Version2.2 2021-02-10T16:59:50Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 30-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCNC(=S)N1CCN(CC1)c2nc3c(c4c(s3)CCCC4)c(=O)n2CC(C)C C12390426 RHF 6-31G(d) (6D,7F) CCNC(=S)N1CCN(CC1)c2nc3c(c4c(s3)CCCC4)c(=O)n2CC(C)C C01[X(C21H31N5O1S2)] 174 C1 505 CCNC(=S)N1CCN(CC1)c1nc2sc3c(c2c(=O)n1CC(C)C)CCCC3 CCNC(=S)N1CCN(CC1)c1nc2sc3c(c2c(=O)n1CC(C)C)CCCC3 CCNC(=S)N1CCN(CC1)C2=Nc3sc4CCCCc4c3C(=O)N2CC(C)C InChIKey=DTLVVGPMZPADTO-UHFFFAOYSA-N InChI=1S/C21H31N5OS2/c1-4-22-21(28)25-11-9-24(10-12-25)20-23-18-17(19(27)26(20)13-14(2)3)15-7-5-6-8-16(15)29-18/h14H,4-13H2,1-3H3,(H,22,28) InChI=1/C21H31N5OS2/c1-4-22-21(28)25-11-9-24(10-12-25)20-23-18-17(19(27)26(20)13-14(2)3)15-7-5-6-8-16(15)29-18/h14H,4-13H2,1-3H3,(H,22,28)/f/h22H CCNC(=S)N1CCN(CC1)c2nc3c(c4c(s3)CCCC4)c(=O)n2CC(C)C C01[X(C21H31N5O1S2)] 174 C01 505 CCNC(=S)N1CCN(CC1)c1nc2sc3c(c2c(=O)n1CC(C)C)CCCC3 CC[NH][C]([N]1CC[N@](CC1)[C]1[N][C]2SC3=[C]([C]2C(=O)N1CC(C)C)CCCC3)S CCN[C](S)N1CCN(CC1)[C]2[N][C]3SC4=C(CCCC4)[C]3C(=O)N2CC(C)C InChIKey=YINIIHGAGZYOGK-UHFFFAOYSA-N InChI=1S/C21H32N5OS2/c1-4-22-21(28)25-11-9-24(10-12-25)20-23-18-17(19(27)26(20)13-14(2)3)15-7-5-6-8-16(15)29-18/h14,22,28H,4-13H2,1-3H3 InChI=1/C21H32N5OS2/c1-4-22-21(28)25-11-9-24(10-12-25)20-23-18-17(19(27)26(20)13-14(2)3)15-7-5-6-8-16(15)29-18/h14,22,28H,4-13H2,1-3H3 3219.6809844477 -1955.4540808 1-A 17854.3475 116 389 505 |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| -91.96957 -91.86518 -20.53193 -15.63060 -15.60771 -15.60146 -15.59238 -15.56928 -11.37945 -11.37002 -11.36385 -11.31309 -11.27989 -11.27694 -11.27674 -11.26683 -11.26670 -11.26595 -11.25689 -11.24129 -11.23574 -11.23485 -11.23472 -11.23192 -11.22362 -11.22032 -11.21888 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0.00650 0.99993 0.01005 -0.00847 -0.01000 0.99991 1 0.01131 0.00344 0.00289 0.23564 0.07162 0.06030 17.13 39.25 44.12 57.29 75.71 83.80 87.46 101.04 123.28 142.73 161.19 180.13 204.26 219.71 231.69 263.55 303.22 340.23 350.34 377.71 386.17 402.80 414.08 422.61 452.04 463.51 484.92 518.77 520.50 550.09 571.24 585.88 597.41 611.30 652.65 655.10 671.90 698.54 707.85 723.44 757.38 760.09 789.89 850.07 873.11 895.00 928.78 960.87 1010.18 1027.44 1031.72 1091.83 1120.87 1186.28 1215.83 1239.10 1255.58 1264.03 1286.95 1306.48 1310.28 1317.67 1320.83 1386.53 1411.62 1440.72 1458.19 1462.23 1477.94 1486.13 1486.80 1510.94 1513.96 1589.12 1593.81 1602.64 1639.87 1646.79 1669.26 1678.80 1696.99 1747.99 1779.50 1790.32 1814.40 1816.44 1822.39 1839.66 1855.25 1873.27 1884.27 1898.35 1909.96 1940.05 1957.42 1989.97 1994.55 1996.17 2029.13 2038.02 2049.85 2072.23 2112.29 2128.55 2144.65 2149.70 2167.29 2168.01 2178.92 2182.85 2199.05 2201.39 2207.21 2218.51 2235.78 2244.86 2246.65 