Version2.1 2021-01-08T10:08:29Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 09-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1,RFO) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1c(c(on1)C)C(=O)N2C[C@H](C3(C2)CC[NH2+]CC3)C(=O)N[C@@H](C(C)C)C(=O)NC(C)(C)C C39685895 RHF 6-31G(d) (6D,7F) Cc1c(c(on1)C)C(=O)N2C[C@H](C3(C2)CC[NH2+]CC3)C(=O)N[C@@H](C(C)C)C(=O)NC(C)(C)C C01[X(C24H40N5O4)] 213 C1 575 CC([C@@H](C(=O)NC(C)(C)C)NC(=O)[C@@H]1CN(CC21CC[NH2+]CC2)C(=O)c1c(C)noc1C)C CC([C@@H](C(=O)NC(C)(C)C)NC(=O)[C@@H]1CN(CC21CC[NH2+]CC2)C(=O)c1c(C)noc1C)C CC(C)[C@H](NC(=O)[C@@H]1CN(CC12CC[NH2+]CC2)C(=O)c3c(C)onc3C)C(=O)NC(C)(C)C InChIKey=WTDBEUMGSLRVHW-HKUYNNGSSA-O InChI=1S/C24H39N5O4/c1-14(2)19(21(31)27-23(5,6)7)26-20(30)17-12-29(13-24(17)8-10-25-11-9-24)22(32)18-15(3)28-33-16(18)4/h14,17,19,25H,8-13H2,1-7H3,(H,26,30)(H,27,31)/p+1/t17-,19-/m0/s1 InChI=1/C24H39N5O4/c1-14(2)19(21(31)27-23(5,6)7)26-20(30)17-12-29(13-24(17)8-10-25-11-9-24)22(32)18-15(3)28-33-16(18)4/h14,17,19,25H,8-13H2,1-7H3,(H,26,30)(H,27,31)/p+1/t17-,19-/m0/s1/fC24H40N5O4/h25-27H/q+1 Cc1c(c(on1)C)C(=O)N2C[C@H](C3(C2)CC[NH2+]CC3)C(=O)N[C@@H](C(C)C)C(=O)NC(C)(C)C C01[X(C24H40N5O4)] 213 C01 575 CC([C@@H](C(=O)NC(C)(C)C)NC(=O)[C@@H]1CN(CC21CC[NH2+]CC2)C(=O)c1c(C)noc1C)C CC([C@@H](C(=O)NC(C)(C)C)NC(=O)[C@@H]1CN(CC21CC[NH2]CC2)C(=O)[C]1[C](C)ON=[C]1C)C C[C]1ON=C(C)[C]1C(=O)N2C[C@@H](C(=O)N[C@@H](C(C)C)C(=O)NC(C)(C)C)C3(CC[NH2]CC3)C2 InChIKey=SOKAYRANTRCZCM-HKUYNNGSSA-N InChI=1S/C24H40N5O4/c1-14(2)19(21(31)27-23(5,6)7)26-20(30)17-12-29(13-24(17)8-10-25-11-9-24)22(32)18-15(3)28-33-16(18)4/h14,17,19H,8-13,25H2,1-7H3,(H,26,30)(H,27,31)/t17-,19-/m0/s1 InChI=1/C24H40N5O4/c1-14(2)19(21(31)27-23(5,6)7)26-20(30)17-12-29(13-24(17)8-10-25-11-9-24)22(32)18-15(3)28-33-16(18)4/h14,17,19H,8-13,25H2,1-7H3,(H,26,30)(H,27,31)/t17-,19-/m0/s1/f/h26-27H 3742.3376934430 -1503.6421248 1-A 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533.06 542.00 553.84 557.58 560.95 596.81 623.66 637.41 648.09 660.45 671.91 706.16 722.36 731.95 741.21 753.41 797.68 814.33 824.37 861.27 909.42 922.94 976.37 1010.85 1031.09 1068.67 1090.70 1123.33 1160.51 1189.80 1199.52 1230.75 1239.87 1260.98 1275.83 1281.90 1324.85 1349.13 1363.42 1439.61 1447.85 1454.33 1459.79 1470.20 1473.36 1484.47 1496.87 1504.63 1509.86 1514.17 1525.48 1552.67 1568.54 1571.77 1604.56 1615.68 1626.91 1636.73 1644.36 1666.67 1669.20 1673.65 1687.00 1690.44 1696.57 1699.73 1736.68 1771.34 1783.44 1816.18 1837.73 1862.10 1889.76 1899.48 1903.43 1929.35 1951.88 1971.31 1981.77 1999.08 2018.20 2030.28 2042.01 2059.61 2071.86 2084.20 2087.26 2089.26 2096.41 2129.83 2150.34 2162.21 2178.47 2192.79 2208.57 2217.56 2221.00 2227.63 2236.87 2237.18 2241.32 2242.01 2249.42 2256.23 2259.40 2274.53 2278.36 