Version2.1 2020-12-14T19:41:30Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 23-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCCN1C(=O)[C@H]2[C@@H]([NH2+][C@@]([C@@H]2C1=O)(CCCNC(=O)N)C(=O)[O-])c3cc(cc(c3Cl)Cl)Cl C33874513 RHF 6-31G(d) (6D,7F) CCCCN1C(=O)[C@H]2[C@@H]([NH2+][C@@]([C@@H]2C1=O)(CCCNC(=O)N)C(=O)[O-])c3cc(cc(c3Cl)Cl)Cl C01[X(C21H25Cl3N4O5)] 168 C1 557 CCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@]([NH2+][C@H]2c1cc(Cl)cc(c1Cl)Cl)(CCCNC(=O)N)C(=O)[O-] CCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@]([NH2+][C@H]2c1cc(Cl)cc(c1Cl)Cl)(CCCNC(=O)N)C(=O)[O-] CCCCN1C(=O)[C@H]2[C@@H]([NH2+][C@](CCCNC(N)=O)([C@@H]2C1=O)C([O-])=O)c3cc(Cl)cc(Cl)c3Cl InChIKey=NSCNNXWKHPGVMM-OAJLEGQYSA-N InChI=1S/C21H25Cl3N4O5/c1-2-3-7-28-17(29)13-14(18(28)30)21(19(31)32,5-4-6-26-20(25)33)27-16(13)11-8-10(22)9-12(23)15(11)24/h8-9,13-14,16,27H,2-7H2,1H3,(H,31,32)(H3,25,26,33)/t13-,14+,16+,21-/m1/s1 InChI=1/C21H25Cl3N4O5/c1-2-3-7-28-17(29)13-14(18(28)30)21(19(31)32,5-4-6-26-20(25)33)27-16(13)11-8-10(22)9-12(23)15(11)24/h8-9,13-14,16,27H,2-7H2,1H3,(H,31,32)(H3,25,26,33)/t13-,14+,16+,21-/m1/s1/f/h26-27H,25H2 CCCCN1C(=O)[C@H]2[C@@H]([NH2+][C@@]([C@@H]2C1=O)(CCCNC(=O)N)C(=O)[O-])c3cc(cc(c3Cl)Cl)Cl C01[X(C21H25Cl3N4O5)] 168 C01 557 CCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@]([NH2+][C@H]2c1cc(Cl)cc(c1Cl)Cl)(CCCNC(=O)N)C(=O)[O-] CCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@]([NH2][C@H]2[C]1[CH][C]([CH][C]([C]1[Cl])Cl)Cl)(CCCNC(=O)N)[C]([O])=O CCCCN1C(=O)[C@H]2[C@@H]([NH2][C@](CCCNC(N)=O)([C@@H]2C1=O)C([O])=O)[C]3[CH][C](Cl)[CH][C](Cl)[C]3Cl InChIKey=IDFABALJDGMALN-OAJLEGQYSA-N InChI=1S/C21H25Cl3N4O5/c1-2-3-7-28-17(29)13-14(18(28)30)21(19(31)32,5-4-6-26-20(25)33)27-16(13)11-8-10(22)9-12(23)15(11)24/h8-9,13-14,16H,2-7,27H2,1H3,(H3,25,26,33)/t13-,14+,16+,21-/m1/s1 InChI=1/C21H25Cl3N4O5/c1-2-3-7-28-17(29)13-14(18(28)30)21(19(31)32,5-4-6-26-20(25)33)27-16(13)11-8-10(22)9-12(23)15(11)24/h8-9,13-14,16H,2-7,27H2,1H3,(H3,25,26,33)/t13-,14+,16+,21-/m1/s1/f/h26H,25H2 4080.4291778229 -2780.3743289 1-A 20456.7170 135 422 557 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -104.86936 -104.86206 -104.86030 -20.58579 -20.57986 -20.52311 -20.48802 -20.47504 -15.69479 -15.63692 -15.58888 -15.58538 -11.40293 -11.39563 -11.38061 -11.35868 -11.35731 -11.35556 -11.34808 -11.32157 -11.31944 -11.31343 -11.30336 -11.29945 -11.29921 -11.29022 -11.28267 -11.27117 -11.25215 -11.23649 -11.23535 -11.23164 -11.22016 -10.60267 -10.59535 -10.59363 -8.07199 -8.06854 -8.06849 -8.06479 -8.06306 -8.06120 -8.06119 -8.05956 -8.05953 -1.45855 -1.43822 -1.40810 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17 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 12.00000 1.00783 12.00000 1.00783 14.00307 1.00783 1.00783 12.00000 12.00000 1.00783 12.00000 15.99491 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 14.00307 12.00000 15.99491 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 34.96885 34.96885 34.96885 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 19815.6028 23199.7171 32180.5359 0.99362 0.11258 0.00704 -0.11246 0.99353 -0.01614 -0.00882 0.01524 0.99985 1 0.00437 0.00373 0.00269 0.09108 0.07779 