Version2.3 2021-03-31T23:21:37Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 16-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1c(sc2c1c(=O)[nH]c(n2)CS[C@@H](C)C(=O)NNC(=O)c3cc4c(s3)CC[C@H](C4)C)C C17640033 RHF 6-31G(d) (6D,7F) Cc1c(sc2c1c(=O)[nH]c(n2)CS[C@@H](C)C(=O)NNC(=O)c3cc4c(s3)CC[C@H](C4)C)C C01[X(C22H26N4O3S3)] 168 C1 544 C[C@@H]1CCc2c(C1)cc(s2)C(=O)NNC(=O)[C@@H](SCc1[nH]c(=O)c2c(n1)sc(c2C)C)C C[C@@H]1CCc2c(C1)cc(s2)C(=O)NNC(=O)[C@@H](SCc1[nH]c(=O)c2c(n1)sc(c2C)C)C C[C@@H]1CCc2sc(cc2C1)C(=O)NNC(=O)[C@H](C)SCC3=Nc4sc(C)c(C)c4C(=O)N3 InChIKey=SCEPWKGBXNFZEW-MFKMUULPSA-N InChI=1S/C22H26N4O3S3/c1-10-5-6-15-14(7-10)8-16(32-15)20(28)26-25-19(27)13(4)30-9-17-23-21(29)18-11(2)12(3)31-22(18)24-17/h8,10,13H,5-7,9H2,1-4H3,(H,25,27)(H,26,28)(H,23,24,29)/t10-,13+/m1/s1 InChI=1/C22H26N4O3S3/c1-10-5-6-15-14(7-10)8-16(32-15)20(28)26-25-19(27)13(4)30-9-17-23-21(29)18-11(2)12(3)31-22(18)24-17/h8,10,13H,5-7,9H2,1-4H3,(H,25,27)(H,26,28)(H,23,24,29)/t10-,13+/m1/s1/f/h23,25-26H Cc1c(sc2c1c(=O)[nH]c(n2)CS[C@@H](C)C(=O)NNC(=O)c3cc4c(s3)CC[C@H](C4)C)C C01[X(C22H26N4O3S3)] 168 C01 544 C[C@@H]1CCc2c(C1)cc(s2)C(=O)NNC(=O)[C@@H](SCc1[nH]c(=O)c2c(n1)sc(c2C)C)C C[C@@H]1CCC2=[C]([CH]=C(S2)C(=O)NNC(=O)[C@@H](SCC2=N[C]3[C]([C](=C(S3)C)C)C(=O)N2)C)C1 C[C@@H]1CCc2sc(cc2C1)C(=O)NNC(=O)[C@H](C)SCC3=N[C]4SC(=C(C)[C]4C(=O)N3)C InChIKey=SCEPWKGBXNFZEW-MFKMUULPSA-N InChI=1S/C22H26N4O3S3/c1-10-5-6-15-14(7-10)8-16(32-15)20(28)26-25-19(27)13(4)30-9-17-23-21(29)18-11(2)12(3)31-22(18)24-17/h8,10,13H,5-7,9H2,1-4H3,(H,25,27)(H,26,28)(H,23,24,29)/t10-,13+/m1/s1 InChI=1/C22H26N4O3S3/c1-10-5-6-15-14(7-10)8-16(32-15)20(28)26-25-19(27)13(4)30-9-17-23-21(29)18-11(2)12(3)31-22(18)24-17/h8,10,13H,5-7,9H2,1-4H3,(H,25,27)(H,26,28)(H,23,24,29)/t10-,13+/m1/s1/f/h23,25-26H 3440.9841269288 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723.28 733.80 743.82 786.94 800.07 822.48 876.66 923.51 938.02 953.30 956.37 970.41 995.23 1021.40 1038.15 1074.24 1109.82 1112.09 1130.04 1191.17 1201.13 1243.03 1245.14 1265.76 1290.79 1315.39 1372.22 1415.02 1428.27 1448.67 1457.53 1471.08 1490.78 1495.62 1503.87 1540.29 1586.05 1600.79 1646.50 1658.28 1659.36 1681.15 1689.95 1694.90 1707.36 1736.56 1738.02 1769.37 1791.09 1808.86 1816.67 1818.83 1849.61 1878.92 1883.13 1900.48 1916.21 1936.82 1971.88 2011.41 2018.21 2048.98 2055.33 2068.67 2103.10 2140.67 2146.54 2183.74 2185.88 2202.58 2214.35 2247.35 2253.32 2254.96 2255.36 2274.99 2314.70 2325.18 2339.77 2341.23 2341.76 2347.19 2349.78 2351.44 2354.85 2358.83 2360.79 2364.72 2365.67 2369.81 2401.90 2442.04 2560.62 2572.22 2588.76 2645.36 2747.36 2817.65 2825.29 4570.09 4582.41 4596.67 4603.18 4606.90 4617.51 4627.33 4635.88 4643.20 4649.16 4659.59 4670.59 4672.12 4687.51 4688.55 4695.40 4699.12 4715.62 4732.22 4754.15 4780.57 4789.78 4911.63 5531.88 5539.50 5560.70 0.495205 0.526300 0.527244 0.425340 -2482.693386 -2482.662292 -2482.661347 -2482.763252 3.417910D-04 MUNgauss RevisionA2.1 retrievium 31-Mar-2021 DUDE Cc1c(sc2c1c(=O)[nH]c(n2)CS[C@@H](C)C(=O)NNC(=O)c3cc4c(s3)CC[C@H](C4)C)C C17640033 RHF 6-31G(d) (6D,10F) C1 