Version2.4 2021-06-10T19:08:03Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 18-Apr-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE C[C@H]([C@@H](c1cccs1)N2CCN(CC2)c3ccc(cc3)OC)NC(=O)C(=O)NCCN4CCOCC4 C20289338 RHF 6-31G(d) (6D,7F) C[C@H]([C@@H](c1cccs1)N2CCN(CC2)c3ccc(cc3)OC)NC(=O)C(=O)NCCN4CCOCC4 C01[X(C26H37N5O4S1)] 213 C1 618 COc1ccc(cc1)N1CCN(CC1)[C@H](c1cccs1)[C@H](NC(=O)C(=O)NCCN1CCOCC1)C COc1ccc(cc1)N1CCN(CC1)[C@H](c1cccs1)[C@H](NC(=O)C(=O)NCCN1CCOCC1)C COc1ccc(cc1)N2CCN(CC2)[C@@H]([C@@H](C)NC(=O)C(=O)NCCN3CCOCC3)c4sccc4 InChIKey=PQQADWUYJRVAPL-YKSBVNFPSA-N InChI=1S/C26H37N5O4S/c1-20(28-26(33)25(32)27-9-10-29-15-17-35-18-16-29)24(23-4-3-19-36-23)31-13-11-30(12-14-31)21-5-7-22(34-2)8-6-21/h3-8,19-20,24H,9-18H2,1-2H3,(H,27,32)(H,28,33)/t20-,24+/m1/s1 InChI=1/C26H37N5O4S/c1-20(28-26(33)25(32)27-9-10-29-15-17-35-18-16-29)24(23-4-3-19-36-23)31-13-11-30(12-14-31)21-5-7-22(34-2)8-6-21/h3-8,19-20,24H,9-18H2,1-2H3,(H,27,32)(H,28,33)/t20-,24+/m1/s1/f/h27-28H C[C@H]([C@@H](c1cccs1)N2CCN(CC2)c3ccc(cc3)OC)NC(=O)C(=O)NCCN4CCOCC4 C01[X(C26H37N5O4S1)] 213 C01 618 COc1ccc(cc1)N1CCN(CC1)[C@H](c1cccs1)[C@H](NC(=O)C(=O)NCCN1CCOCC1)C CO[C]1[CH][CH][C]([CH][CH]1)[N@@]1CCN(CC1)[C@@H]([C@H]([NH][C](=O)[C]([NH]CCN1CCOCC1)=O)C)C1=[CH][CH]=CS1 CO[C]1[CH][CH][C]([CH][CH]1)N2CCN(CC2)[C@@H]([C@@H](C)NC(=O)C(=O)NCCN3CCOCC3)c4sccc4 InChIKey=PQQADWUYJRVAPL-YKSBVNFPSA-N InChI=1S/C26H37N5O4S/c1-20(28-26(33)25(32)27-9-10-29-15-17-35-18-16-29)24(23-4-3-19-36-23)31-13-11-30(12-14-31)21-5-7-22(34-2)8-6-21/h3-8,19-20,24H,9-18H2,1-2H3,(H,27,32)(H,28,33)/t20-,24+/m1/s1 InChI=1/C26H37N5O4S/c1-20(28-26(33)25(32)27-9-10-29-15-17-35-18-16-29)24(23-4-3-19-36-23)31-13-11-30(12-14-31)21-5-7-22(34-2)8-6-21/h3-8,19-20,24H,9-18H2,1-2H3,(H,27,32)(H,28,33)/t20-,24+/m1/s1/f/h27-28H 3893.1629795556 -1975.2890368 1-A 40195.9469 138 480 618 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1 12.00000 12.00000 1.00783 12.00000 1.00783 12.00000 12.00000 12.00000 12.00000 31.97207 14.00307 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 14.00307 12.00000 15.99491 12.00000 15.99491 14.00307 12.00000 12.00000 14.00307 12.00000 12.00000 15.99491 12.00000 12.00000 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 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 8391.4185 66853.7345 70749.3917 1.00000 0.00263 0.00117 -0.00263 0.99999 0.00318 -0.00116 -0.00318 0.99999 1 0.01032 0.00130 0.00122 0.21507 0.02700 0.02551 11.24 12.10 19.59 28.97 34.10 38.61 44.36 58.76 76.09 84.24 94.48 102.96 118.02 128.47 140.36 161.39 189.37 197.59 223.61 242.69 279.36 303.76 318.15 346.44 363.37 378.33 390.03 397.62 409.34 419.95 426.61 437.43 485.08 496.74 532.06 536.39 576.28 597.98 620.06 650.17 661.82 670.79 675.76 681.70 711.20 739.46 763.46 769.02 780.61 792.02 846.74 854.93 873.87 890.01 897.67 947.00 959.97 971.72 996.45 1008.80 1030.54 1039.59 1110.03 1146.84 1163.75 1165.28 1167.35 1175.29 1266.82 1270.58 1272.52 1309.18 1321.65 1328.51 1333.48 1355.51 1362.22 1367.74 1370.66 1403.39 1405.51 1436.03 1449.28 1479.59 1486.95 