2280.33 2294.43 2324.07 2332.94 2335.02 2339.50 2343.15 2345.20 2346.27 2355.61 2356.70 2358.27 2360.74 2362.46 2363.31 2375.42 2376.41 2379.66 2382.06 2388.68 2400.80 2403.92 2469.86 2480.97 2485.28 2616.23 2627.50 2748.55 2757.93 2770.40 4607.22 4609.30 4620.28 4621.76 4629.78 4630.57 4632.39 4635.77 4647.32 4649.05 4652.39 4659.20 4696.64 4697.70 4700.07 4707.11 4711.49 4712.69 4713.13 4718.16 4724.43 4731.76 4736.97 4737.27 4739.68 4740.13 4740.36 4762.25 4766.95 4774.57 4785.44 4798.43 4801.94 4803.13 4822.91 4829.49 5272.47 5369.35 5570.40 5620.20 0.689921 0.723094 0.724038 0.622056 -1502.952204 -1502.919031 -1502.918087 -1503.020069 3.420493D-04 MUNgauss RevisionA2.0 retrievium 08-Jan-2021 DUDE Cc1c(c(on1)C)C(=O)N2C[C@H](C3(C2)CC[NH2+]CC3)C(=O)N[C@@H](C(C)C)C(=O)NC(C)(C)C C39685895 RHF 6-31G(d) (6D,10F) C1 462.308030 |X|Y|Z| 112.292840 67.057654 35.449318 64.387679 16 6 7 8 12 3 1 |36.858105| |12.708560|36.858105| |7.140428|13.203004|36.858105| |5.189725|8.679353|14.019606|36.858105| |5.355359|8.959739|8.754695|14.559353|73.516695| |7.933810|14.883818|8.510995|8.652849|24.703231|53.358707| 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|2.636068|2.613057|2.571782|2.403963|4.199610|3.363939|2.206206|2.532871|4.012718|3.803528|3.548530|3.656495|0.097177|2.886319|2.575104|2.558379|2.160530|2.930751|0.053833|0.062117|2.307695|2.818908|4.616691|7.379612|8.576164|7.507898|0.196406|12.440781|36.858105| |2.927582|2.690930|2.558757|2.292535|4.012500|3.353714|2.044793|2.564015|4.003142|4.046829|3.788473|3.627886|0.089392|3.002876|2.777876|2.514315|2.176232|3.039508|0.056055|0.063254|2.520797|3.096610|4.366044|6.614805|8.566285|7.401614|0.151758|12.419190|7.529043|36.858105| |2.493130|2.372155|2.418823|2.156041|3.602480|2.894248|1.993728|2.612968|4.228619|4.240590|3.871169|4.395390|0.103360|3.891952|3.220816|3.235635|2.807297|4.176118|0.075088|0.090706|3.541209|4.582120|6.196200|10.443090|10.646941|12.362476|0.247358|7.423454|4.868962|6.133045|36.858105| |2.676865|2.497650|2.547246|2.225281|3.691160|2.992769|2.037732|2.810877|4.528741|4.716059|4.261201|4.733971|0.106462|4.429359|3.696627|3.492410|3.066623|4.670219|0.083389|0.099244|4.216915|5.640281|6.138559|9.798409|9.715786|7.957517|0.169549|5.578649|4.004991|5.413454|15.766505|73.516695| |2.127227|2.037792|2.073539|1.884298|3.174328|2.530663|1.767892|2.217001|3.653724|3.489933|3.049730|3.423801|0.084295|3.148904|2.662019|2.761972|2.476330|3.719611|0.068411|0.081891|3.055420|3.677541|4.522580|8.261480|7.130962|7.838256|0.201857|6.151584|4.304374|5.021919|14.212127|15.006924|53.358707| |1.912931|1.820600|1.848790|1.685142|2.844897|2.268088|1.589323|1.984331|3.312884|3.100536|2.607536|2.872420|0.071318|2.782948|2.410110|2.482162|2.313263|3.562280|0.066