490.116706 |X|Y|Z| 168.909140 67.299858 34.521890 73.212846 25 6 7 16 18 4 3 |36.858105| |12.645251|36.858105| |7.470117|14.140350|36.858105| |4.688729|7.363578|10.852025|388.023441| |5.054801|8.087243|7.658769|78.676351|36.858105| |7.360075|13.129074|8.243171|53.007722|13.982039|36.858105| |6.031750|7.290118|5.128979|34.477961|7.909138|13.138991|36.858105| |6.218379|6.132232|4.337723|27.400554|5.363914|7.976235|15.890457|73.516695| |4.211310|5.065345|4.117843|31.351456|7.320856|8.091561|13.652961|15.074004|53.358707| |3.695717|4.146765|3.427697|25.468596|5.291322|5.854736|9.407666|14.054081|25.976918|0.500000| |3.626389|4.581177|4.086715|35.243271|8.541221|6.983862|7.779585|9.638398|19.045578|0.257758|36.858105| |3.803131|5.182503|4.972875|50.077738|13.934659|7.806113|6.652934|8.349761|11.197565|0.165214|14.979461|53.358707| |2.832173|3.362967|3.109066|26.387410|5.213918|4.503174|5.063664|7.266206|10.700722|0.207176|12.645313|10.676432|36.858105| |2.425213|2.894449|2.844733|25.506571|4.452216|3.616732|3.658643|5.421134|6.453898|0.122091|6.906481|8.891781|10.500238|388.023441| |2.025334|2.314416|2.250822|18.984487|3.173653|2.781992|2.923837|4.574362|5.008646|0.102413|4.581872|5.589842|6.909620|73.784193|36.858105| |2.033967|2.296982|2.199327|18.141553|3.081150|2.771938|2.995702|4.744689|5.202671|0.109975|4.578919|5.336997|7.096077|56.417820|17.576962|0.500000| |1.912214|2.154529|2.089056|17.269022|2.847649|2.552831|2.701158|4.304692|4.530236|0.094150|3.944686|4.825296|5.489408|48.108622|12.470412|0.245491|36.858105| |1.816939|2.065575|2.049788|17.328982|2.754348|2.410152|2.463283|3.899666|4.022176|0.081123|3.581420|4.659767|4.706922|50.339170|12.522944|0.248233|7.605317|36.858105| |1.717249|1.950873|1.962518|16.658317|2.568108|2.239243|2.248329|3.572346|3.583851|0.071552|3.161334|4.253896|3.918797|41.367519|7.955311|0.164031|6.619738|15.869892|73.516695| |1.742878|1.961791|1.940724|16.146810|2.550557|2.268370|2.330537|3.732494|3.758698|0.076509|3.251543|4.211160|4.134504|38.657259|7.860192|0.214954|5.302186|14.109010|15.163500|53.358707| |1.598809|1.790048|1.793652|14.861394|2.270998|2.026254|2.047095|3.305047|3.205523|0.064697|2.724984|3.639052|3.256162|29.598343|5.142894|0.137487|3.994925|8.131407|12.783137|18.675883|53.358707| |1.585122|1.768106|1.775419|14.598492|2.209025|1.984002|1.995157|3.235746|3.080636|0.061995|2.582867|3.476545|2.985134|25.772733|4.086697|0.114287|3.227326|5.479052|8.696323|11.097181|19.103580|36.858105| |1.670043|1.859664|1.851064|15.110803|2.319726|2.098752|2.129295|3.457348|3.300353|0.066708|2.745857|3.648031|3.167225|26.123965|4.036203|0.118723|3.126815|4.943710|7.443095|9.900087|11.607272|15.821219|73.516695| |1.451545|1.609010|1.631929|13.319521|1.963165|1.772634|1.762057|2.878653|2.663224|0.053355|2.202751|3.016341|2.462673|20.893710|3.185451|0.087394|2.666755|4.086399|7.073539|7.058131|10.769303|12.892420|14.384405|36.858105| |1.419919|1.566469|1.594594|12.896063|1.877054|1.706645|1.686648|2.769108|2.512583|0.050187|2.053094|2.832320|2.238143|18.419924|2.700425|0.074920|2.291