0.05608 20.96 24.18 27.62 32.29 43.51 52.37 70.90 80.49 93.21 103.81 112.80 118.67 132.05 148.89 160.15 180.09 188.99 200.86 206.29 235.48 255.70 285.12 305.79 330.55 344.34 367.65 374.79 376.87 403.16 435.81 454.31 460.42 481.82 491.93 519.42 526.58 550.19 577.90 604.61 646.90 658.44 673.75 722.13 752.55 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0.525059 0.424100 -2779.881617 -2779.850214 -2779.849270 -2779.950229 3.386181D-04 MUNgauss RevisionA2.0 retrievium 14-Dec-2020 DUDE CCCCN1C(=O)[C@H]2[C@@H]([NH2+][C@@]([C@@H]2C1=O)(CCCNC(=O)N)C(=O)[O-])c3cc(cc(c3Cl)Cl)Cl C33874513 RHF 6-31G(d) (6D,10F) C1 518.089053 |X|Y|Z| 98.901492 87.614820 54.761548 77.998343 14 6 7 12 2 |36.858105| |12.467552|36.858105| |7.486519|12.454446|36.858105| |4.883166|7.518674|12.480620|36.858105| |3.786484|4.961294|7.660073|13.039520|53.358707| |3.305337|4.070342|5.738148|7.619928|18.765002|36.858105| |3.287088|4.011080|5.300476|6.568361|11.298635|16.031289|73.516695| |2.789934|3.246861|4.341722|5.157440|11.359766|12.597701|13.845196|36.858105| |2.919860|3.297828|4.477435|4.837579|9.786077|9.190473|11.605216|17.498988|0.500000| |2.297383|2.597899|3.243520|3.726174|6.985958|6.929872|10.200093|12.554577|0.249291|36.858105| |2.172252|2.482573|3.029282|3.591089|6.546759|6.283658|9.704889|8.866763|0.174752|17.630398|0.500000| |2.136857|2.377204|2.927032|3.278553|5.959710|5.046315|7.355895|8.306649|0.207999|12.536577|0.252915|53.358707| |2.083767|2.272271|2.778526|2.997064|5.265983|4.413891|6.649614|6.772574|0.197260|9.068743|0.183136|25.763682|0.500000| |1.938949|2.152260|2.584501|2.911125|5.094414|4.195854|6.355846|6.057904|0.149014|8.885346|0.234379|24.997081|0.317272|0.500000| |2.302149|2.596980|3.243147|3.702423|6.914258|5.154453|7.092874|7.912726|0.200692|7.510484|0.179979|16.743102|0.247006|0.263902|36.858105| |2.682220|3.158904|4.136309|5.142575|11.297272|8.075871|9.695996|12.558768|0.249496|8.060958|0.201500|11.032296|0.171358|0.179175|12.468110|36.858105| |2.502676|2.980285|3.751639|4.874096|9.896701|7.215209|9.356680|8.963989|0.175576|7.316461|0.220846|9.351956|0.143348|0.172883|8.937095|17.503156|0.500000| |3.283975|4.047701|5.672774|7.576989|18.498548|8.162136|9.757231|8.150911|0.201599|5.219559|0.134246|6.860538|0.121182|0.118957|6.902356|12.578553|0.256610|36.858105| |3.350536|4.078712|5.433127|6.606325|11.321260|5.526726|7.468931|5.506263|0.148323|4.026751|0.105187|5.614751|0.103074|0.101193|5.703518|7.735003|0.179585|16.116185|73.516695| |2.342194|2.567499|3.189400|3.409085|5.982620|4.244505|6.048862|5.825640|0.177947|5.221795|0.123018|10.163879|0.207387|0.169733|12.493359|7.388630|0.153697|5.917722|9.908484|36.858105| |1.999877|2.141287|2.556901|2.677479|4.439118|3.246439|4.893055|4.220698|0.126841|4.244137|0.103162|8.375560|0.191647|0.157531|7.423495|4.828291|0.113142|4.019867|6.938424|12.443700|36.858105| |1.969624|2.058378|2.416160|2.439396|3.879878|2.784511|4.292656|3.401330|0.105058|3.300761|0.081181|5.777644|0.132179|0.109015|4.871789|3.732225|0.088960|3.411528|6.152456|7.535061|12.459582|36.858105| |1.724236|1.784011|2.047899|2.063210|3.213200|2.343135|3.705768|2.798279|0.084641|2.820156|0.070757|4.810488|0.110596|0.094673|3.769