973|0.078257|2.936313|3.333197|3.530722|6.497809|5.243137|4.931394|0.130257|4.269937|3.258389|3.882794|7.552536|11.598345|17.548131|36.858105| |1.868606|1.790841|1.847567|1.680458|2.803888|2.217809|1.598655|2.022989|3.426672|3.166867|2.599618|2.937291|0.072817|2.992199|2.545619|2.711024|2.594887|4.167955|0.078681|0.093435|3.438490|3.761538|3.529088|6.723998|4.877818|4.217976|0.114796|3.472596|2.795289|3.189134|6.120416|10.796514|10.496824|12.426813|36.858105| |1.687902|1.623002|1.646090|1.524155|2.591107|2.051246|1.451944|1.744738|2.936971|2.664540|2.212236|2.423221|0.061900|2.333823|2.045978|2.148914|2.018322|3.056429|0.058281|0.067356|2.430581|2.687818|2.927197|5.483063|4.300779|4.001145|0.112090|3.715953|2.999885|3.311426|5.130158|7.768971|10.788413|12.439473|7.604321|36.858105| |1.946873|1.815088|1.811952|1.641234|2.795195|2.258156|1.530736|1.930016|3.199683|3.030398|2.528098|2.664977|0.065699|2.596821|2.337630|2.273777|2.138369|3.271127|0.062158|0.069886|2.761694|3.089936|3.134691|5.499160|4.762708|4.246058|0.106081|3.975584|3.027214|4.006591|6.139459|10.801802|10.498980|12.431190|7.549024|7.603294|36.858105| |17.584636|8.867741|6.159601|4.562518|8.148550|8.444160|3.402330|5.313785|7.112268|8.318433|6.703578|4.364725|0.110736|3.720098|4.394510|2.996534|2.565463|3.282974|0.060767|0.063608|2.726631|3.235516|3.668474|5.309551|5.337643|3.144909|0.077326|3.089612|3.035231|3.506384|2.867221|5.500832|3.264434|2.127226|2.055462|1.856219|2.172684|0.500000| |17.623596|9.004715|5.452882|4.471993|8.860330|10.425053|3.315616|4.342594|6.228806|5.951970|4.299747|3.202479|0.085235|2.877126|3.388478|2.462858|2.182341|2.779444|0.052497|0.053811|2.251239|2.544892|2.770149|4.209671|3.951153|2.459446|0.062150|2.468080|2.481360|2.761723|2.274958|4.295045|2.684794|1.786908|1.732339|1.592926|1.832955|0.301498|0.500000| |17.590884|8.917026|6.482643|4.673350|8.114266|8.205119|3.486499|5.811482|7.989137|8.393709|5.299298|3.756388|0.097348|3.540928|4.580484|2.934101|2.609399|3.292747|0.061886|0.062402|2.720438|3.065025|3.067487|4.624378|4.210734|2.560652|0.064555|2.460005|2.400902|2.711518|2.425936|4.716822|2.825616|1.892623|1.872728|1.661874|1.935498|0.302042|0.300106|0.500000| |3.388931|4.556754|5.842885|9.023787|12.489890|6.570620|17.570813|4.878185|9.265638|4.925908|3.205849|2.973617|0.093005|2.793448|3.065492|2.859430|2.529451|2.916514|0.055506|0.056749|2.112200|2.281977|2.488216|4.109517|3.143238|1.978371|0.054138|1.868696|1.967777|1.850333|1.802711|3.285489|2.196641|1.466595|1.478581|1.346135|1.420284|0.084862|0.086364|0.090390|0.500000| |3.347421|4.524511|5.733273|8.999100|12.895065|6.623004|17.580197|4.695467|8.297081|4.967048|3.477763|3.303230|0.107595|2.925614|3.044983|2.993792|2.543925|2.953208|0.055453|0.058537