222|3.267657|5.633525|5.394158|7.087916|7.649245|11.745937|14.140759|36.858105| |1.302483|1.428428|1.462096|11.735730|1.682631|1.537771|1.512041|2.496603|2.226782|0.044448|1.804345|2.504726|1.942081|15.862144|2.312549|0.063487|2.023915|2.755562|4.904665|4.330930|5.500590|5.097221|7.891303|8.191376|13.278956|36.858105| |1.253824|1.375068|1.408346|11.329761|1.623930|1.481558|1.458156|2.407607|2.153399|0.043050|1.749580|2.426588|1.897321|15.695733|2.329277|0.063076|2.072560|2.825735|5.182586|4.358531|5.663448|4.834164|7.068556|7.684970|8.243414|14.113827|36.858105| |1.324166|1.460783|1.488366|12.095640|1.761075|1.595120|1.580638|2.594945|2.371243|0.047551|1.950420|2.682805|2.168924|18.462728|2.850581|0.076262|2.510776|3.661891|6.838936|5.783589|8.372032|6.662289|8.561204|10.944765|7.448774|7.426879|11.002162|388.023441| |1.152692|1.256739|1.290530|10.296362|1.462224|1.341941|1.317783|2.187444|1.929185|0.038587|1.554624|2.161326|1.669427|13.647658|2.013787|0.054338|1.837179|2.386955|4.440745|3.557758|4.392454|3.527524|5.385336|4.809506|5.065956|7.522182|12.662713|47.627196|36.858105| |1.123369|1.220767|1.258503|9.976191|1.402441|1.292228|1.262431|2.101392|1.830319|0.036505|1.465630|2.048926|1.550976|12.501991|1.805265|0.048960|1.647331|2.089014|3.841210|3.090040|3.687082|3.005542|4.792187|3.915421|4.467661|6.698166|7.655306|32.792835|12.423388|36.858105| |1.133368|1.227174|1.259683|9.919722|1.401403|1.298572|1.273351|2.126333|1.843121|0.036851|1.467118|2.041218|1.548944|12.306408|1.774110|0.048766|1.604741|2.030996|3.653373|3.057134|3.614544|3.052246|5.022887|3.959192|4.906865|7.555800|6.699221|29.716209|7.493155|12.418294|36.858105| |1.098309|1.184550|1.209110|9.475818|1.349161|1.256173|1.240106|2.078337|1.799107|0.036160|1.425940|1.968357|1.514138|11.948326|1.747012|0.048320|1.587510|1.997230|3.575334|3.027557|3.575594|3.008250|4.964514|3.862699|4.651343|6.725723|6.284026|29.313738|7.029676|8.924744|17.490259|0.500000| |1.241010|1.351759|1.387332|11.005433|1.561000|1.438600|1.409175|2.341006|2.048913|0.040856|1.641085|2.286695|1.735839|13.866619|1.984480|0.054768|1.758987|2.287742|4.058246|3.511814|4.208606|3.743135|6.218411|5.061847|7.286942|12.624987|7.594560|33.669711|6.297128|7.568046|12.403698|0.247824|36.858105| |1.085122|1.168922|1.202828|9.388650|1.315437|1.225959|1.198065|2.008948|1.717940|0.034302|1.357299|1.894499|1.415806|11.102079|1.579402|0.043498|1.438313|1.773308|3.180556|2.633024|3.023819|2.514317|4.250733|3.077694|3.714850|4.928726|4.403617|22.396729|4.886752|7.515021|12.465031|0.247764|7.534425|36.858105| |5.931252|7.371568|12.672829|48.528567|4.832977|5.031289|3.703688|5.958183|4.235640|0.075165|3.099149|4.942929|2.508183|16.847239|1.935726|0.052462|1.814823|1.799481|3.100353|2.334679|2.193246|1.603894|2.953862|1.497872|1.476175|1.369869|1.320436|9.808338|1.221151|1.200343|1.200287|0.031933|1.313150|1.155752|36.858105| |17.584348|8.886883|5.860066|29.267692|4.609536|6.597736|6.078525|12.006432|5.774701|0.105712|3.559563|4.925907|2.814874|16.924368|2.011933|0.056132|1.929667|1.788751|3.009153|2.320