800|2.987399|0.073923|2.727788|4.885267|4.971666|7.645977|13.140460|53.358707| |1.645253|1.691910|1.935826|1.940825|3.016125|2.253408|3.619464|2.692115|0.081883|2.788277|0.069519|4.676350|0.111159|0.092111|3.414042|2.757396|0.068679|2.489362|4.358796|4.230650|6.028507|7.819926|19.013104|36.858105| |1.728595|1.774055|2.048314|2.040804|3.196736|2.433008|3.920186|2.942471|0.091520|3.071802|0.074888|5.106692|0.126670|0.097759|3.566638|2.906724|0.071497|2.600865|4.467413|4.380297|5.872491|6.903857|11.478032|15.825553|73.516695| |1.472059|1.508516|1.699438|1.707320|2.614488|1.954827|3.184583|2.286316|0.068146|2.393263|0.060978|3.906527|0.090290|0.079058|2.823825|2.339943|0.059642|2.128936|3.740886|3.308820|4.409334|5.223374|11.270150|13.887903|14.999063|53.358707| |2.012383|2.265075|2.708021|3.121149|5.413869|3.935326|5.758230|5.144838|0.127442|5.401034|0.151301|10.493824|0.167420|0.242568|12.100026|7.433577|0.209402|5.142514|8.311726|7.389423|6.208481|4.246690|4.786331|3.140163|5.570239|3.681702|36.858105| |1.828927|2.041670|2.401768|2.745345|4.653099|3.552994|5.406335|4.586857|0.112794|5.430620|0.161171|10.461228|0.167495|0.310532|8.087152|5.716730|0.169965|4.077109|6.512113|5.500019|5.257113|3.718198|4.449383|3.035904|5.414487|3.645759|15.380006|73.516695| |2.025327|2.285460|2.696535|3.109107|5.205523|3.563718|5.252342|4.313908|0.109580|4.191983|0.117698|7.247258|0.125418|0.156147|8.140630|6.298044|0.179721|5.099526|8.994586|6.493877|5.473369|4.084488|4.591987|2.922881|5.065033|3.467785|15.750250|15.082829|73.516695| |2.154223|2.370737|2.884052|3.146677|5.437745|5.327230|9.031788|7.282251|0.188602|12.555940|0.247304|10.278467|0.206723|0.173147|4.956108|5.016888|0.129102|3.858490|5.617891|4.072629|3.612292|2.967447|3.583819|2.710412|5.459706|3.206903|3.915175|7.265750|5.690059|36.858105| |2.334826|2.531199|3.092706|3.236243|5.416569|5.372484|9.759989|6.444943|0.189114|7.567263|0.162471|7.299552|0.155261|0.123625|4.093566|4.336217|0.108851|3.657994|5.394137|3.649641|3.220966|2.787575|3.369419|2.566199|5.239357|3.036750|3.225859|5.757727|4.907225|13.755466|36.858105| |2.115588|2.239077|2.637104|2.690183|4.262195|3.949625|7.440718|4.391364|0.128910|5.022989|0.119356|5.492883|0.119690|0.098918|3.209461|3.301059|0.085053|2.900337|4.443323|2.973429|2.750313|2.460733|3.068838|2.388031|4.896586|2.884398|2.665176|4.830176|4.135192|7.932792|13.772135|36.858105| |1.839553|1.943034|2.241899|2.313925|3.627794|3.253484|6.036876|3.655533|0.103698|4.423105|0.110689|5.093748|0.111291|0.096309|2.932711|2.916754|0.077016|2.531186|3.938067|2.700720|2.589818|2.310586|2.954754|2.331984|4.751817|2.872373|2.535307|4.732844|3.918060|6.828517|7.936576|13.847399|36.858105| |1.746400|1.866855|2.157396|2.279853|3.632679|3.243598|5.856693|3.788300|0.103496|5.002242|0.129186|5.841065|0.126085|0.114814|3.201370|3.096970|0.083250|2.592690|4.018711|2.853936|2.774689|2.404815|3.089621|2.433128|4.902208|3.008946|2.828670|5.465979|4.278997|7.894903|6.892691|7.995751|13.746767|36.858105| |1.861873|2.024453|2.383902|2.582669|4.268295|3.901514|6.799137|4.883232|0.127740|7.511205|0.190958|8.199348|0.170289|0.160488|4.079559|3.902648|0.105216|3.090471|4.679237|3.435137|