|2.135838|2.372567|2.811680|4.637295|3.554848|2.220307|0.061407|2.102294|2.274559|2.042537|1.967110|3.523680|2.389268|1.569966|1.568462|1.445474|1.504826|0.087442|0.084988|0.085740|0.301845|0.500000| |3.473832|4.611964|6.751982|8.954292|10.316472|5.990309|17.669816|6.505422|13.284475|6.193850|3.975552|3.855829|0.128063|3.589709|3.842198|3.808780|3.203632|3.547750|0.066190|0.069008|2.528152|2.781415|3.087346|5.102174|3.742116|2.297661|0.063330|2.109132|2.210639|2.050588|2.075946|3.787405|2.499406|1.651677|1.679050|1.503232|1.578828|0.090512|0.084854|0.093172|0.301143|0.298195|0.500000| |6.203924|6.736217|7.259519|5.331428|8.268401|6.926697|4.159291|7.232972|9.111717|12.270772|17.663550|8.691688|0.222028|5.605491|5.819674|4.315582|3.313305|4.089147|0.072794|0.080559|3.317227|4.290394|6.220967|8.135706|8.363990|4.228389|0.105486|3.800049|3.827982|3.871878|3.563746|6.663452|3.901742|2.433947|2.378748|2.105849|2.362716|0.212087|0.133117|0.148942|0.095984|0.108756|0.117134|0.500000| |5.608757|4.990306|5.057573|3.825916|6.113837|5.237352|3.162503|5.777340|7.884578|12.500168|17.549657|8.691702|0.174349|6.631447|7.167360|4.424894|3.534251|4.621729|0.081562|0.089629|4.084708|5.615273|6.566417|8.364484|9.181687|4.640862|0.109121|3.999402|3.625271|4.315589|4.276445|8.766725|4.475080|2.817816|2.775038|2.344611|2.800667|0.203301|0.122487|0.151640|0.076990|0.081839|0.090902|0.300990|0.500000| |4.148486|3.877467|4.320997|3.360301|5.160185|4.194320|2.957680|5.922914|9.410841|12.591774|6.984400|6.219335|0.139111|8.717021|17.548768|5.607408|5.042717|6.555512|0.115172|0.114285|6.411726|7.512233|4.558428|6.910102|5.457979|3.217965|0.081405|2.741066|2.501723|2.839490|3.294399|6.972130|3.699296|2.501420|2.647697|2.096439|2.480166|0.122998|0.094499|0.130563|0.074763|0.073670|0.089072|0.141504|0.201412|0.500000| |3.766471|3.897708|4.829946|3.833834|5.569996|4.286937|3.526737|7.629345|14.802106|12.483213|5.879855|5.808371|0.149369|8.548865|17.690982|7.214206|6.593423|7.026346|0.124106|0.118803|5.644988|5.914506|4.086352|6.532455|4.672413|2.790200|0.073501|2.395886|2.273133|2.402552|2.759583|5.519005|3.197357|2.162649|2.303595|1.866586|2.095960|0.104997|0.086656|0.116375|0.089053|0.085002|0.111966|0.129645|0.143573|0.301841|0.500000| |2.985639|3.309394|4.238483|3.777693|5.385119|3.884923|3.870617|5.863524|12.052195|7.991572|5.158203|6.828618|0.223535|8.791101|6.971045|17.583185|9.019923|7.634527|0.127175|0.143710|4.901549|5.513719|4.913488|8.636640|5.066412|3.026442|0.084310|2.518591|2.465551|2.373604|2.861161|5.396372|3.358139|2.215488|2.370694|1.949270|2.051357|0.085028|0.071110|0.084600|0.093444|0.097554|0.132688|0.123926|0.116825|0.141560|0.205381|0.500000| |2.607115|2.778084|3.309374|2.990836|4.502210|3.323824|3.012727|4.144