1509.99 1519.33 1537.66 1574.47 1593.92 1607.39 1610.56 1627.26 1631.75 1642.70 1655.60 1667.97 1679.48 1707.55 1710.94 1730.71 1732.34 1741.26 1742.96 1746.35 1795.08 1813.01 1819.39 1826.18 1826.79 1844.14 1854.75 1862.75 1864.48 1866.20 1876.37 1912.96 1915.33 1935.81 1941.94 1947.30 1949.86 1967.25 1981.37 2002.28 2046.44 2051.21 2052.49 2065.33 2073.84 2081.23 2096.98 2100.86 2108.75 2122.41 2135.60 2146.03 2150.26 2169.57 2172.03 2179.03 2201.98 2222.72 2224.70 2234.79 2253.62 2262.86 2270.38 2276.72 2278.99 2294.28 2295.27 2346.98 2352.11 2357.58 2359.65 2360.21 2362.54 2368.01 2371.57 2373.06 2374.86 2377.52 2385.94 2389.82 2390.57 2397.31 2400.67 2441.01 2470.11 2534.98 2552.43 2557.98 2628.49 2781.84 2825.60 4501.81 4511.08 4513.53 4514.35 4524.65 4529.77 4541.17 4545.73 4585.10 4598.44 4610.42 4639.31 4659.38 4677.83 4691.10 4695.91 4697.62 4704.88 4709.72 4724.15 4729.77 4730.98 4748.03 4754.69 4757.62 4782.57 4790.31 4806.49 4850.79 4865.90 4875.07 4882.69 4896.85 4898.78 4948.80 5543.25 5564.53 0.670397 0.703368 0.704312 0.597426 -1974.618640 -1974.585669 -1974.584725 -1974.691611 3.584974D-04 MUNgauss RevisionA2.1 retrievium 10-Jun-2021 DUDE C[C@H]([C@@H](c1cccs1)N2CCN(CC2)c3ccc(cc3)OC)NC(=O)C(=O)NCCN4CCOCC4 C20289338 RHF 6-31G(d) (6D,10F) C1 515.256627 |X|Y|Z| 59.085883 187.760239 38.090655 75.041574 31 6 7 8 16 24 5 1 1 |36.858105| |12.464414|36.858105| |8.900041|17.688883|0.500000| |7.302516|12.249839|0.247029|36.858105| |5.467170|9.004454|0.221214|17.437215|0.500000| |6.066044|7.493660|0.153555|12.559722|0.251576|36.858105| |4.569183|5.549888|0.122398|7.428156|0.198667|14.123490|36.858105| |3.816300|4.145740|0.094904|5.014131|0.130356|8.170435|13.259831|36.858105| |3.985627|4.011048|0.091740|4.790481|0.116635|7.662995|8.251246|14.182150|36.858105| |5.444004|5.243524|0.115639|6.662897|0.142708|10.943467|7.475214|7.459778|11.035000|388.023441| |6.100048|7.551245|0.192355|13.025653|0.251219|7.799310|5.211983|4.063530|4.180958|43.515922|53.358707| |4.206112|5.003627|0.131551|7.903413|0.203656|6.499444|4.937574|3.989630|4.048475|38.369560|17.741940|36.858105| |3.512882|3.826880|0.104133|5.069670|0.130326|4.489599|3.635622|3.190108|3.366543|30.991442|10.556261|12.538252|36.858105| |3.388887|3.676398|0.105997|4.473932|0.117735|3.712586|3.064634|2.676906|2.781273|25.009826|9.038041|7.852509|13.151479|53.358707| |4.169267|4.407880|0.131531|5.017948|0.125490|3.907515|3.122928|2.693271|2.815248|26.200644|10.578356|6.773933|7.990252|17.843377|36.858105| 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|3.941811|4.613591|0.115141|3.955672|0.114265|4.015041|4.451661|3.787808|3.237098|22.655676|4.145088|2.687980|2.231211|2.886818|2.282811|2.780909|1.832042|1.718609|1.529642|1.444403|1.507442|1.691034|2.331698|1.236183|9.662628|7.958224|9.793477|15.828886|73.516695| |3.303699|3.935084|0.110272|3.344212|0.100597|3.096161|3.233086|2.750627|2.442452|17.813791|3.706664|2.428114|2.059196|2.761996|2.193722|2.655679|1.771463|1.704837|1.521224|1.416121|1.451609|1.612107|2.297744|1.207638|7.295571|7.955002|12.660879|14.309834|14.976778|53.358707| |2.703327|3.075703|0.084979|2.725498|0.081027|2.619578|2.793659|2.475997|2.200558|15.601881|3.109138|2.086906|1.802151|2.407097|1.884521|2.216927|1.568225|1.514760|1.367823|1.282231|1.312500|1.443436|2.097439|1.108913|5.366294|5.030625|8.223270|7.786990|11.901685|17.888237|36.858105| 