2250.69 2257.61 2271.82 2285.77 2307.34 2337.06 2340.89 2348.09 2352.02 2352.35 2357.11 2357.42 2358.87 2363.97 2365.04 2373.24 2378.01 2379.96 2382.83 2390.75 2403.62 2444.93 2475.04 2532.51 2579.22 2781.56 4590.75 4598.93 4600.16 4605.02 4605.54 4615.04 4615.75 4626.04 4636.42 4640.70 4647.37 4666.64 4668.14 4673.47 4677.93 4687.01 4688.67 4696.35 4705.08 4712.24 4718.32 4722.19 4727.16 4763.39 4771.24 4774.34 4788.59 4805.16 4850.02 4859.36 5575.90 0.551457 0.578401 0.579346 0.491598 -1954.902624 -1954.875679 -1954.874735 -1954.962482 2.943049D-04 MUNgauss RevisionA2.1 retrievium 10-Feb-2021 DUDE CCNC(=S)N1CCN(CC1)c2nc3c(c4c(s3)CCCC4)c(=O)n2CC(C)C C12390426 RHF 6-31G(d) (6D,10F) C1 433.197004 |X|Y|Z| 114.845332 60.570406 31.561111 60.326580 19 6 7 16 14 4 1 |36.858105| |12.510596|36.858105| |7.828699|13.071474|53.358707| |5.109630|7.676575|19.278334|36.858105| |4.182956|6.241653|9.792536|11.255937|388.023441| |4.063706|5.192190|11.349505|14.094278|50.479375|53.358707| |3.911883|4.473577|9.204831|7.626032|33.552206|17.725544|36.858105| |3.210011|3.581334|6.548357|5.474147|28.642034|10.599987|12.441889|36.858105| |2.686247|3.043618|5.303746|4.699662|27.372631|8.985334|7.566683|13.063210|53.358707| |2.742427|3.254230|5.663130|5.530064|34.593948|10.558372|6.597656|7.850186|17.620952|36.858105| |3.133694|3.861922|7.107413|7.733415|44.002558|17.791822|7.895563|6.719938|10.458669|12.502041|36.858105| |2.347326|2.590199|4.375070|3.714907|22.274732|6.769431|5.803818|7.848769|18.643044|7.838384|5.903480|36.858105| |2.377021|2.571864|4.357296|3.570423|20.792895|6.492600|5.979401|6.909081|11.205937|5.740034|5.263522|14.847162|53.358707| |2.060028|2.195667|3.590883|2.882977|17.487624|4.929433|4.246273|4.654668|7.333223|4.279331|4.008031|8.497803|19.096669|36.858105| |1.828984|1.955140|3.128443|2.527246|15.945646|4.188509|3.416425|3.822030|6.307991|3.887984|3.501451|6.999977|10.720009|14.025899|36.858105| |1.646115|1.737737|2.726962|2.162520|13.826910|3.475348|2.797366|3.009369|4.679143|3.022224|2.832678|4.588331|7.097350|8.121136|13.140445|36.858105| |1.677370|1.750605|2.744754|2.140896|13.497265|3.425828|2.802826|2.915145|4.319001|2.788847|2.713536|4.084516|6.792161|7.676655|8.243011|14.184705|36.858105| |1.963889|2.044007|3.279407|2.540125|15.415255|4.176239|3.586821|3.628194|5.161100|3.216550|3.220985|4.929216|9.567328|11.017781|7.430619|7.367681|10.858545|388.023441| |1.522075|1.572071|2.421754|1.863247|11.891157|2.907610|2.344530|2.394695|3.460809|2.293777|2.265758|3.090617|4.923488|4.812488|5.056198|7.515614|12.658895|47.518350|36.858105| |1.377842|1.425145|2.172930|1.676545|10.886642|2.585408|2.054133|2.134456|3.122110|2.090975|2.027992|2.751034|4.161863|3.908024|4.449090|6.681596|7.660933|32.708012|12.425765|36.858105| |1.