3.261341|2.706794|3.397199|2.622577|5.245563|3.183819|3.533692|6.953948|5.157279|13.612272|7.942194|6.898144|7.915166|13.739355|36.858105| |1.688205|1.846275|2.143244|2.365779|3.880862|3.369703|5.720343|4.176501|0.105264|6.256854|0.188011|8.104148|0.156356|0.191075|4.120713|3.752394|0.106477|2.916461|4.495167|3.346190|3.284769|2.658778|3.391918|2.583705|4.983714|3.197957|3.952610|8.546146|5.635484|7.014509|4.767581|4.238958|4.761364|7.033287|10.993976|448.794386| |1.508120|1.600202|1.808639|1.906360|2.963385|2.541419|4.579441|2.882151|0.078373|3.621736|0.098688|4.561013|0.097442|0.094537|2.634056|2.508853|0.068791|2.143240|3.402375|2.387371|2.398458|2.115017|2.798999|2.223001|4.387779|2.838857|2.451704|4.827104|3.772293|4.737626|4.241077|4.815315|7.128923|11.020303|6.987586|48.307042|448.794386| |2.215502|2.278662|2.628147|2.565505|3.875042|3.443339|6.663098|3.548270|0.107071|3.657015|0.089558|4.218112|0.091323|0.076737|2.656051|2.778914|0.071452|2.590120|4.065189|2.561184|2.371405|2.209287|2.770945|2.151275|4.385356|2.620699|2.234304|3.966126|3.572296|4.772280|7.060255|10.989928|7.074573|4.786724|4.238064|24.558121|28.579521|448.794386| |17.541824|8.777434|6.785893|4.510341|4.988571|3.157360|5.418623|2.756880|0.081459|2.268800|0.059125|2.931588|0.058741|0.054184|2.351408|2.696108|0.068949|3.325134|6.214994|2.450967|2.093434|2.093851|2.480738|1.726789|3.214464|2.094703|2.049192|3.284140|3.693008|2.117146|2.281173|2.063892|1.800674|1.715484|1.832463|13.394248|11.917602|17.257585|0.500000| |17.556822|8.783267|5.462437|4.055708|4.362749|2.843539|5.084347|2.432225|0.069833|2.049866|0.054437|2.606912|0.051866|0.048825|2.052977|2.360848|0.062154|2.830410|5.163166|2.079681|1.803781|1.781733|2.148089|1.508508|2.802055|1.853744|1.828490|2.976588|3.286430|1.933911|2.080049|1.909830|1.682018|1.601231|1.696057|12.458120|11.232428|16.084142|0.301730|0.500000| |17.539711|8.775722|6.782528|4.509560|4.985906|3.347361|6.069507|2.824732|0.083169|2.340364|0.060978|2.929737|0.058782|0.053993|2.272327|2.630672|0.067814|3.131965|5.517958|2.310111|1.984973|1.955020|2.340186|1.658307|3.126494|2.018436|1.967907|3.207528|3.473816|2.238645|2.478853|2.267588|1.950258|1.825821|1.928632|13.827422|12.584249|19.530167|0.301508|0.301733|0.500000| |8.861819|17.514028|8.854518|6.916321|6.296845|3.996988|7.380276|3.114656|0.086052|2.539432|0.068332|3.104328|0.060293|0.057779|2.441868|2.975210|0.079740|3.669651|6.359333|2.363546|1.993120|1.898861|2.264024|1.590124|2.968947|1.942347|2.153939|3.500264|3.832353|2.343171|2.508363|2.237060|1.946200|1.865704|2.012772|14.718149|12.868602|18.353085|0.172991|0.212938|0.210822|0.500000| |8.863384|17.516816|8.858613|6.916258|6.300644|3.685897|6.295514|3.024592|0.084166|2.449079|0.065764|3.106205|0.060244|0.058006|2.539782|3.069707|0.081577|3.988364|7.489041|2.513651|2.102000|2.024188|2.389467|1.649678|3.043280|2.009442|2.260803|3.599423|4.130144|2.205603|2.305203|2.041883|1.798313|1.749080|1.904733|14.201327|12.162205|16.440172|0.210880|0.212984|0.172991|0.303648|0.500000| |6.855092|8.839527|17.537798|8.895890|9.547111|5.162631|8.019544|4.296496|0.128056|3.203674|0.081849|4.091338|0.080106|0.073298|3.432551|4.265676|0.103903