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|1.632222|1.788446|0.049407|1.721483|0.051034|1.711976|1.852545|1.745409|1.570511|10.755347|2.088048|1.483035|1.329234|1.769842|1.334684|1.490041|1.190902|1.165177|1.077951|1.021560|1.037845|1.116405|1.701141|0.908420|2.788089|2.287306|3.957659|2.719353|4.810571|4.238530|3.935238|5.079708|10.659476|12.533205|36.858105| |1.612653|1.749899|0.047772|1.689353|0.049667|1.707500|1.864340|1.784417|1.603231|10.827862|2.044926|1.453258|1.303125|1.722384|1.297497|1.445261|1.159422|1.127846|1.044725|0.995373|1.015939|1.093202|1.657928|0.888914|2.733702|2.201514|3.737908|2.636924|4.821044|3.974896|3.669790|4.536453|9.200478|7.912122|13.616411|73.516695| |1.746117|1.883743|0.051063|1.794411|0.052376|1.822994|1.994034|1.912224|1.716494|11.564279|2.151558|1.512602|1.350279|1.780879|1.351545|1.514396|1.193624|1.155807|1.067655|1.018172|1.042671|1.125787|1.691740|0.907437|2.988546|2.409061|4.022064|2.972798|5.551429|4.472762|4.311306|5.076241|10.651074|6.799350|8.203417|24.199132|36.858105| |2.012019|2.209087|0.059568|2.093170|0.061645|2.125439|2.352931|2.218746|1.958628|13.190488|2.461548|1.719279|1.512751|1.987951|1.513868|1.720899|1.318789|1.271522|1.165459|1.107551|1.137115|1.236771|1.829423|0.977952|3.603988|2.957260|4.842985|3.845976|7.275327|5.860621|6.063545|7.852857|17.812862|7.993046|6.803967|14.071818|12.535534|36.858105| |17.592420|8.774175|0.205894|6.789502|0.139581|5.595159|4.118828|3.538294|3.836657|39.450896|9.341218|4.558863|3.965822|5.260492|4.991760|6.386699|3.138077|2.746379|2.342206|2.218307|2.403768|2.859724|3.434329|1.800996|7.656633|4.289116|7.114565|3.346418|5.763723|3.838913|2.360187|2.129910|2.524338|1.681273|1.503254|2.637962|1.592605|1.812974|0.500000| |17.593328|8.770165|0.174015|6.424478|0.136393|6.467127|4.989496|4.353586|4.684530|45.192550|7.136804|3.885797|3.262610|4.142059|3.569811|4.452713|2.538554|2.255823|1.966326|1.882603|2.033080|2.366232|2.965467|1.574963|9.734033|4.905482|7.349670|3.999659|7.290910|4.345135|2.674344|2.375383|2.804524|1.832608|1.634806|2.903124|1.779966|2.051206|0.302548|0.500000| |17.564548|8.865429|0.220948|5.410991|0.124362|4.587862|3.753782|3.226224|3.317714|29.818287|6.425423|3.477787|3.011519|4.082279|3.690279|4.676303|2.526235|2.311011|2.011667|1.892335|2.000705|2.302849|2.990071|1.570562|9.488223|5.421666|8.766734|4.123447|6.927471|4.654038|2.788014|2.409875|2.828190|1.844707|1.642969|2.876686|1.760311|2.020873|0.300409|0.301761|0.500000| |4.100120|5.252015|0.121220|6.653258|0.207491|8.925907|17.733537|8.594873|5.740856|37.746164|6.340754|4.499150|3.336932|3.942539|2.936204|3.640862|2.395698|2.152132|1.871140|1.778273|1.905442|2.209499|2.809768|1.488354|8.131725|4