365219|1.428427|2.180273|1.705867|11.218849|2.636917|2.058176|2.156559|3.245055|2.207980|2.116219|2.883442|4.223919|3.955818|4.894082|7.595724|6.764758|29.724179|7.543773|12.451429|36.858105| |1.465999|1.546146|2.385705|1.888544|12.371246|2.964275|2.326780|2.503414|3.884334|2.596092|2.417933|3.591566|5.159027|5.029204|7.228778|12.618488|7.612610|33.491464|6.282698|7.516939|12.432958|36.858105| |1.810313|1.959942|3.126774|2.574161|16.621275|4.247413|3.358792|3.948566|7.082798|4.414564|3.669234|7.840982|9.134636|7.927359|13.174651|7.296168|5.134781|34.442022|3.730143|3.540833|4.043731|5.877554|36.858105| |1.642512|1.774377|2.778711|2.275810|15.096523|3.644145|2.809454|3.249686|5.622741|3.724901|3.124268|5.417290|6.421539|5.395183|8.086628|6.236939|4.389201|27.543503|3.419056|3.449061|4.134687|6.144473|15.858210|73.516695| |2.032248|2.232126|3.633378|3.060204|19.491434|5.207467|4.140267|5.273917|11.061407|6.235764|4.615078|13.883676|11.051862|7.181300|7.960943|5.020387|4.082030|30.943808|3.098375|2.878412|3.140845|4.119118|13.506674|14.905976|53.358707| |1.947930|2.149163|3.429821|2.894457|19.186408|4.715408|3.602046|4.666059|9.335656|5.886556|4.113172|7.653630|7.054382|4.636604|5.106269|3.784410|3.160930|23.253270|2.548297|2.447828|2.678581|3.400076|7.766066|12.524712|17.538892|36.858105| |1.909196|2.067249|3.257021|2.663414|17.494363|4.221184|3.345895|4.476890|7.790618|4.607284|3.416943|5.901502|6.034667|3.999026|4.244266|3.333068|2.872435|21.246256|2.369869|2.296759|2.444719|3.034499|5.638102|9.441200|10.268195|12.411030|36.858105| |1.795262|1.948110|2.997370|2.443072|16.666334|3.721558|2.837752|3.614294|5.916543|3.916360|2.985043|4.168665|4.526370|3.046224|3.223812|2.682296|2.353231|17.163214|2.008181|1.975195|2.108891|2.538506|4.079744|7.327211|6.757073|7.651716|12.431876|36.858105| |1.727683|1.834785|2.856029|2.279259|14.887973|3.574479|2.888163|3.675470|5.920496|3.536929|2.834250|4.914148|5.585483|4.025348|4.474554|3.655873|3.103091|22.026626|2.570895|2.547420|2.695696|3.402279|5.719221|10.075658|8.478383|7.445627|12.443531|7.555209|36.858105| |17.552841|8.793520|9.608137|4.797095|27.393624|5.432670|4.049810|3.420858|3.793983|2.772512|3.069910|2.417585|3.321322|2.103215|1.863230|1.670772|1.700271|14.192605|1.538400|1.394692|1.377539|1.485363|1.848382|2.976186|2.840166|2.009411|2.001208|1.879881|1.811345|0.500000| |17.525050|8.769854|9.548578|4.732937|26.854262|5.393947|3.919069|3.130033|3.571140|2.649289|3.073658|2.339766|3.293528|2.110829|1.857841|1.682850|1.733648|14.575731|1.579400|1.418543|1.396951|1.491289|1.813021|2.913093|2.742667|1.902087|1.854497|1.725797|1.696102|0.300392|0.500000| |17.573057|8.865853|7.686636|4.154137|26.379424|4.583801|3.212372|2.736728|3.203261|2.418480|2.719601|2.080451|2.853498|1.845078