|6.065779|11.206064|3.528777|2.788456|2.678928|3.039290|2.084765|3.907671|2.468685|2.830339|4.385398|5.071909|2.824395|2.999431|2.556957|2.185921|2.113632|2.341408|17.011018|14.273027|20.344378|0.203333|0.140241|0.168577|0.173555|0.211828|0.500000| |6.863039|8.845608|17.520206|8.885556|9.523836|6.142299|10.745763|4.565903|0.134997|3.413908|0.086950|4.085604|0.080200|0.072816|3.199522|4.019153|0.100109|5.084954|8.190721|3.143646|2.546762|2.405663|2.791740|1.967725|3.753187|2.346735|2.626832|4.207326|4.544740|3.132868|3.496248|2.977862|2.469987|2.330333|2.551845|17.920391|15.457833|24.386253|0.168827|0.140339|0.203528|0.211809|0.173635|0.302262|0.500000| |4.522535|6.826959|8.812384|17.622435|12.614349|7.274124|13.057185|4.716444|0.119397|3.586989|0.098630|4.161608|0.077503|0.076532|3.309826|4.483096|0.124182|5.756572|8.819138|2.984210|2.412926|2.192347|2.569739|1.796592|3.364840|2.172337|2.862350|4.601549|5.005755|3.103397|3.208890|2.700118|2.329847|2.288694|2.572782|18.873215|15.404650|20.763033|0.111039|0.108324|0.119427|0.205924|0.170201|0.173755|0.212313|0.500000| |4.527281|6.840039|8.822477|17.624924|12.613029|5.766525|8.837121|4.411880|0.114323|3.339781|0.091205|4.161488|0.077319|0.076986|3.564068|4.821860|0.131331|7.293311|12.976720|3.303591|2.612991|2.391555|2.757230|1.883230|3.472609|2.266771|3.127198|4.831080|5.731062|2.799021|2.808745|2.372392|2.085142|2.080386|2.354827|17.798945|14.218949|18.082089|0.119524|0.108449|0.111116|0.170573|0.206386|0.212525|0.173728|0.301702|0.500000| |2.423118|2.670844|3.293728|3.528573|6.019355|3.983946|5.691106|5.007176|0.147646|4.304549|0.106634|7.525812|0.147114|0.134865|9.121175|6.806525|0.147838|6.318035|11.917651|17.601964|8.841274|6.833410|6.235572|3.755540|6.654325|4.120517|6.861441|8.715679|12.724735|3.409028|3.127387|2.599490|2.367664|2.478944|2.923500|23.176040|16.976023|18.468356|0.071215|0.059854|0.065244|0.067435|0.074031|0.103534|0.087384|0.084166|0.098187|0.500000| |2.558697|2.773134|3.525229|3.625824|6.378970|4.591104|6.524669|6.301872|0.221422|5.271884|0.118739|9.190879|0.202237|0.145559|8.814609|6.871832|0.139065|5.991676|9.799367|17.480626|8.830289|6.988429|6.380535|4.174631|8.099879|4.391301|5.405329|7.810944|8.609540|4.302268|4.063303|3.270170|2.880680|2.956272|3.501397|25.851674|19.434804|22.931541|0.074818|0.062254|0.070913|0.070269|0.074028|0.110115|0.098705|0.087265|0.094746|0.302806|0.500000| |1.911026|2.036922|2.423957|2.532474|4.199353|3.198406|4.905618|4.232401|0.127794|4.563128|0.108769|9.342963|0.243754|0.176611|6.718860|4.495186|0.107084|3.638129|6.069764|8.756788|17.547102|8.968485|9.741059|6.720893|12.694977|6.557389|5.573375|9.296416|8.225102|4.054690|3.545070|3.045740|2.910844|3.166361|3.741546|30.090234|21.837070|20.569813|0.055083|0.047978|0.053275|0.053213|0.054998|0.072203|0.068273|0.064435|0.067643|0.172792|0.208212|0.500000| |1.862727|2.005262|2.357124|2.508202|4.104274|2.973258|4.521922|3.762072|0.107607|3.866546|0.098433|7.508861|0.159055|0.155080|6.796271|4.472549|0.110509|3.723573|6.532042|8.856819|17.562382|8.848162|9.326381|5.303272|8.603019|5.736090|7.058269|10.646998|11.438683|3.263205|2.865255|2.476818|2.374864|2.582293|3.034229|25.758