.934208|7.213643|4.619039|8.929451|4.964676|3.128530|3.126519|3.559833|2.379843|2.038166|3.626800|2.175316|2.613653|0.101446|0.119424|0.097254|0.500000| |3.206373|3.468431|0.081985|4.013482|0.108852|5.704870|8.581919|17.747450|8.910559|37.699295|4.552618|3.348167|2.762321|3.212382|2.354453|2.691941|2.042709|1.823293|1.629829|1.593941|1.731690|1.972282|2.552911|1.382094|5.059956|3.163021|4.810652|3.179739|6.503102|3.614846|2.454169|2.456565|2.989583|2.017597|1.801435|3.309823|1.993895|2.309128|0.082615|0.100123|0.077865|0.201818|0.500000| |3.420810|3.333121|0.078447|3.814176|0.094570|5.395930|5.690806|8.774171|17.783736|55.346929|4.752613|3.432331|3.005792|3.420544|2.528546|2.775055|2.199585|1.914407|1.720814|1.718402|1.912232|2.192610|2.741807|1.503099|4.417839|2.689104|4.207359|2.568921|5.043320|2.972285|2.002105|1.941896|2.397133|1.624189|1.478636|2.699142|1.623664|1.828915|0.093066|0.111077|0.081463|0.122638|0.203497|0.500000| |3.746637|4.666753|0.128370|6.999973|0.215791|5.554784|4.622430|3.668959|3.544775|30.896087|12.280834|17.434710|8.895715|9.653034|5.937021|7.207414|4.810850|4.019832|3.154036|2.865537|3.110503|3.945275|4.251875|2.158644|5.231566|3.426450|6.083460|2.827655|4.800435|3.422799|2.155402|2.132516|2.511595|1.756502|1.543815|2.669616|1.552242|1.769275|0.108629|0.095461|0.088888|0.125290|0.088129|0.084255|0.500000| |3.990022|4.636726|0.116073|7.350096|0.188341|7.602800|5.889273|4.833364|4.932922|45.938159|12.424625|17.639202|8.946793|7.734344|5.022551|5.743750|4.186201|3.359222|2.767037|2.649857|2.998273|3.811642|3.977949|2.082152|5.225731|3.232938|5.437878|2.749236|4.864661|3.248140|2.075631|2.041775|2.431604|1.685618|1.495224|2.625290|1.539265|1.751271|0.117058|0.107671|0.091161|0.141848|0.109915|0.113407|0.301524|0.500000| |2.967234|3.240929|0.088285|4.196785|0.113096|3.910012|3.351531|3.010723|3.135538|27.053671|7.659571|8.911836|17.580344|12.517980|5.738238|5.008791|7.230211|5.044490|3.983053|3.858492|4.612867|6.573786|5.450101|2.788704|3.715758|2.449902|4.331772|2.118803|3.681371|2.614753|1.702090|1.682639|2.042016|1.440222|1.295078|2.258286|1.308234|1.458864|0.090475|0.078043|0.072010|0.086848|0.073927|0.079008|0.217108|0.215700|0.500000| |3.596502|3.701832|0.098189|4.743035|0.116092|4.466605|3.567830|3.245856|3.582368|34.249213|9.548518|8.935355|17.450246|12.221343|7.067372|5.850493|6.697687|4.527630|3.645815|3.626799|4.483886|6.593297|5.165536|2.695505|4.056129|2.582247|4.496678|2.205261|3.859856|2.678998|1.733175|1.680505|2.038654|1.418922|1.279890|2.243658|1.313374|1.466233|0.115965|0.094664|0.084987|0.088409|0.077478|0.090217|0.174486|0.218715|0.300555|0.500000| |3.707827|3.893857|0.120805|4.149524|0.107796|3.282296|2.716969|2.364967|2.444588|21.902117|7.681072|5.044837|5.737442|12.475066|17.596552|8.930591|7.345764|6.794612|4.790541|3.971987|4.067651|5.138566|5.632368|2.703679|4.148020|2.816584|5.331207|2.298605|3.812665|2.887779|1.827943|1.736361|2.087765|1.452056|1.304260|2.242989|1.310659|1.461131|0.120037|0.087950|0.095353|0.072322|0.058365|0.061694|0.133052