|1.658786|1.506235|1.532269|12.573641|1.402528|1.278451|1.268003|1.354480|1.647268|2.682627|2.494521|1.773001|1.743204|1.658716|1.585952|0.301278|0.302239|0.500000| |8.843328|17.649648|12.520394|6.938854|46.988918|6.472099|4.067684|3.464331|4.070274|3.235988|3.689386|2.511598|3.321434|2.088391|1.884267|1.671341|1.667211|13.656132|1.497100|1.369579|1.379729|1.498975|1.916794|3.109075|2.988859|2.158779|2.092012|2.003900|1.839753|0.211156|0.172721|0.212679|0.500000| |8.823215|17.580725|12.374474|6.753905|44.599401|6.402898|3.930468|3.162606|3.798743|3.045937|3.695144|2.423698|3.290534|2.093764|1.877352|1.682055|1.696813|13.977278|1.533085|1.390881|1.398160|1.504089|1.876795|3.036772|2.875426|2.027914|1.926850|1.821602|1.719637|0.172713|0.209838|0.213060|0.303931|0.500000| |7.624168|9.143646|26.081294|9.515254|38.452082|10.649166|7.590392|4.979476|5.302056|3.953701|4.938668|3.301356|4.636319|2.798586|2.390523|2.090284|2.133501|18.521465|1.881446|1.669791|1.659309|1.809413|2.341819|3.667270|3.670216|2.490392|2.375419|2.151368|2.114795|0.198146|0.218813|0.149033|0.183254|0.198403|0.500000| |3.498642|3.867242|7.417157|5.921553|28.574227|12.414493|17.613071|8.811957|9.081986|5.734949|7.070818|6.031330|9.713492|4.980384|3.791830|3.106696|3.188326|30.648406|2.632305|2.251619|2.237176|2.519187|3.548256|5.184788|5.742337|3.482641|3.179125|2.656826|2.835048|0.098690|0.101150|0.081189|0.096197|0.098281|0.177151|0.500000| |4.683027|5.100710|10.736083|7.234952|31.635507|12.306194|17.673299|8.979633|7.615337|4.964369|5.679068|4.529589|6.438166|3.603059|2.955601|2.495901|2.535351|22.838720|2.169588|1.908753|1.889880|2.105765|2.885957|4.386333|4.689945|3.095287|2.990908|2.596531|2.634802|0.139989|0.130664|0.102920|0.125563|0.118523|0.276143|0.301631|0.500000| |2.973948|3.169596|5.545048|4.325887|23.533709|7.674671|8.857648|17.638510|12.472155|5.682515|5.017622|7.488818|9.997738|5.023287|4.012062|3.172906|3.116596|28.222431|2.546239|2.254748|2.240184|2.603685|4.006208|5.815723|7.006422|4.440059|4.521246|3.545094|3.922565|0.089292|0.081787|0.071050|0.084674|0.078157|0.121255|0.215415|0.214265|0.500000| |3.370543|3.791010|6.781303|5.594692|30.194960|9.514010|8.914121|17.547572|12.634762|7.022795|5.837773|5.836767|6.838951|3.730272|3.227703|2.616416|2.521558|21.471709|2.120030|1.922964|1.947791|2.241549|3.421336|5.205126|6.096003|4.352120|4.390840|3.747027|3.516639|0.101973|0.088374|0.080055|0.105622|0.090768|0.136325|0.174228|0.221673|0.301651|0.500000| |2.395606|2.800834|4.670156|4.380852|29.523535|7.671023|4.949304|5.679909|12.353832|17.625230|8.910583|7.480581|7.335260|4.310132|4.152499|3.203807|2.873023|22.667202|2.353910|2.172045|2.344739|2.793954|4.978538|7.593855|9.555830|6.775633|4.735796|4.056321|3.638233|0.066784|0.064744|0.059677