496|7.633439|6.203815|4.653017|7.072679|0.211097|8.845061|5.453505|17.553676|8.882053|9.335048|0.143742|0.204998|5.636959|6.777131|6.185921|12.765212|5.860113|3.589296|0.103432|2.829874|2.709533|2.568311|3.441992|6.389530|4.037918|2.630000|2.883398|2.292752|2.347212|0.076613|0.063259|0.072884|0.073735|0.079689|0.097103|0.111686|0.111813|0.124242|0.143031|0.302378|0.500000| |2.588646|2.691541|3.197484|2.825341|4.244454|3.175136|2.818730|4.237955|8.694236|6.181500|3.814358|4.407914|0.119491|6.606870|6.443324|8.732385|17.628386|12.439772|0.224026|0.181154|6.976680|5.691312|3.576606|6.359766|3.990465|2.525921|0.069067|2.136614|2.022065|2.073618|2.568687|5.039580|3.087200|2.137823|2.372079|1.869114|2.017482|0.072923|0.062841|0.076881|0.072728|0.070761|0.090715|0.090101|0.096935|0.153178|0.226333|0.215131|0.172877|0.500000| |2.233023|2.357616|2.781496|2.563057|3.889419|2.858704|2.649921|3.479191|6.998057|4.918287|3.301581|4.055177|0.115802|5.435526|4.541291|8.771229|17.626841|12.353316|0.223000|0.223497|5.581038|4.892225|3.541505|6.768920|3.877693|2.516686|0.071121|2.109284|2.018351|1.988286|2.534214|4.806064|3.110566|2.147312|2.406803|1.909539|1.971408|0.063418|0.055073|0.064414|0.068023|0.068532|0.085771|0.080870|0.083304|0.109398|0.139661|0.211575|0.216121|0.301434|0.500000| |2.681395|2.600125|2.886542|2.469539|3.861570|3.025951|2.334051|3.654909|6.593543|6.061944|3.996457|4.411850|0.106281|6.719695|6.684921|5.775291|7.013714|12.430356|0.222505|0.181164|17.617340|8.692757|3.803121|6.528886|4.427414|2.846148|0.074961|2.378004|2.146948|2.371588|3.102149|6.538354|3.663605|2.601621|2.963981|2.182752|2.516357|0.078110|0.065233|0.080974|0.060286|0.059589|0.071343|0.090713|0.112314|0.210516|0.183392|0.130284|0.132116|0.212093|0.143903|0.500000| |2.319400|2.242222|2.435461|2.134559|3.402818|2.665929|2.035260|2.931583|5.184518|4.773341|3.464123|4.006380|0.096286|5.455745|4.633078|4.874859|5.580892|12.352283|0.223529|0.222960|17.628114|8.782407|3.880156|7.030210|4.567211|3.094738|0.082296|2.524874|2.222317|2.469091|3.587277|7.672311|4.328580|3.174195|3.879045|2.599884|2.992066|0.068799|0.057491|0.068105|0.052465|0.053178|0.061535|0.080832|0.099523|0.140006|0.120140|0.107760|0.126409|0.143838|0.126412|0.301047|0.500000| |2.657863|2.623431|2.895000|2.517193|3.969241|3.094146|2.383244|3.493895|5.927655|5.912186|4.851491|6.792596|0.149736|8.779100|5.458473|6.805863|5.730784|9.593704|0.146680|0.214132|8.955903|17.612800|7.483385|14.200683|7.537168|4.787431|0.127963|3.487473|3.018534|3.222880|5.395204|11.401772|5.876219|3.830742|4.443112|3.047633|3.374607|0.081403|0.064778|0.075201|0.059563|0.063156|0.072442|0.109818|0.135144|0.147986|0.127174|0.138896|0.198421|0.132479|0.129206|0.173157|0.216122|0.500000| |3.143099|2.954