|0.110166|0.128086|0.143346|0.500000| |4.343175|4.232691|0.121329|4.665926|0.111821|3.840899|3.041248|2.690909|2.896231|27.647495|9.482897|5.852344|7.083009|12.283809|17.435253|8.884020|6.825969|5.175625|4.003662|3.709593|4.184417|5.638686|5.289028|2.661034|4.360910|2.814451|5.085444|2.315261|3.935475|2.839738|1.806035|1.707955|2.061018|1.422595|1.282620|2.229638|1.311846|1.463890|0.153019|0.104633|0.106207|0.077757|0.065068|0.073097|0.134988|0.130400|0.143784|0.208278|0.301443|0.500000| |6.776420|7.502051|0.255901|6.992699|0.163142|4.701072|3.621039|2.987840|3.059738|29.015335|12.383084|5.734407|5.020019|7.722955|9.023050|17.640764|4.219161|3.755729|3.004346|2.693983|2.843988|3.475470|4.058522|2.052761|6.618797|4.204489|7.853588|3.151739|5.142823|3.788157|2.300310|2.123587|2.493737|1.693597|1.500951|2.588113|1.535675|1.745346|0.226396|0.140094|0.164104|0.095239|0.071667|0.074533|0.145015|0.127439|0.109925|0.131372|0.217386|0.220802|0.500000| |4.642126|5.950939|0.200341|6.871358|0.194779|4.537248|3.669642|2.952649|2.908305|26.089388|12.236877|7.131761|5.827089|9.461754|8.872849|17.434471|4.776092|4.360598|3.326593|2.875147|2.980265|3.675627|4.280949|2.126258|5.998595|4.060559|7.863185|3.092589|4.988206|3.796653|2.311121|2.200095|2.565061|1.770438|1.554200|2.657010|1.556637|1.774136|0.137615|0.106559|0.114425|0.100782|0.071782|0.070498|0.214020|0.144686|0.130606|0.133790|0.218482|0.173940|0.301353|0.500000| |2.546129|2.747880|0.082895|3.027828|0.084367|2.563562|2.255017|2.004418|2.032845|17.060076|5.103259|4.003433|4.811847|9.938845|6.168839|4.654591|8.922070|17.718274|8.967611|5.644219|4.966968|5.683645|7.608752|3.333684|3.180510|2.240974|4.253912|1.912216|3.189932|2.465396|1.599201|1.560718|1.900428|1.349906|1.219013|2.086357|1.201135|1.325125|0.077435|0.063614|0.066431|0.061512|0.050778|0.052124|0.116441|0.092072|0.127529|0.113599|0.205946|0.136667|0.111499|0.137696|0.500000| |1.972382|2.053597|0.060479|2.208871|0.060996|1.972516|1.780374|1.636299|1.674515|13.638951|3.545543|2.767575|3.307194|5.689419|3.712018|2.981243|5.611985|8.915972|17.732906|8.947034|5.672153|4.972994|13.473638|4.872181|2.457092|1.741702|3.262372|1.534706|2.593508|2.000591|1.326702|1.300273|1.612053|1.153415|1.056525|1.814686|1.040176|1.131689|0.059553|0.050564|0.052311|0.048431|0.042127|0.043923|0.078165|0.068119|0.092587|0.084886|0.115883|0.094679|0.076016|0.084328|0.214804|0.500000| |2.016747|2.017399|0.056432|2.238588|0.059382|2.127527|1.904668|1.820956|1.942694|15.915163|3.665821|2.960074|3.874596|5.633819|3.503479|2.782348|5.638381|4.970111|5.640753|8.887767|17.756504|8.944848|12.455446|7.436756|2.399366|1.636645|2.942382|1.461623|2.541931|1.860655|1.243840|1.217421|1.519102|1.078386|0.994004|1.735917|1.002352|1.089351|0.062244|0.053495|0.052088|0.050024|0.046581|0.052189|0.077047|0.076944|0.112773|0.112719|0.094417|0.100995|0.070601|0.072543|0.107823|0.124257|0.500000| |2.634289|2.649770|0.072987|3.081772|0.079620|2.910872|2.505683|2.359392|2.559945|22.132717|5.429298|4.592335|7.175651|9.494790|5.299687|3.963631