Version2.1 2020-12-19T00:48:25Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 31-Oct-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC[C@@H](C(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCC2)n3c(nnc3SCC(=O)OCC)N C40174436 RHF 6-31G(d) (6D,7F) CC[C@@H](C(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCC2)n3c(nnc3SCC(=O)OCC)N C01[X(C20H28N6O5S2)] 177 C1 559 CCOC(=O)CSc1nnc(n1[C@H](C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCC1)CC)N CCOC(=O)CSc1nnc(n1[C@H](C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCC1)CC)N CCOC(=O)CSc1nnc(N)n1[C@@H](CC)C(=O)Nc2ccc(cc2)[S](=O)(=O)N3CCCC3 InChIKey=JRWFVTHKVNYVSF-INIZCTEOSA-N InChI=1S/C20H28N6O5S2/c1-3-16(26-19(21)23-24-20(26)32-13-17(27)31-4-2)18(28)22-14-7-9-15(10-8-14)33(29,30)25-11-5-6-12-25/h7-10,16H,3-6,11-13H2,1-2H3,(H2,21,23)(H,22,28)/t16-/m0/s1 InChI=1/C20H28N6O5S2/c1-3-16(26-19(21)23-24-20(26)32-13-17(27)31-4-2)18(28)22-14-7-9-15(10-8-14)33(29,30)25-11-5-6-12-25/h7-10,16H,3-6,11-13H2,1-2H3,(H2,21,23)(H,22,28)/t16-/m0/s1/f/h22H,21H2 CC[C@@H](C(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCC2)n3c(nnc3SCC(=O)OCC)N C01[X(C20H28N6O5S2)] 177 C01 559 CCOC(=O)CSc1nnc(n1[C@H](C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCC1)CC)N CCOC(=O)CSC1=[N][N][C](N1[C@H](C(=O)N[C]1[CH][CH][C]([CH][CH]1)S(=O)(=O)N1CCCC1)CC)N CCOC(=O)CSC1=N[N][C](N)N1[C@@H](CC)C(=O)N[C]2[CH][CH][C]([CH][CH]2)[S](=O)(=O)N3CCCC3 InChIKey=JRWFVTHKVNYVSF-INIZCTEOSA-N InChI=1S/C20H28N6O5S2/c1-3-16(26-19(21)23-24-20(26)32-13-17(27)31-4-2)18(28)22-14-7-9-15(10-8-14)33(29,30)25-11-5-6-12-25/h7-10,16H,3-6,11-13H2,1-2H3,(H2,21,23)(H,22,28)/t16-/m0/s1 InChI=1/C20H28N6O5S2/c1-3-16(26-19(21)23-24-20(26)32-13-17(27)31-4-2)18(28)22-14-7-9-15(10-8-14)33(29,30)25-11-5-6-12-25/h7-10,16H,3-6,11-13H2,1-2H3,(H2,21,23)(H,22,28)/t16-/m0/s1/f/h22H,21H2 3749.2143482602 -2269.6407809 1-A 27480.5105 131 428 559 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1862.55 1863.08 1869.23 1887.12 1899.14 1903.71 1935.21 1950.02 1982.81 1985.91 2001.15 2008.60 2048.89 2052.11 2091.45 2099.01 2104.39 2118.42 2132.03 2148.14 2168.57 2176.94 2206.99 2224.28 2231.35 2234.70 2255.66 2270.17 2281.86 2301.92 2332.85 2344.68 2353.33 2354.04 2363.37 2365.11 2370.29 2374.35 2405.36 2408.59 2416.21 2426.68 2474.70 2485.84 2560.41 2586.47 2598.06 2655.71 2814.35 2888.32 4586.35 4616.21 4626.53 4630.08 4636.18 4651.39 4667.17 4695.49 4704.13 4710.21 4724.97 4728.10 4729.33 4729.68 4731.11 4736.11 4746.11 4777.21 4788.93 4791.89 4805.61 4835.47 4903.29 4914.00 4993.56 5416.12 5566.02 5568.61 0.530451 0.562383 0.563327 0.459000 -2269.110330 -2269.078398 -2269.077454 -2269.181781 3.499145D-04 MUNgauss RevisionA2.0 retrievium 19-Dec-2020 DUDE CC[C@@H](C(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCC2)n3c(nnc3SCC(=O)OCC)N C40174436 RHF 6-31G(d) (6D,10F) C1 496.156262 |X|Y|Z| 75.609729 37.971997 142.554419 74.246149 20 6 7 16 14 5 1 |36.858105| |12.474991|36.858105| |7.469603|12.421278|36.858105| |6.939964|8.973312|17.632817|0.500000| |4.879889|7.525644|12.423876|0.246128|36.858105| |4.338479|6.504657|8.001632|0.163654|15.861952|73.516695| |3.942684|5.325099|7.831500|0.213825|14.061332|14.945953|53.358707| |3.078193|3.922314|5.006097|0.136713|7.639214|11.565819|18.415575|36.858105| |2.682029|3.227235|3.994795|0.116114|5.168445|7.897320|10.883286|13.675194|36.858105| |2.260122|2.655977|3.130474|0.089269|3.899472|6.403185|7.081736|7.912331|13.814142|36.858105| |2.134388|2.525235|2.899230|0.079917|3.677310|6.425833|6.202089|6.865034|7.963590|13.729811|36.858105| |2.316986|2.817081|3.222961|0.085755|4.316261|7.987852|6.985789|7.954427|6.901775|7.938041|13.745661|36.858105| |2.779070|3.530393|4.191202|0.108611|6.274465|11.688948|10.506162|13.694075|7.910527|6.840029|7.910018|13.766230|36.858105| |1.783775|2.052227|2.284262|0.063101|2.748198|4.884375|4.356194|4.189772|4.731463|6.943553|10.750440|6.944284|4.717339|388.023441| |1.705921|1.961247|2.163265|0.058717|2.601171|4.766197|3.965693|3.696931|3.856366|4.993587|7.378101|6.449250|4.410077|94.733130|73.516695| |1.684967|1.906250|2.134938|0.059922|2.498947|4.342260|3.988085|3.697124|4.440116|6.519538|7.387165|4.971759|3.834821|94.708613|13.555370|73.516695| |1.717405|1.965419|2.130388|0.059108|2.521713|4.488364|3.931592|3.632826|4.004441|5.342892|6.974094|5.432037|4.032947|83.567404|13.813739|13.822451|53.358707| |1.704029|1.957521|2.076902|0.056868|2.460075|4.485881|3.715368|3.345205|3.445151|4.195857|5.435799|5.065382|3.874304|50.087153|11.592266|8.860276|17.715441|36.858105| |1.591355|1.800900|1.881863|0.052049|2.170749|3.910480|3.252670|2.817007|2.939097|3.453816|4.034004|3.731525|3.101375|34.788635|7.850877|7.201169|11.183414|12.481548|36.858105| |1.658273|1.870960|1.969064|0.055343|2.256944|3.968211|3.461743|3.002453|3.264769|3.879111|4.240970|3.705596|3.155176|34.762169|7.094688|7.710317|11.010654|7.957286|12.436443|36.858105| |1.690059|1.912084|2.061694|0.058209|2.386933|4.153457|3.755438|3.368210|3.861653|5.006621|5.481564|4.289896|3.496255|50.179840|8.848984|11.609233|17.645423|7.793314|7.870808|12.410946|36.858105| |6.280092|7.579909|13.058011|0.259772|7.837177|11.262295|7.863671|4.171985|3.475525|2.815853|2.630543|2.897217|3.631270|15.074820|3.624930|3.566002|2.648530|1.887836|1.707294|1.770236|1.869500|53.358707| |5.230904|5.973345|7.419012|0.157511|5.950815|10.284823|6.091389|3.551431|2.973313|2.508568|2.416228|2.697965|3.304596|14.150741|3.477538|3.329768|2.481513|1.787943|1.612570|1.646643|1.731335|18.911480|36.858105| |4.215351|4.394246|5.281186|0.126360|4.456813|7.629885|5.039246|3.074539|2.682584|2.306016|2.211497|2.417419|2.862621|13.200836|3.254422|3.151432|2.301923|1.646712|1.491391|1.523183|1.610325|11.868588|14.876901|53.358707| |4.135622|4.171876|5.309342|0.138760|4.323806|6.906973|5.198188|3.131342|2.817231|2.390927|2.233821|2.382488|2.802714|13.296801|3.228424|3.223259|2.312303|1.632125|1.485429|1.535371|1.635580|11.877307|8.893588|18.856830|53.358707| |4.980290|5.188879|7.512765|0.204845|5.487392|8.065471|6.556682|3.693719|3.282894|2.689313|2.463796|2.625208|3.166914|14.345490|3.430850|3.467827|2.502754|1.759505|1.600999|1.670950|1.781625|18.855355|8.874491|12.126195|20.387834|36.858105| |4.293075|4.326251|5.936432|0.