682|3.173535|2.650685|4.210107|3.386210|2.416633|3.872731|6.308511|7.148745|5.768445|6.623649|0.136439|8.718916|6.933815|5.492751|4.850639|7.636279|0.126874|0.145796|8.959907|17.592604|6.197042|9.571235|7.280855|4.426733|0.109175|3.441514|2.929053|3.451197|5.069204|12.215648|5.348220|3.574207|3.934467|2.804262|3.442205|0.098075|0.075394|0.091347|0.060791|0.062975|0.072258|0.122582|0.180922|0.224670|0.147642|0.122902|0.139040|0.126803|0.107366|0.209193|0.213518|0.306267|0.500000| |3.821833|3.611205|3.628177|3.072607|5.094061|4.213750|2.686726|3.844492|5.749904|6.630797|7.611814|7.386666|0.159011|5.093645|4.421553|3.831121|3.064803|4.169675|0.073738|0.085812|3.542361|4.909320|9.503774|10.958687|26.106114|9.172545|0.181740|7.124365|5.804407|7.099171|6.768199|12.281413|6.331326|3.589970|3.321693|2.935915|3.441649|0.132045|0.092435|0.098652|0.065495|0.073055|0.076750|0.199979|0.249187|0.121025|0.098768|0.098635|0.107255|0.079966|0.075033|0.091069|0.091094|0.138706|0.152786|0.500000| |2.309518|2.220156|2.193413|2.021408|3.496375|2.816263|1.869532|2.233285|3.597271|3.432880|3.106403|3.269598|0.083370|2.762949|2.440944|2.428835|2.116220|2.990388|0.055267|0.064044|2.401586|2.902186|4.222868|7.077013|7.691235|8.978321|0.215912|17.541225|8.952837|8.963320|7.023535|9.073887|9.474086|4.773126|3.661506|4.344701|4.362045|0.073483|0.060502|0.060350|0.047085|0.052539|0.052710|0.087033|0.092183|0.067885|0.059877|0.063104|0.071538|0.054848|0.054721|0.061247|0.066316|0.088475|0.085788|0.144640|0.500000| |3.017376|3.033148|2.971321|2.768362|4.847052|3.897844|2.500187|2.872545|4.469077|4.295493|4.126706|4.125928|0.111048|3.121543|2.814758|2.739149|2.271545|3.023768|0.055267|0.063451|2.380746|2.939189|5.030877|7.641702|9.376100|6.717297|0.171520|8.751492|17.567736|6.780267|4.433985|6.852126|5.124173|2.930813|2.599108|2.657432|2.758995|0.097643|0.078201|0.074816|0.061153|0.071889|0.069081|0.129658|0.114656|0.074979|0.068549|0.074397|0.079749|0.059332|0.058649|0.062025|0.062678|0.085765|0.084565|0.183468|0.173794|0.500000| |2.480260|2.439188|2.357453|2.227648|3.963711|3.195256|2.044415|2.287005|3.641133|3.387993|3.067578|3.071206|0.082194|2.504217|2.290582|2.241793|1.929332|2.619947|0.048657|0.055234|2.059226|2.456678|3.676886|5.971146|6.445970|5.474449|0.143742|8.814303|17.564760|6.917309|4.045167|6.098978|5.098169|2.965987|2.527158|2.802942|2.831070|0.078579|0.066167|0.062604|0.051185|0.058735|0.056316|0.092293|0.087755|0.062350|0.056830|0.060469|0.065279|0.050637|0.050348|0.053779|0.055458|0.072148|0.071248|0.127943|0.215427|0.301909|0.500000| |2.389744|2.416929|2.431733|2.308655|3.996561|3.132548|2.166826|2.417488|3.894851|3.576830|3.265599|3.517385|0.096031|2.808635|2.459089|2.564040|2.164946|2.930772|0.053853|0.062866|2