589583|0.074472|2.972361|4.792677|5.121481|4.315281|5.321150|9.969961|5.258800|4.278865|9.010773|17.733761|8.885395|5.643108|4.962526|5.713123|9.620144|3.004470|14.525729|3.209547|3.574567|2.248320|2.234159|2.329320|2.457235|2.470915|2.358296|2.507685|2.438110|3.366189|2.401172|4.147218|2.309012|0.060296|0.071762|0.071651|0.057394|0.057072|0.051460|0.051283|0.062120|0.075442|0.129831|0.099672|0.155963|0.119986|0.152302|0.118894|0.099135|0.128541|0.500000| |1.834703|1.734089|1.583153|1.891417|1.996167|0.057780|2.207786|3.659061|3.548813|2.874551|3.475365|5.685073|3.456081|2.862300|5.621182|8.920318|17.728441|8.911191|5.647445|4.992018|8.316739|2.411210|12.060109|2.717304|2.992055|1.875803|1.873708|1.992092|2.139760|2.139461|1.995186|2.261855|2.280575|3.058462|2.230674|3.787311|2.264766|0.047073|0.053961|0.053720|0.045646|0.045407|0.041892|0.041482|0.049244|0.056717|0.082356|0.071241|0.103308|0.087689|0.102091|0.087180|0.071107|0.081988|0.214152|0.500000| |1.638884|1.586078|1.447377|1.742348|1.882158|0.055178|2.053438|3.434375|3.208703|2.539504|3.133747|4.894715|3.133360|2.538386|4.915356|5.645663|8.903531|17.726183|8.933061|5.680322|9.617199|2.326318|12.006753|2.718798|2.981715|1.916519|1.923629|2.103585|2.333980|2.318133|2.083869|2.563418|2.700490|3.503216|2.584882|4.240696|2.772816|0.042151|0.048245|0.047030|0.042405|0.041005|0.038848|0.037885|0.045985|0.051153|0.069233|0.064585|0.090929|0.085226|0.090838|0.085126|0.064755|0.069219|0.123915|0.214260|0.500000| |1.761708|1.736274|1.560022|1.942491|2.177388|0.064926|2.381093|3.970044|3.696452|2.873734|3.702755|5.638833|3.726227|2.883763|5.624114|4.963066|5.631974|8.844529|17.735273|8.983009|16.847625|2.712817|14.360742|3.218257|3.543956|2.400643|2.419981|2.751547|3.229144|3.178565|2.694683|3.711114|4.143520|5.164176|3.751535|5.778236|4.144627|0.044894|0.052345|0.049738|0.046920|0.043662|0.042206|0.040512|0.051378|0.056168|0.074399|0.073500|0.102576|0.108938|0.103622|0.109625|0.074062|0.074652|0.107722|0.123706|0.213134|0.500000| |4.844039|5.988724|4.279777|6.357246|9.212742|0.184624|7.741086|15.511145|6.821668|4.015301|3.308271|4.027628|3.293512|3.990873|2.467242|2.149546|1.881983|1.835128|2.017559|2.353715|5.876542|25.891228|61.209703|13.355321|10.150228|6.201097|5.877238|4.235735|3.554297|3.616888|4.467722|2.854861|2.539820|3.864693|2.563665|4.761363|2.140587|0.116981|0.148015|0.110865|0.210773|0.101228|0.118013|0.106270|0.156675|0.134699|0.097593|0.119791|0.080260|0.096487|0.079826|0.096104|0.117085|0.097096|0.059821|0.048117|0.046344|0.053792|0.500000| |2.986524|3.227499|2.630418|3.504060|4.737747|0.123753|5.041563|10.364745|5.505067|3.667873|3.404895|3.980845|3.113629|3.310020|2.548133|2.169026|1.937508|1.953361|2.213888|2.571802|6.769659|8.088816|47.250953|12.027057|8.053315|8.914439|17.743315|8.966997|5.685983|4.973661|5.629105|3.579587|3.347240|5.603660|3.697971|7.177024|2.859502|0.075703|0.092777|0.074180|0.099946|0.066569|0.073014|0.068032|0.091349|0.085940|0.085594|0.113031|0.084019|0.109092|0.074744|0.096588|0.092356|0.079198|0.058371|0.048902|0.049500|0.060554|0.188160|0.500000| |2.381277|2.441340|2.060581|2.658877|3.373557|0.093645|3.831317|7.418932|4.856161|3.574150|3.741819|4.260236|3.140859|3.037533|2.865040|2.393929|2.174320|2.259368|2.641269|3.053366|8.408121|4.898840|27.776504|6.670317|5.696023|5.630631|8.906045|17.839444|8.876979|5.616598|4.912277|4.211754|4.513141|9.154909|6.604880|14.840924|4.351140|0.060911|0.074023|0.061631|0.071745|0.053952|0.056490|0.053824|0.069303|0.069375|0.082819|0.109000|0.095342|0.129516|0.075305|0.099531|0.081165|0.073225|0.062529|0.054104|0.057