202905|4.657378|6.619139|6.403275|3.672706|3.504192|2.831092|2.490000|2.549630|3.005989|14.529944|3.393433|3.589373|2.546014|1.759960|1.618660|1.722050|1.850550|9.415254|4.942516|6.709322|9.532260|10.809942|388.023441| |3.200090|3.148762|3.926117|0.120498|3.386820|5.181506|4.677571|2.930951|2.887398|2.456623|2.189921|2.210435|2.506898|13.200088|3.116571|3.317232|2.295713|1.580302|1.457997|1.541245|1.665183|6.436535|4.016416|6.104324|9.000854|7.069917|74.758920|36.858105| |2.733211|2.680976|3.221723|0.100805|2.878274|4.436817|4.125540|2.677076|2.749322|2.382187|2.094268|2.063355|2.286674|12.825486|2.995264|3.281094|2.243202|1.530199|1.425481|1.521522|1.650086|4.867311|3.082606|4.507726|5.909493|4.680261|49.852554|12.619219|36.858105| |2.730081|2.688867|3.210862|0.103574|2.887566|4.397132|4.250931|2.766004|2.908381|2.505339|2.164320|2.105042|2.325687|13.225018|3.047446|3.403251|2.331067|1.581380|1.482197|1.599834|1.736468|4.602407|2.854888|4.021445|5.063097|4.200760|46.884271|7.946483|16.033859|73.516695| |2.354409|2.301031|2.689424|0.081503|2.452865|3.883918|3.477604|2.318061|2.383141|2.122624|1.894727|1.863035|2.030474|11.839908|2.789967|3.046906|2.070076|1.414294|1.321043|1.401733|1.519148|4.086038|2.710088|4.048726|5.133256|3.797757|34.670386|8.202519|14.473971|15.264541|73.516695| |2.062638|2.017076|2.306846|0.069924|2.140788|3.419264|3.069564|2.090207|2.188450|1.986996|1.771665|1.719642|1.844080|11.256517|2.641068|2.930012|1.981615|1.348851|1.270562|1.354275|1.467901|3.391307|2.266080|3.314158|4.010141|2.999968|26.738897|5.191741|8.107210|12.680570|23.692995|36.858105| |1.831875|1.789682|2.015391|0.059807|1.888383|3.071719|2.673253|1.843004|1.913843|1.767170|1.602031|1.561024|1.658427|10.329806|2.449831|2.688508|1.819168|1.243934|1.173058|1.240512|1.340737|2.984914|2.051999|3.037406|3.587354|2.595041|21.589770|4.083973|5.279706|8.172739|14.283552|12.589357|36.858105| |4.964633|5.962313|6.209172|0.129981|5.598512|11.167814|5.559583|3.371020|2.772939|2.388834|2.365462|2.705046|3.307698|13.972493|3.482436|3.236766|2.474886|1.815091|1.633800|1.647296|1.711649|10.731501|13.851215|10.965743|7.446099|5.474580|26.458772|3.116391|2.528014|4.245294|4.030459|1.948579|1.787972|53.358707| |17.539200|8.753200|6.813354|0.207454|4.519713|6.860521|5.310259|3.043424|2.725370|2.283165|2.118194|2.256198|2.679872|12.605053|2.981391|3.007801|2.327375|1.680745|1.579791|1.664721|1.702009|7.757887|4.511522|5.223569|5.463329|4.974859|33.870257|3.436195|2.986107|5.406272|4.493799|2.219455|1.942596|5.544815|0.500000| |17.583528|8.772554|6.680522|0.167040|4.466854|7.244613|4.914252|2.865410|2.510769|2.135191|2.025393|2.197316|2.614057|12.127864|2.923370|2.876500|2.214732|1.610681|1.499095|1.552979|1.592119|9.327687|6.147353|6.853106|6.564819|5.564709|31.411300|3.404076|2.825276|4.888453|4.366101|2.122192|1.899406|7.647051|0.301193|0.500000| |17.567808|8.846566|5.470892|0.142494|4.070715|6.753182|4.595049|2.743927|2.412789|2.073692|1.980891|2.150468|2.536955|11.941557|2.867098|2.812637|2.226824|1.639157|1.543475|1.601671|1.613572|6.413462|4.244740|4.811965|4.631892|3.897182|24.630002|2