745|18.373286|17.162262|0.053943|0.047093|0.051006|0.052156|0.055280|0.070735|0.064480|0.063316|0.069143|0.213959|0.173549|0.302737|0.500000| |2.000655|2.090902|2.433849|2.453184|3.838526|2.674081|4.115119|3.170887|0.096325|2.994969|0.075126|5.076920|0.110615|0.096967|4.504951|3.594346|0.086611|3.429144|6.451269|6.786790|8.825119|17.576714|12.610577|5.784847|8.982459|5.956252|4.090162|6.198016|7.440666|2.656367|2.512276|2.221627|2.080654|2.156154|2.418440|19.235950|15.343568|16.245631|0.059598|0.050411|0.054523|0.053181|0.057818|0.075860|0.066157|0.060745|0.067956|0.201101|0.170312|0.174743|0.214193|0.500000| |2.101194|2.169733|2.566454|2.530108|4.009011|2.893762|4.476645|3.512753|0.112990|3.331406|0.080330|5.611724|0.131358|0.102202|4.572610|3.689032|0.086427|3.452651|6.174005|6.987674|8.834791|17.624344|12.637253|7.283061|13.277336|6.584806|3.766597|5.918528|6.369763|3.064352|2.969258|2.626515|2.423661|2.469037|2.745981|20.880042|17.180291|19.220516|0.062426|0.052407|0.058419|0.055291|0.058623|0.079758|0.071890|0.062908|0.067936|0.171988|0.213926|0.211158|0.173652|0.303043|0.500000| |1.623783|1.685349|1.915653|1.946375|3.007756|2.179292|3.459628|2.571337|0.076098|2.606330|0.066690|4.418083|0.098645|0.089365|3.502373|2.792784|0.070483|2.557482|4.622508|4.416000|6.527264|9.081979|26.039239|9.417085|10.931828|10.608652|3.446521|5.743517|6.010245|2.416180|2.252200|2.059429|2.001571|2.109928|2.319262|19.031861|15.588424|14.934166|0.047576|0.041546|0.044739|0.043786|0.046411|0.057747|0.052887|0.049676|0.053607|0.117401|0.111697|0.165619|0.186940|0.225251|0.181244|0.500000| |1.424162|1.455617|1.627347|1.632128|2.475788|1.830519|2.984934|2.112584|0.062587|2.183339|0.056167|3.525238|0.079720|0.071610|2.608819|2.188512|0.056125|2.020355|3.594767|3.055735|3.979774|4.837766|10.397205|9.326460|10.949699|26.035874|2.540606|4.434845|4.344865|2.128303|2.023158|1.920662|1.906019|1.989388|2.104345|17.074144|15.142375|14.157192|0.041487|0.036743|0.039675|0.038190|0.039785|0.048365|0.045566|0.042341|0.044537|0.079846|0.082167|0.114787|0.108718|0.119506|0.122519|0.226251|0.500000| |1.424561|1.452889|1.630274|1.630538|2.484737|1.874677|3.084871|2.176988|0.064981|2.293935|0.058443|3.666772|0.085081|0.074007|2.590909|2.186650|0.055943|1.993708|3.478957|2.968899|3.781884|4.312471|8.180130|9.562562|13.955683|26.031972|2.461469|4.380369|4.096046|2.308830|2.208478|2.134275|2.145053|2.232145|2.317838|18.482978|17.088791|15.666890|0.041238|0.036678|0.040080|0.038329|0.039329|0.048053|0.046253|0.042590|0.043960|0.075168|0.081953|0.117062|0.099295|0.101763|0.116614|0.154388|0.315580|0.500000| |2.684381|2.927396|3.693607|3.795213|6.424920|6.638278|12.140964|7.420879|0.235891|6.986344|0.149980|6.859094|0.142768|0.113745|4.173666|4.689251|0.114152|4.148342|6.020886|3.799103|3.220697|2.830538|3.353425|2.510667|5.092613|2.948323|3.201885|5.516656|4.968036|8.898395|17.802853|8.997233|5.674206|4.970104|5.640193|31.503079|27.503771|54.404200|0.072559|0.065339|0.079955|0.080114|0.072717|0.098659|0.120120|0.103536|0.088727|0.091761|0.121546|0.095493|0.078862|0.071743|0.084959|0.062073|0.055006|0.059182|0.500000| 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