|0.077532|0.074418|0.091270|0.129078|0.109086|0.127437|0.142952|0.500000| |2.817036|3.391552|5.767750|5.660020|38.098076|9.473950|5.753844|6.952646|12.442575|17.580245|8.876737|5.805850|6.098814|3.511983|3.264280|2.622568|2.431839|19.585598|2.043902|1.887974|1.986481|2.309271|3.722199|5.827509|6.863158|5.338191|4.498131|4.090985|3.376368|0.079681|0.073843|0.069450|0.096997|0.087085|0.107674|0.132294|0.129958|0.142129|0.205246|0.301726|0.500000| |3.045732|3.853845|6.710303|7.450010|52.966842|12.462356|5.700096|4.984982|7.612438|8.865797|17.718191|4.579216|5.616291|3.360880|3.049664|2.541681|2.429963|19.868835|2.070824|1.876322|1.971715|2.225429|3.224974|5.054877|5.309855|3.642747|3.040807|2.760353|2.541545|0.081200|0.082217|0.074746|0.103935|0.106126|0.124064|0.144763|0.126967|0.109632|0.129670|0.213585|0.214970|0.500000| |2.892920|3.433438|6.150173|5.965174|34.273847|12.569255|7.244602|5.981401|9.426497|8.865137|17.540946|6.301794|8.332174|4.673908|3.964193|3.186755|3.082085|26.607083|2.535710|2.229277|2.328058|2.659125|3.984553|5.899022|6.563960|4.002179|3.275018|2.801316|2.808569|0.078385|0.081006|0.070115|0.089107|0.092923|0.125717|0.215914|0.145590|0.133956|0.136160|0.215330|0.173968|0.301240|0.500000| |1.512892|1.565488|2.403686|1.849841|11.857581|2.871814|2.282632|2.281350|3.288117|2.226584|2.243590|2.888278|4.586287|4.322841|4.425793|6.056490|8.922814|42.255716|17.506944|8.809793|6.576952|5.281328|3.374723|5.528019|3.898057|2.373711|2.181104|1.872123|2.313455|0.042166|0.043797|0.038795|0.041252|0.042723|0.051877|0.071562|0.058680|0.066385|0.056224|0.063607|0.055072|0.057470|0.070363|0.500000| |1.525736|1.559162|2.393898|1.818608|11.524813|2.820637|2.303962|2.343754|3.305565|2.171453|2.154157|2.899783|4.653981|4.380960|4.339642|5.750976|8.896227|45.346991|17.538150|8.806494|5.509201|4.851577|3.303720|5.359649|3.874402|2.373280|2.257254|1.920094|2.458006|0.043003|0.044147|0.039060|0.041148|0.042097|0.052003|0.071849|0.060067|0.070160|0.057838|0.060977|0.054188|0.054572|0.066373|0.303727|0.500000| |1.299272|1.338536|2.023819|1.552866|10.144019|2.368512|1.867124|1.918711|2.777207|1.884220|1.845788|2.392843|3.590849|3.245554|3.574744|4.893332|5.574783|27.205605|8.840757|17.545846|8.802075|5.479971|2.961450|5.180789|3.376721|2.152900|2.031668|1.777571|2.230165|0.036437|0.037227|0.033641|0.035720|0.036430|0.043170|0.056623|0.048594|0.056002|0.048428|0.054209|0.047641|0.047867|0.056107|0.219655|0.206827|0.500000| |1.361134|1.401853|2.134317|1.640037|10.631307|2.523973|2.023131|2.133341|3.103260|2.050643|1.963918|2.726068|4.085607|3.790770|4.315131|6.165770|6.693321|30.851747|8.851638|17.520858|8.856297|6.917903|3.511002|6.123630|3.906651|2.470342|2.372961|2.035532|2.700936|0.038498|0.038809|0.035097|0.037548|0.037805|0.045