|8.919219|5.663349|4.973632|5.665287|8.967212|17.737346|7.458515|3.921327|3.044200|2.021325|3.595387|1.769388|3.083073|2.209286|1.455285|1.418174|1.747430|1.229771|1.122382|1.963225|1.140564|1.254451|0.083370|0.069503|0.065818|0.064408|0.058807|0.067441|0.111343|0.116545|0.199782|0.232046|0.127529|0.157497|0.095857|0.098323|0.124409|0.107899|0.218860|0.500000| |1.633496|1.649257|0.046474|1.798633|0.048712|1.715651|1.575890|1.513600|1.586519|12.571512|2.828761|2.263808|2.751261|4.005185|2.574393|2.160114|3.726049|3.799610|4.764183|7.043013|6.731970|4.571180|16.444537|17.552868|2.010935|1.398040|2.529613|1.267187|2.200170|1.635866|1.105679|1.090039|1.372038|0.982635|0.911521|1.588391|0.911047|0.982021|0.049285|0.043494|0.042875|0.042072|0.039378|0.042864|0.061147|0.059571|0.081242|0.076801|0.071810|0.071841|0.055693|0.058224|0.088347|0.120002|0.223893|0.113322|0.500000| |1.699440|1.686692|0.047678|1.809625|0.048415|1.714952|1.559015|1.496080|1.580686|12.691445|2.859976|2.221034|2.690818|4.004969|2.688253|2.217704|3.726379|3.796904|4.764623|7.046504|6.728651|4.574498|16.444371|17.552861|2.041100|1.415057|2.564049|1.276777|2.213379|1.646378|1.109851|1.084638|1.364476|0.972024|0.902512|1.573257|0.906198|0.976750|0.051805|0.045067|0.044890|0.041417|0.038737|0.042749|0.059153|0.057983|0.076335|0.076723|0.076149|0.077023|0.058155|0.058905|0.088171|0.119898|0.223505|0.113468|0.299024|0.500000| |1.522638|1.530563|0.043502|1.636889|0.044428|1.548704|1.426135|1.365776|1.424551|11.262086|2.543688|1.985289|2.343733|3.490892|2.335276|1.977894|3.170823|3.414156|4.412496|5.880349|4.902072|3.613244|17.004987|17.641339|1.875702|1.315695|2.396894|1.194975|2.065907|1.553968|1.052831|1.034891|1.306544|0.936578|0.871507|1.515005|0.868332|0.932532|0.045777|0.040373|0.040460|0.038291|0.035646|0.038475|0.054025|0.051944|0.067421|0.065077|0.066928|0.065099|0.051868|0.053683|0.082153|0.121204|0.145564|0.089167|0.299986|0.299980|0.500000| |6.903594|8.932734|0.180802|6.702833|0.173695|6.789045|6.658120|5.024483|4.420557|34.226542|6.137321|3.656715|2.898810|3.677898|2.994361|3.859048|2.254248|2.058972|1.796670|1.695892|1.796741|2.064773|2.693447|1.422602|25.993662|9.592796|10.888048|7.846670|15.147645|6.937152|3.953474|3.442993|3.828394|2.420555|2.081510|3.684651|2.290800|2.780305|0.141416|0.205890|0.169083|0.186210|0.120281|0.101228|0.097848|0.103272|0.072188|0.079105|0.075615|0.081392|0.113270|0.103370|0.059395|0.046875|0.047065|0.059502|0.039537|0.040034|0.036766|0.500000| |3.271444|3.944901|0.115898|3.330395|0.101186|2.973814|3.024861|2.556115|2.300715|17.131202|3.758462|2.454824|2.092487|2.851251|2.278619|2.768078|1.828881|1.776492|1.581039|1.460136|1.486818|1.649672|2.367640|1.237609|6.939953|7.849979|15.222074|9.600206|10.907725|26.025426|8.918710|6.361739|6.057198|3.653953|2.921887|4.771051|2.937084|3.684773|0.078538|0.085385|0.095008|0.093982|0.067930|0.057216|0.071323|0.065928|0.054111|0.055133|0.061913|0.059620|0.080984|0.082187|0.052905|0.042607|0.038707|0.045793|0.034108|0.034371|0.032525|0.127276|0.500000| |2