219|0.073900|0.105520|0.215640|0.500000| |2.597215|2.954052|2.573667|3.718479|4.829503|0.170850|4.143694|6.450153|5.266946|3.169450|3.194869|4.392326|3.990171|3.948290|2.889311|2.415864|2.170834|2.227110|2.579588|3.009999|8.160667|6.623144|47.254671|8.459210|13.853201|8.906740|5.630531|4.905429|5.628438|8.893425|17.747249|6.569475|4.446657|5.857142|3.322520|5.456935|2.791879|0.063838|0.075144|0.069332|0.082879|0.068775|0.074143|0.063364|0.106962|0.096878|0.076675|0.084112|0.075773|0.099014|0.101998|0.137064|0.125009|0.090457|0.063686|0.054132|0.056191|0.071223|0.114216|0.124048|0.106874|0.500000| |1.941971|2.082232|1.868325|2.444881|2.915813|0.093283|2.832467|4.641483|3.905665|2.610027|2.877139|4.043523|3.392339|2.978933|2.938808|2.464249|2.324022|2.529552|3.055598|3.377421|9.587779|3.904658|24.235303|5.228415|6.336933|4.485144|3.932674|4.289905|5.973140|8.771584|6.481095|17.586208|8.723713|8.035822|4.211826|6.197387|3.774789|0.048976|0.056587|0.052882|0.057963|0.050890|0.052839|0.047442|0.068341|0.066726|0.064302|0.069301|0.071179|0.090946|0.090477|0.116253|0.086633|0.071487|0.062439|0.057338|0.064905|0.090083|0.073600|0.089631|0.099882|0.179840|0.500000| |2.146866|2.261074|1.996763|2.701633|3.262222|0.106211|3.292217|5.233855|4.799333|3.207740|3.721873|5.461640|4.733852|3.793947|4.009719|3.181554|2.930547|3.208320|4.071331|4.800275|14.904586|4.120356|23.995009|5.013643|6.171201|4.475447|3.992652|4.430806|6.265826|8.859049|6.334656|17.565249|8.756177|8.585047|4.499744|6.594037|3.993232|0.053418|0.063232|0.059169|0.061857|0.054940|0.055545|0.050394|0.073678|0.075591|0.077899|0.082397|0.089411|0.119349|0.125032|0.176515|0.107741|0.088643|0.078656|0.070243|0.079547|0.117432|0.077541|0.090797|0.103371|0.169697|0.302250|0.500000| |1.740732|1.815990|1.625683|2.052097|2.423482|0.073580|2.486204|4.255077|3.447826|2.448501|2.778902|3.738129|2.885719|2.520957|2.819627|2.387301|2.311797|2.596041|3.191586|3.378359|9.695110|3.293453|19.658035|4.495784|4.799970|3.636629|3.653626|4.485814|6.380294|6.305358|4.439105|8.740933|17.567008|12.329316|6.549586|8.449896|6.298970|0.044532|0.051408|0.047188|0.051055|0.044090|0.045433|0.042027|0.056145|0.055970|0.060367|0.066719|0.071434|0.089898|0.075574|0.095012|0.069998|0.061831|0.059709|0.056998|0.067696|0.099074|0.064756|0.085470|0.112749|0.110727|0.225740|0.177533|0.500000| |1.830622|1.878025|1.670183|2.137776|2.519900|0.076907|2.661551|4.478513|3.857522|2.797850|3.360193|4.642278|3.503084|2.878828|3.673807|3.008428|2.927123|3.412333|4.519377|4.794045|14.965478|3.290679|18.789395|4.193983|4.598655|3.439823|3.457893|4.245404|6.007932|5.911154|4.186756|8.724913|17.654568|12.294749|6.891913|8.642370|7.112771|0.046491|0.054422|0.050210|0.052040|0.045740|0.046126|0.043056|0.057622|0.059468|0.068739|0.074466|0.086256|0.109987|0.091771|0.117064|0.077939|0.070362|0.072833|0.070152|0.087077|0.146825|0.064628|0.081377|0.107903|0.105317|0.186887|0.226276|0.301430|0.500000| |1.702594|1.702788|1.513815|1.876006|2.175790|0.063783|2.385338|4.169549|3.464023|2.676892|3.267899|4.255266|2.939845|2.486077|3.457608|2.941752|2.947810|3.493598|4.500206|4.448867|12.248990|2.865062|15.784875|3.648180|3.744655|2.788869|3.006454|3.782697|4.607649|3.918274|3.071433|4.409481|6.488293|9.266427|8.864922|11.181106|17.556868|0.043828|0.051158|0.046580|0.047452|0.041350|0.041367|0.039613|0.049833|0.052167|0.066546|0.073348|0.089729|0.106462|0.075989|0.091708|0.065251|0.062521|0.071152|0.071298|0.091265|0.149403|0.057997|0.074255|0.106885|0.076514|0.104313|0.117754|0.160322|0.224622|0.500000| 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