749|2.119113|1.531592|2.857436|1.400196|1.362146|1.251590|1.211104|9.137420|1.115995|1.083655|1.090567|0.029443|1.189203|1.042244|4.817921|0.500000| |17.584425|8.886992|5.859868|29.267688|4.609776|6.598348|6.079023|12.006965|5.774813|0.105716|3.559697|4.926193|2.815442|16.909322|2.009613|0.056772|1.881157|1.804436|3.007373|2.382806|2.184184|1.602326|3.027825|1.463718|1.437466|1.313995|1.258561|9.429807|1.154047|1.126188|1.142703|0.030816|1.254610|1.094904|4.817618|0.304118|0.500000| |17.620807|8.844973|7.032665|30.625195|4.225171|5.464475|4.515833|8.191095|4.659819|0.084987|3.070060|4.451778|2.474639|15.534881|1.843588|0.051189|1.747545|1.677266|2.841845|2.195652|2.035216|1.487404|2.773461|1.375121|1.352012|1.248707|1.202357|8.968503|1.111061|1.087905|1.096895|0.029480|1.196780|1.055405|6.763628|0.301353|0.301353|0.500000| |2.703901|3.129544|2.868985|23.568845|4.502242|4.089180|4.738209|7.086123|9.662110|0.205711|9.000365|8.332517|17.555276|56.168682|6.532202|0.216193|4.952994|4.635534|6.630851|5.948147|4.614476|3.172133|6.187565|2.569429|2.343365|2.007804|1.941830|15.755425|1.695775|1.576322|1.590223|0.043361|1.793589|1.451094|2.347994|0.074108|0.076484|0.065792|0.500000| |2.705474|3.127949|2.863829|23.484076|4.488967|4.088490|4.754847|7.119145|9.734889|0.208685|9.001363|8.287416|17.567854|56.122887|6.588368|0.187336|6.115646|4.367421|6.618300|5.124682|4.066850|2.700789|5.015744|2.258627|2.047536|1.798953|1.774850|14.450816|1.577322|1.461829|1.454507|0.039681|1.612363|1.331695|2.343873|0.076519|0.074245|0.065801|0.302168|0.500000| |1.866163|2.113243|2.080009|17.389221|2.793779|2.472633|2.551888|4.053982|4.173989|0.084760|3.659228|4.685677|4.743726|44.800458|8.841416|0.173561|17.630618|6.985700|12.821155|6.470181|5.195194|3.074587|5.174784|2.608897|2.242073|2.007014|2.077879|17.914857|1.857783|1.662790|1.601650|0.043810|1.744967|1.436383|1.820453|0.052275|0.050519|0.047709|0.115584|0.142561|0.500000| |1.744662|1.936028|1.874979|15.217724|2.470099|2.257473|2.400451|3.901164|3.942506|0.083212|3.302131|4.057652|4.388680|35.903156|8.823909|0.213392|17.545599|6.888097|10.858591|7.122963|5.459935|3.207147|5.478480|2.662096|2.271720|2.015554|2.080218|18.077122|1.849628|1.646100|1.604009|0.044428|1.746728|1.432353|1.648983|0.048958|0.047956|0.044540|0.116841|0.134226|0.300754|0.500000| |2.033781|2.283278|2.180191|17.791518|3.006842|2.738107|2.965220|4.735354|5.066943|0.107361|4.326091|5.086534|6.099551|44.934799|8.800971|0.210657|17.575403|5.517245|8.662519|5.818237|4.536699|2.814823|4.964364|2.360957|2.072874|1.841973|1.869771|15.731843|1.671321|1.516380|1.485446|0.040822|1.623881|1.343962|1.877433|0.057632|0.055470|0.051223|0.147610|0.214666|0.300724|0.301329|0.500000| |1.826102|2.053849|2.014200|16.658020|2.673401|2.392973|2.484650|3.978131|4.042605|0.082787|3.478543|4.424091|4.455455|38.842135|7.268806|0.229924|4.801823|9.241477|10.887207|26.010509|13.008146|7.946988|15.495238|4.927884|3.959730|3.112652|3.027948|27.160842|2.470750|2.188049|2.207471|0.060770|2.566456|1.917519|1.768584|0.049432|0.051381|0.046722|0.138388|