.262558|2.738908|4.518908|7.683132|7.714642|6.900533|0.214237|8.753363|17.551954|5.472049|4.577674|6.594818|5.758827|3.206912|2.788635|3.033395|2.876120|0.074898|0.062365|0.061050|0.053674|0.062584|0.060781|0.096720|0.090261|0.065626|0.060973|0.068660|0.076986|0.055716|0.056818|0.057996|0.060584|0.082904|0.077225|0.136421|0.213651|0.301691|0.301819|0.500000| |2.819889|2.549203|2.435992|2.163429|3.758063|3.144026|1.935543|2.489217|3.914461|3.989191|3.653652|3.517637|0.084974|3.032969|2.815160|2.510868|2.208648|3.147036|0.058207|0.065344|2.664128|3.255278|4.185853|6.425039|7.821552|6.810190|0.139446|8.700847|5.462539|17.566275|6.932450|11.529537|7.650788|4.468568|3.582525|3.634249|4.917792|0.093273|0.073688|0.074270|0.048990|0.053174|0.054280|0.099630|0.119047|0.081838|0.067475|0.064959|0.070753|0.058621|0.055716|0.069530|0.073642|0.093888|0.103700|0.180963|0.210414|0.139251|0.140477|0.122099|0.500000| |2.697465|2.482736|2.331622|2.123736|3.777049|3.160723|1.902749|2.297482|3.617797|3.538949|3.198802|3.041364|0.076949|2.573380|2.422486|2.207481|1.938307|2.696994|0.050295|0.056056|2.207392|2.633781|3.536070|5.537156|6.415856|5.442975|0.123357|8.826837|6.846254|17.574235|4.722960|7.507398|5.762814|3.449344|2.827731|3.083156|3.626447|0.088073|0.072384|0.069145|0.048212|0.053121|0.052549|0.092304|0.099020|0.068705|0.059243|0.058521|0.062564|0.051609|0.049687|0.058219|0.060362|0.075727|0.080421|0.142929|0.218586|0.166493|0.206294|0.140593|0.302071|0.500000| |3.497498|3.157892|2.939795|2.590831|4.556280|3.885377|2.259344|2.900904|4.427049|4.627236|4.480346|4.027536|0.098441|3.234752|3.064001|2.655644|2.268825|3.116076|0.057233|0.064040|2.596347|3.225671|4.623360|6.683550|9.159030|6.517512|0.136802|8.716865|6.873480|17.525384|5.269181|8.927631|5.696016|3.345738|2.888631|2.855453|3.443315|0.120834|0.090895|0.088029|0.056419|0.062415|0.062492|0.130923|0.145270|0.086767|0.072740|0.070412|0.074195|0.060550|0.057169|0.068704|0.069403|0.090782|0.100440|0.239425|0.173700|0.202461|0.172666|0.139657|0.300995|0.303930|0.500000| |2.026510|1.964343|1.999544|1.840381|3.115034|2.467067|1.738775|2.112745|3.492772|3.266435|2.850847|3.205660|0.081068|2.892960|2.454266|2.600968|2.320556|3.421111|0.063209|0.075620|2.732197|3.249996|4.246335|7.936705|6.702626|7.644722|0.223088|6.504445|4.701310|4.856679|9.534172|10.892101|26.062535|9.013190|6.034656|7.907673|5.966488|0.063119|0.052506|0.054473|0.044060|0.048391|0.050016|0.076041|0.083630|0.068565|0.060742|0.065425|0.078501|0.058941|0.060281|0.067394|0.077963|0.105231|0.094042|0.119059|0.225487|0.109683|0.113644|0.133863|0.141124|0.117626|0.111247|0.500000| |1.814571|1.764753|1.840959|1.687532|2.801868|2.193854|1.622302|2.021233|3.452311|3.130188|2.564337|2.977213|0.075015|3.029397