547|0.061071|0.052530|0.063318|0.053657|0.058823|0.051797|0.050304|0.059277|0.174106|0.219963|0.302964|0.500000| |1.370879|1.439983|2.196010|1.723960|11.388886|2.660651|2.051163|2.113900|3.184360|2.208040|2.150721|2.805952|4.123400|3.806208|4.569489|6.618668|6.210219|28.885023|6.950690|8.869863|17.510736|8.846089|3.803207|6.833004|4.105188|2.567760|2.303030|2.003744|2.469767|0.038190|0.039063|0.035395|0.038529|0.039392|0.046381|0.062248|0.052152|0.060256|0.052973|0.065472|0.054965|0.056080|0.066366|0.196625|0.140169|0.211135|0.173854|0.500000| |1.272725|1.329612|2.013104|1.571712|10.438983|2.404063|1.862961|1.959382|2.939642|2.016959|1.923070|2.558818|3.663071|3.297815|4.012938|5.548942|4.939752|24.172837|5.493636|8.816942|17.545695|8.843850|3.547110|6.706960|3.831514|2.483056|2.296136|2.018183|2.550743|0.035694|0.036056|0.032993|0.035839|0.036181|0.042353|0.055565|0.047841|0.056368|0.049773|0.059580|0.051030|0.050210|0.058008|0.138038|0.123289|0.214722|0.210812|0.303323|0.500000| |1.424233|1.495857|2.298663|1.811176|11.886325|2.825494|2.231869|2.446044|3.775750|2.490588|2.280400|3.447331|4.834285|4.540696|6.327974|8.947981|6.108064|29.646512|5.259581|6.530406|8.799171|17.523885|5.649624|11.078939|5.483466|3.448277|3.192694|2.670383|3.759434|0.040318|0.040075|0.036623|0.040493|0.040225|0.048322|0.066205|0.056567|0.071394|0.061491|0.073945|0.062389|0.058284|0.068398|0.120686|0.122129|0.137301|0.194427|0.174015|0.219632|0.500000| |1.454872|1.547981|2.385499|1.908881|12.672725|2.991182|2.301291|2.476392|3.925741|2.691475|2.488379|3.598429|4.974338|4.631859|6.690625|8.921995|5.807910|29.107370|4.860076|5.499779|8.799335|17.598816|6.214164|12.693253|5.820266|3.594386|3.094087|2.623073|3.376751|0.040792|0.040941|0.037405|0.041848|0.041987|0.049839|0.068595|0.057455|0.070167|0.061962|0.082386|0.066443|0.064290|0.075885|0.122834|0.108262|0.123106|0.139760|0.219603|0.206420|0.305782|0.500000| |2.071148|2.328521|3.733627|3.236845|21.908412|5.264311|3.839465|4.957984|10.342048|7.513863|4.752443|7.038740|6.512559|4.090038|4.269640|3.271217|2.821925|21.227879|2.315455|2.206459|2.399194|2.948194|5.837623|9.477834|12.366807|17.710066|8.875504|7.157627|5.480708|0.059117|0.055660|0.052295|0.065588|0.060993|0.073942|0.099994|0.090683|0.122919|0.132820|0.253120|0.197755|0.118306|0.122165|0.060896|0.060208|0.054618|0.061272|0.064966|0.061976|0.081610|0.086930|0.500000| |1.769274|1.944530|3.050854|2.555212|17.341585|4.066118|3.045065|3.719294|6.885436|4.727221|3.551112|5.752191|5.897305|4.167024|4.900987|3.800150|3.092321|21.679864|2.527991|2.488698|2.798096|3.596246|7.762892|15.332543|12.633868|17.697882|8.820100|6.915275|6.796212|0.050368|0.048131|0.045131|0.054277|0.051522|0.061474|0.083132|0.073868|0.099344|0.097321|0.156885|0.121021|