0.109643|0.116361|0.129721|0.113588|0.500000| |1.557106|1.747179|1.765525|14.717714|2.215798|1.965211|1.965175|3.168300|3.053594|0.061204|2.605621|3.535906|3.071164|28.675463|4.860224|0.122840|3.967327|7.891405|15.167512|12.994512|25.993286|9.200118|10.896282|7.217690|4.839251|3.996187|4.332772|48.327971|3.411950|2.808765|2.669912|0.072758|3.049785|2.227102|1.594927|0.042184|0.043117|0.040616|0.086273|0.079144|0.110059|0.110030|0.090936|0.188634|0.500000| |1.478654|1.630062|1.654845|13.327046|1.946337|1.776129|1.756942|2.886450|2.610473|0.052110|2.122830|2.923939|2.294516|18.509279|2.663068|0.075053|2.236972|3.127464|5.256772|5.178611|6.366481|6.912800|12.623710|8.973372|17.748870|8.561854|5.727099|37.716112|4.039902|3.803640|4.350483|0.114697|6.495258|3.513250|1.528825|0.039220|0.041822|0.039064|0.067535|0.057799|0.060219|0.061202|0.056845|0.110305|0.116913|0.500000| |1.101677|1.194998|1.220862|9.672640|1.381998|1.276292|1.261181|2.103209|1.847196|0.037145|1.479398|2.040904|1.594667|12.900293|1.930932|0.052449|1.778621|2.273743|4.208107|3.398862|4.151803|3.291154|5.076899|4.330897|4.446102|6.075400|8.948471|42.446323|17.516933|8.810227|6.551863|0.199187|5.293307|4.489958|1.154988|0.029719|0.030684|0.029482|0.045143|0.042129|0.049746|0.050239|0.045025|0.065638|0.088623|0.101074|0.500000| |1.150104|1.256902|1.295244|10.377800|1.466895|1.341178|1.312464|2.174013|1.921211|0.038334|1.553993|2.170135|1.667981|13.769641|2.027038|0.054052|1.866839|2.412193|4.584138|3.516140|4.313472|3.330185|5.039887|4.359968|4.332843|5.745882|8.895748|45.184046|17.549856|8.802426|5.485593|0.141245|4.860922|4.061315|1.227255|0.030981|0.031849|0.030821|0.046648|0.043918|0.053023|0.052101|0.047033|0.066914|0.095870|0.098053|0.303743|0.500000| |1.057538|1.144091|1.178840|9.285969|1.302868|1.206136|1.179429|1.970746|1.703571|0.034036|1.356858|1.894100|1.431645|11.451094|1.656171|0.044930|1.529351|1.896660|3.497481|2.775344|3.253951|2.597119|4.184471|3.250627|3.587489|4.902071|5.576108|27.268450|8.856355|17.541799|8.806051|0.210788|5.501345|7.010597|1.129237|0.028399|0.029424|0.028516|0.040324|0.037708|0.042968|0.042583|0.039273|0.054569|0.068967|0.087346|0.219751|0.207397|0.500000| |1.157395|1.262650|1.309967|10.436560|1.453489|1.332772|1.292640|2.144376|1.868599|0.037070|1.502112|2.118171|1.578754|12.803059|1.819476|0.049025|1.656058|2.101004|3.884604|3.072935|3.641235|2.954231|4.722962|3.791035|4.323265|6.172598|6.683796|30.867232|8.842099|17.511039|8.850813|0.174467|6.973704|6.782289|1.253117|0.030933|0.032151|0.031195|0.044335|0.041179|0.046682|0.045582|0.042395|0.060434|0.077693|0.103922|0.173981|0.219473|0.303109|0.500000| |1.279133|1.397958|1.444692|11.498949|1.613065|1.480879|1.438227|2.382245|2.079985|0.041217|1.669885|2.350173|1.747322|13.985439|1.959813|0.053802|1.733087|2.241549|3.986738|3.391930|3.998604|3.516369|5.918426|4.556292|6.329434|8.927415|6.112769|29.791192|5.290940|6.603757|8.818813|0.174647|17.492603|7.119332|1.372982|0.033907|0.035870|0.034359|0.049909|0.044865|0.047960|0.047365|0.044611|0.069084|0.081052|0.167320|0.