.493350|2.781669|0.078296|2.454385|0.072343|2.333589|2.441685|2.186595|1.978010|14.164861|2.863694|1.923672|1.684938|2.274799|1.786360|2.077705|1.494775|1.455330|1.321052|1.236766|1.259156|1.376428|2.031729|1.073738|4.667681|4.312285|7.469853|5.856526|8.945845|12.542337|17.599074|8.879751|9.616068|4.934853|3.962846|6.377726|4.159771|5.344306|0.061165|0.067905|0.072521|0.074610|0.060019|0.050431|0.055162|0.052749|0.044248|0.045059|0.048615|0.047609|0.060247|0.060251|0.042760|0.035769|0.033153|0.038381|0.029654|0.029850|0.028404|0.093805|0.222767|0.500000| |2.724832|3.019146|0.081447|2.666780|0.077702|2.630336|2.829992|2.560043|2.277589|15.914753|3.035497|2.031598|1.759112|2.330862|1.826294|2.137046|1.521435|1.460189|1.322219|1.247618|1.283462|1.411172|2.042779|1.085077|5.306065|4.697759|7.319318|7.416391|13.357075|12.632573|17.651627|8.788529|9.450535|4.575560|3.743414|6.567620|4.592804|6.569536|0.065695|0.076524|0.078148|0.086822|0.071027|0.057870|0.057544|0.056664|0.046110|0.047437|0.048937|0.049114|0.061789|0.060930|0.042517|0.035518|0.033931|0.039747|0.030083|0.030258|0.028605|0.113172|0.180894|0.302721|0.500000| |2.507475|2.927650|0.079197|2.787215|0.085579|2.765180|3.111465|2.754511|2.355086|16.132829|3.157076|2.193494|1.870105|2.451178|1.869266|2.191271|1.592518|1.529696|1.379474|1.296876|1.332946|1.469478|2.118085|1.121740|5.008323|4.372159|7.022810|6.124614|10.768226|9.612702|8.841645|17.449939|12.234916|6.572044|4.480830|7.537564|4.693103|7.327954|0.061806|0.069774|0.068851|0.101729|0.078050|0.059190|0.063894|0.061743|0.049789|0.049553|0.049775|0.049398|0.061224|0.063947|0.044720|0.037051|0.035137|0.041305|0.031304|0.031032|0.029538|0.105256|0.158495|0.173826|0.209505|0.500000| |2.326098|2.708944|0.076265|2.542131|0.078287|2.421522|2.608283|2.299217|2.025598|14.304486|2.959547|2.053497|1.777454|2.381082|1.823933|2.124107|1.558949|1.521024|1.375602|1.282546|1.303656|1.427887|2.102474|1.107635|4.461930|4.057686|7.153561|5.165485|8.045215|9.618307|8.938089|17.561214|12.538481|7.670077|4.850163|7.239221|4.240134|5.731202|0.058030|0.063134|0.065043|0.083084|0.063925|0.051250|0.060447|0.056603|0.047335|0.046775|0.049375|0.047825|0.059686|0.063015|0.044903|0.037266|0.034223|0.039714|0.030772|0.030556|0.029277|0.089191|0.184964|0.215651|0.174072|0.302642|0.500000| 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|1.692884|1.808768|0.048646|1.732773|0.050215|1.782900|1.959602|1.909507|1.717431|11.439259|2.083283|1.468636|1.314865|1.725525|1.306485|1.457244|1.158936|1.118401|1.035303|0.991628|1.018501|1.098686|1.649335|0.887686|2.852802|2.255039|3.732469|2.751174|5.256704|4.001681|3.696856|4.172699|7.681412|5.059873|5.890858|16.912815|17.605996|8.846340|0.042999|0.048345|0.047234|0.058910|0.055813|0.045451|0.041638|0.041755|0.035444|0.035689|0.035089|0.035384|0.040996|0.041349|0.032147|0.027970|0.027282|0.031022|0.024792|0.024655|0.023594|0.061374|0.072967|0.097764|0.112458|0.112739|0.098092|0.131821|0.110679|0.132297|0.147633|0.500000| 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