.721326|2.385034|4.254890|3.720926|1.863769|1.673365|5.854411|0.301783|0.302308|0.500000| |8.845295|17.524414|8.990583|0.219072|7.048115|10.826918|7.393768|4.080744|3.368410|2.771087|2.630724|2.927480|3.661985|15.152298|3.583905|3.498314|2.823765|2.077901|1.924766|2.014098|2.035599|7.613922|4.544140|4.838669|4.702959|4.226619|27.351263|2.842486|2.502903|4.557276|3.828054|1.919660|1.700381|6.279253|0.209560|0.172843|0.214415|0.500000| |8.841012|17.651294|8.836220|0.175125|6.923891|12.619084|6.477306|3.700310|3.002543|2.528571|2.467113|2.810282|3.512324|14.379861|3.491665|3.305865|2.633990|1.951713|1.785305|1.827052|1.858556|9.203212|6.282514|6.086597|5.394707|4.618080|26.242814|2.844459|2.421048|4.260282|3.768966|1.864881|1.678637|10.039507|0.172676|0.211260|0.212459|0.303971|0.500000| |4.012723|5.110120|7.665085|0.251846|9.505733|10.889533|26.049828|9.366631|7.720920|4.955402|4.101036|4.301510|5.749394|21.212231|4.758523|5.018971|3.690357|2.524117|2.253923|2.439535|2.658342|7.853936|4.265281|4.960830|5.386061|5.185579|40.241733|3.888593|3.468296|6.508353|5.049035|2.496193|2.130752|5.080021|0.115451|0.101793|0.094075|0.144279|0.121010|0.500000| |2.750437|3.229316|4.048718|0.124103|4.849051|7.108753|10.046772|8.886000|17.704400|8.962023|5.660854|4.966057|5.630321|27.821424|5.757188|6.920355|4.670010|2.968564|2.629796|2.965329|3.458836|4.814460|2.950135|3.669929|3.969962|3.458335|28.007499|3.194371|3.110157|6.009997|4.695371|2.430372|2.083991|3.653714|0.079482|0.071429|0.068151|0.093286|0.081432|0.237691|0.500000| |2.071996|2.376481|2.764590|0.080054|3.284127|5.378694|5.745144|5.635902|8.938126|17.757908|8.914343|5.649052|4.938452|47.087395|8.199647|13.361384|7.124336|3.928355|3.369201|3.909328|5.301901|3.438786|2.259429|2.873819|3.012682|2.468134|18.915949|2.363040|2.348545|4.437245|3.750499|2.007080|1.784780|2.910882|0.058722|0.054589|0.053062|0.068710|0.062586|0.117187|0.216139|0.500000| |2.150322|2.588313|2.878094|0.075632|3.743326|7.230351|5.651190|5.659493|4.970065|5.651153|8.931414|17.751242|8.955399|47.164668|13.091794|8.143563|7.338425|5.496483|3.872163|3.611777|4.044799|3.581731|2.517068|3.086806|2.995475|2.380794|16.185777|2.006645|1.871505|3.369595|3.039085|1.583227|1.452470|3.510241|0.057655|0.057008|0.056085|0.074359|0.073126|0.098272|0.107803|0.124299|0.500000| |2.940060|3.828797|4.423956|0.109062|6.845036|15.117123|9.512757|8.898516|5.636720|4.944279|5.645357|8.938760|17.837656|27.791819|6.872087|5.729636|4.724228|3.496047|2.848664|2.827458|3.023911|5.222989|3.603035|4.143504|3.925128|3.223726|20.822895|2.440970|2.191244|3.916621|3.475698|1.765354|1.598664|5.124324|0.076824|0.077071|0.074915|0.109055|0.110052|0.143106|0.123893|0.107441|0.216173|0.500000| |1.860737|2.169820|2.292375|0.062265|2.766259|5.102389|4.163619|3.790895|3.752043|4.418735|5.831206|5.972138|4.564109|44.547705|10.446185|7.863364|12.230383|17.502838|8.792679|6.758842|6.353058|2.796076|1.940588|2.403485|2.367641|1.887344|13.308836|1.657207|1.590478|2.919714|2.596339|1.383133|1.270744|2.703220|0.050690|0.048559|0.049731|0.064519|0.060336|0.077119|0.088106|0.109577|0.182795|0.115105