121227|0.122844|0.138384|0.197675|0.500000| |1.238822|1.343072|1.371069|10.791288|1.540009|1.429082|1.407125|2.347401|2.043099|0.040892|1.624656|2.249154|1.716339|13.496511|1.935518|0.054069|1.711840|2.202472|3.845320|3.414079|4.017073|3.621667|6.268656|4.663005|6.752667|8.910822|5.780811|29.199267|4.856573|5.519674|8.814978|0.220522|17.531318|6.725521|1.296510|0.032950|0.034962|0.033159|0.049696|0.044268|0.046769|0.047325|0.044144|0.070499|0.079023|0.188049|0.122765|0.108221|0.123372|0.140498|0.303989|0.500000| |1.108276|1.196810|1.238475|9.690038|1.345807|1.250528|1.214231|2.031391|1.734816|0.034483|1.373565|1.930977|1.423121|11.192395|1.572139|0.043092|1.430238|1.759982|3.168111|2.589977|2.957183|2.446301|4.141833|2.963216|3.557524|4.597672|4.110223|21.397836|4.488909|6.832018|8.777331|0.173527|6.763010|17.528994|1.194681|0.029494|0.031002|0.030015|0.040340|0.037084|0.039832|0.039320|0.037182|0.052382|0.060854|0.094407|0.110213|0.108631|0.174632|0.201549|0.209342|0.161808|0.500000| |1.085159|1.164988|1.194971|9.274742|1.303568|1.220638|1.196074|2.011502|1.711740|0.034242|1.345699|1.872032|1.400589|10.871568|1.545122|0.042867|1.403527|1.720519|3.053940|2.569153|2.921077|2.451071|4.228311|2.944705|3.598472|4.530218|3.885983|20.622382|4.050024|5.468426|8.774100|0.212028|6.919807|17.541595|1.148120|0.028918|0.030528|0.029317|0.040090|0.036559|0.038713|0.038837|0.036577|0.052511|0.058981|0.098035|0.106457|0.094682|0.141749|0.139620|0.180789|0.201488|0.301516|0.500000| |1.024156|1.099418|1.130312|8.785480|1.230417|1.150420|1.125923|1.893504|1.611676|0.032240|1.269063|1.768108|1.323614|10.344065|1.478056|0.040662|1.359124|1.652745|2.978293|2.434804|2.776702|2.266051|3.820230|2.728831|3.168631|4.071541|3.878249|20.423150|4.553760|6.808175|8.776549|0.214465|5.477473|17.547017|1.089081|0.027398|0.028669|0.027711|0.037587|0.034777|0.037786|0.037726|0.035338|0.049041|0.057122|0.082806|0.121662|0.107987|0.208421|0.165350|0.142621|0.139521|0.301460|0.301688|0.500000| |4.822137|5.808612|8.869428|44.648206|4.378309|4.368567|3.321968|5.351950|3.910362|0.069944|2.908795|4.650386|2.396452|16.391177|1.890142|0.051280|1.754666|1.780820|3.071677|2.330408|2.208920|1.630108|3.006388|1.532029|1.521871|1.414658|1.356478|9.997648|1.254183|1.239961|1.242914|0.032944|1.363584|1.201374|17.547838|0.109682|0.117656|0.149410|0.063019|0.061570|0.048890|0.044454|0.049928|0.049113|0.044603|0.043947|0.032846|0.034955|0.032357|0.036085|0.039830|0.037405|0.034629|0.033185|0.031372|0.500000| |4.821399|5.808086|8.869442|44.654979|4.378416|4.368407|3.321875|5.351751|3.910425|0.069945|2.908879|4.650517|2.396230|16.406198|1.892201|0.050806|1.794231|1.765743|3.073798|2.271985|2.141343|1.555385|2.838434|1.459229|1.432804|1.337199|1.297262|9.649337|1.205503|1.183536|1.176253|0.031273|1.280278|1.132396|17.547904|0.117645|0.109666|0.149375|0.061663|0.062860|0.050493|0.045257|0.051502|0.047393|0.043568|0.040939|0.031664|0.033810|0.031000|0.034378|0.037177|0.034956|0.032551|0.031134|0.029719|0.301925|0.500000| 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