0.090473|0.097788|0.065546|0.064635|0.060869|0.069592|0.074454|0.072987|0.102094|0.109360|0.304110|0.500000| |2.101881|2.270551|3.623173|2.945295|18.835815|4.712295|3.866442|5.566150|9.283906|5.010408|3.684299|6.414812|6.537393|4.084621|4.053207|3.176200|2.828254|21.824955|2.333047|2.217460|2.310058|2.812287|4.979348|7.855816|9.408784|8.923698|17.536901|8.925898|8.906372|0.061897|0.056490|0.052854|0.063845|0.057984|0.073649|0.099519|0.096360|0.159561|0.155007|0.132970|0.137842|0.089035|0.096406|0.059776|0.062541|0.054690|0.063598|0.060737|0.059827|0.081164|0.078259|0.214848|0.174440|0.500000| |1.648281|1.786882|2.724233|2.219069|15.365145|3.356823|2.524176|3.096228|5.069983|3.483935|2.728444|3.715278|4.126062|2.867971|3.130235|2.658386|2.301965|16.344947|1.981329|1.980271|2.146845|2.590219|4.017058|7.664268|6.236411|6.903605|8.761426|17.529228|6.823367|0.047568|0.044204|0.042561|0.050924|0.046891|0.054349|0.066710|0.064182|0.084325|0.087497|0.103760|0.099378|0.071246|0.072178|0.051389|0.052233|0.049603|0.056634|0.056616|0.057686|0.076226|0.075513|0.174862|0.204821|0.173596|0.500000| |1.747661|1.872241|2.849492|2.278106|15.474943|3.417261|2.640044|3.332125|5.134542|3.360353|2.659453|3.603324|4.074540|2.762524|2.881369|2.455639|2.191267|16.016886|1.895878|1.870317|1.969216|2.333576|3.483980|6.224859|5.552169|5.527171|8.783937|17.557283|6.919478|0.051230|0.046577|0.045038|0.053656|0.048415|0.057002|0.068536|0.068572|0.092964|0.097614|0.093929|0.098196|0.068476|0.069462|0.048974|0.050898|0.047015|0.053997|0.051730|0.052642|0.068796|0.066009|0.144486|0.140803|0.213426|0.301814|0.500000| |1.896755|2.086337|3.207391|2.650829|18.431756|3.994868|2.964804|3.764319|6.182623|4.324521|3.221347|4.078845|4.392704|2.884889|2.986345|2.485082|2.208459|16.352992|1.892307|1.844552|1.966790|2.335768|3.711141|6.537735|6.316121|6.995353|8.738470|17.539239|5.479927|0.055071|0.050193|0.048689|0.060275|0.054093|0.063022|0.075594|0.075187|0.098703|0.111918|0.123515|0.132455|0.083773|0.081734|0.049539|0.050280|0.046405|0.052280|0.052559|0.052149|0.067013|0.067429|0.216617|0.170990|0.213317|0.301185|0.301900|0.500000| 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|1.684020|1.769888|2.725388|2.142247|14.013934|3.300175|2.678260|3.376846|5.134143|3.110255|2.549906|4.050946|4.792666|3.428762|3.671825|3.136615|2.756783|19.736998|2.346617|2.333651|2.421440|2.952151|4.351324|7.672048|6.397319|5.454685|8.818571|6.964384|17.545058|0.049394|0.045789|0.043118|0.049508|0.045890|0.056077|0.072386|0.069422|0.101520|0.092198|0.086868|0.084501|0.064018|0.069571|0.058782|0.063357|0.057469|0.069374|0.061631|0.064327|0.090883|0.080416|0.123404|0.139732|0.213271|0.170673|0.210027|0.141769|0.302667|0.500000| 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