|0.500000| |1.615645|1.848041|1.957660|0.053187|2.308847|4.266713|3.426756|3.044778|3.082486|3.694770|4.810981|4.672694|3.581143|46.153237|12.890365|8.270652|12.363323|17.659958|8.676012|5.693555|5.771016|2.455975|1.730728|2.181393|2.148655|1.684815|11.864049|1.513989|1.461209|2.664849|2.416939|1.295826|1.203080|2.404451|0.044044|0.042740|0.043231|0.053932|0.051634|0.064515|0.074257|0.096352|0.149936|0.092011|0.300427|0.500000| |1.590375|1.798489|1.851334|0.050969|2.123883|3.857210|3.129854|2.657792|2.703373|3.060949|3.521500|3.418179|2.937901|28.301196|6.657267|5.931569|7.916990|8.729461|17.584268|8.675920|5.638075|2.276639|1.585782|1.988489|1.969508|1.558255|11.131301|1.405205|1.368767|2.526242|2.254922|1.218006|1.126077|2.205511|0.043687|0.041497|0.043167|0.053680|0.049775|0.060049|0.067650|0.081780|0.099598|0.076756|0.218151|0.194941|0.500000| |1.464438|1.641184|1.715997|0.047501|1.957572|3.525575|2.914851|2.495128|2.619401|3.077221|3.545546|3.253034|2.722793|32.009015|7.481283|6.956454|9.518716|8.866619|17.560616|8.802599|6.757401|2.144580|1.496940|1.899911|1.894370|1.489344|10.716668|1.373635|1.348673|2.487286|2.237160|1.215984|1.128722|2.060147|0.040425|0.038552|0.039487|0.048328|0.045256|0.056521|0.065951|0.085189|0.094443|0.069966|0.174266|0.219291|0.301218|0.500000| |1.794081|2.038458|2.131326|0.060052|2.451407|4.288927|3.773237|3.257075|3.498368|4.014988|4.287823|3.859490|3.389645|31.662803|6.515476|6.930805|8.966004|6.826491|8.835317|17.550471|8.816695|2.566502|1.740239|2.172291|2.188861|1.764923|12.949811|1.606842|1.580741|2.966010|2.570080|1.391171|1.267469|2.373973|0.050080|0.046257|0.048212|0.061770|0.055049|0.073688|0.088210|0.109332|0.102428|0.084415|0.189522|0.137888|0.217861|0.174040|0.500000| |1.550388|1.726735|1.806218|0.051047|2.032627|3.556166|3.092094|2.616076|2.853639|3.312122|3.488524|3.076812|2.696082|28.370790|5.961638|6.702618|7.965169|5.674424|8.671037|17.588613|8.718349|2.223159|1.521224|1.926963|1.949173|1.553245|11.456176|1.452889|1.445384|2.709197|2.377811|1.301504|1.195122|2.065827|0.043431|0.040395|0.041758|0.051538|0.046721|0.061321|0.073904|0.095013|0.083350|0.067968|0.137009|0.125856|0.195885|0.216298|0.302150|0.500000| |1.561222|1.745130|1.881771|0.053289|2.144845|3.725332|3.345060|2.936371|3.381890|4.315635|4.568938|3.618938|3.008890|43.824901|8.111748|11.779560|12.378054|6.015147|6.387267|8.695012|17.618259|2.353299|1.608624|2.056472|2.096658|1.665964|12.365250|1.588033|1.587000|2.968081|2.618065|1.434292|1.316383|2.155653|0.043797|0.041098|0.041436|0.051196|0.047117|0.066554|0.086433|0.133009|0.096001|0.073285|0.135159|0.138450|0.132117|0.176325|0.175141|0.220224|0.500000| |1.813819|2.058499|2.244991|0.064155|2.604795|4.442740|4.209525|3.820575|4.618334|6.148707|6.062246|4.526655|3.791900|47.173244|8.066942|11.592045|12.203104|5.988670|5.757551|8.728356|17.581275|2.745211|1.842008|2.325915|2.383446|1.927553|14.446136|1.809343|1.800738|3.399389|2.921604|1.586808|1.435867|2.454391|0.051109|0.047246|0.047797|0.061135|0.054954|0.083798|0.115642|0.188757|0.112235|0.088926|0.153535|0.129046|0.127719|0.137322|0.225341|0.191120|0.302105|0.500000| |2.941068|2.984629|3.758303|0.110889|3.395268|5.283897|4.704339|3.013006|2.961323|2.541086|2.279953|2.305697|2.603931|13.739723|3.267383|3.457104|2.356007|1.616663|1.479146|1.554234|1.691738|6.299258|4.104308|6.434969|9.408644|6.737735|56.265894|17.632020|8.926202|10.991010|13.016866|4.809346|3.999538|4.328399|0.085224|0.087056|0.070123|0.074830|0.076595|0.106049|0.089580|0.067686|0.058238|0.070376|0.046988|0.043254|0.039459|0.038799|0.044752|0.040559|0.044892|0.050869|0.500000| |3.221060|3.055569|3.654897|0.109365|3.088919|4.831865|4.128447|2.597746|2.524067|2.179829|1.976946|2.012992|2.273485|12.062322|2.873547|3.015744|2.115701|1.469983|1.362343|1.431781|1.532835|6.123553|4.002359|6.335480|9.438451|6.622760|56.262080|17.640489|8.922669|10.932349|13.120865|4.825053|4.020836|4.235405|0.095530|0.098009|0.076575|0.075742|0.077465|0.093023|0.076164|0.058200|0.051369|0.062396|0.042829|0.039271|0.036662|0.035732|0.041454|0.037608|0.040662|0.045926|0.304139|0.500000| |2.089983|2.015173|2.273299|0.069560|2.084403|3.320469|2.978692|2.015033|2.105879|1.907629|1.700835|1.652888|1.775814|10.815970|2.530672|2.806251|1.923916|1.314427|1.245979|1.332415|1.434337|3.295800|2.187178|3.163170|3.800109|2.884310|26.052774|4.753364|7.269310|12.821783|16.518530|17.623063|8.806756|2.574562|0.063220|0.059442|0.052675|0.053537|0.051429|0.067567|0.065162|0.053528|0.042297|0.047320|0.037493|0.034974|0.033283|0.033085|0.038159|0.035685|0.038887|0.043117|0.116530|0.126400|0.500000| |2.003164|1.990282|2.292745|0.069750|2.167215|3.451911|3.167153|2.186645|2.334470|2.131197|1.879347|1.801174|1.917453|11.959364|2.784690|3.146878|2.095765|1.413920|1.331127|1.426414|1.558800|3.318303|2.202457|3.176549|3.799899|2.891145|25.987694|4.755973|7.268790|12.816246|16.517560|17.622696|8.807405|2.593754|0.059786|0.056625|0.050325|0.053083|0.051088|0.071880|0.072747|0.060485|0.045837|0.050461|0.040122|0.037649|0.035273|0.035417|0.040592|0.038095|0.042454|0.047017|0.126492|0.116883|0.302227|0.500000| |1.687451|1.650219|1.839564|0.054579|1.736552|2.836495|2.468508|1.718020|1.796527|1.675809|1.521192|1.473752|1.552983|9.906431|2.345577|2.591856|1.753651|1.197976|1.135815|1.203345|1.299081|2.683689|1.847444|2.701850|3.132687|2.286632|18.908465|3.378086|4.277594|7.079533|10.208282|8.906044|17.558545|2.219204|0.049726|0.048258|0.043160|0.043910|0.043068|0.054500|0.054279|0.047365|0.038186|0.041494|0.033862|0.032183|0.030275|0.030450|0.034070|0.032349|0.035596|0.038587|0.091665|0.091997|0.211485|0.211504|0.500000| |1.788341|1.767121|2.003109|0.058853|1.900075|3.108703|2.691952|1.871363|1.942701|1.803907|1.641757|1.599503|1.692873|10.610797|2.528044|2.767583|1.853338|1.264731|1.186745|1.250046|1.357489|2.990320|2.076771|3.097235|3.640068|2.596730|21.085319|4.015180|4.906753|7.440001|12.877650|8.854035|17.577996|2.463851|0.052159|0.051628|0.045337|0.046527|0.046355|0.059164|0.058355|0.050584|0.041413|0.045308|0.035827|0.034099|0.031573|0.031774|0.035351|0.033375|0.037077|0.040281|0.115194|0.108310|0.172954|0.211144|0.300689|0.500000| 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