|2.520108|2.829721|2.702747|4.338898|0.081537|0.100280|3.433100|3.748451|3.630785|7.272047|4.856181|4.192371|0.120598|3.375463|2.793545|2.988430|5.657249|9.434670|9.590680|8.791998|17.548700|6.951768|5.490169|0.055135|0.046634|0.050343|0.041589|0.044389|0.047583|0.065454|0.074363|0.071355|0.063815|0.068441|0.085727|0.067452|0.070573|0.081007|0.105998|0.127223|0.104109|0.089380|0.098645|0.072170|0.069568|0.079336|0.090152|0.073844|0.075846|0.168316|0.500000| |1.720605|1.645611|1.691483|1.546184|2.590447|2.048565|1.475701|1.844704|3.146751|2.857304|2.299675|2.549014|0.063950|2.632840|2.297627|2.421468|2.372434|3.817232|0.073821|0.084639|3.116106|3.257662|2.954507|5.571938|4.068827|3.420900|0.093262|2.951316|2.437200|2.780134|4.610734|8.333114|7.606414|8.818411|17.555790|6.948427|6.876255|0.052118|0.044614|0.048140|0.038182|0.040178|0.042957|0.058778|0.068053|0.066763|0.058585|0.059421|0.070736|0.060954|0.061690|0.076110|0.099099|0.103015|0.094465|0.078478|0.086787|0.063268|0.062342|0.067473|0.086533|0.070047|0.070505|0.130938|0.300984|0.500000| |2.028830|1.931165|1.999427|1.795985|2.976608|2.364024|1.697668|2.220762|3.750391|3.542694|2.902717|3.292669|0.079719|3.448695|2.909722|3.036403|2.915037|4.805449|0.089589|0.106707|4.165824|4.597592|3.905860|7.291946|5.302385|4.371676|0.114928|3.494617|2.801095|3.292537|6.542470|13.319296|9.410897|8.788579|17.612817|5.513917|6.892685|0.062232|0.051794|0.056944|0.043535|0.045906|0.049727|0.072223|0.087175|0.085405|0.072306|0.072530|0.088407|0.074063|0.073568|0.097826|0.134399|0.151659|0.137186|0.101603|0.098489|0.073799|0.069768|0.076495|0.104064|0.079617|0.084598|0.146445|0.300328|0.301033|0.500000| |1.680552|1.612174|1.620226|1.505496|2.579969|2.049799|1.429098|1.696651|2.840233|2.578598|2.153774|2.320511|0.059580|2.194478|1.948133|2.013185|1.875556|2.791497|0.053232|0.060890|2.218385|2.471119|2.793776|5.133547|4.215875|3.980679|0.110384|3.956424|3.186405|3.533235|4.831054|7.180579|9.762149|8.765359|5.503450|17.544545|6.938660|0.051462|0.044344|0.045648|0.036815|0.039684|0.040829|0.057699|0.063548|0.055364|0.049337|0.051308|0.059376|0.048567|0.049328|0.056032|0.064969|0.076592|0.072062|0.080720|0.134804|0.076852|0.084445|0.088906|0.106835|0.093790|0.082730|0.217505|0.141447|0.141337|0.122920|0.500000| |1.575359|1.511426|1.531283|1.420598|2.418307|1.914068|1.356677|1.624268|2.750816|2.468457|2.015838|2.187364|0.056087|2.145985|1.906662|1.991192|1.903185|2.900634|0.056043|0.063612|2.300985|2.477606|2.569496|4.793124|3.712234|3.301480|0.091768|3.100228|2.572155|2.863588|4.136185|6.670036|7.717394|8.820409|6.927111|17.585722|6.930781|0.047777|0.041456|0.043349|0.035140|0.037421|0.039007|0.053201|0.059330|0.054578|0.048750|0.050296|0.058529|0.049278|0.050220|0.057848|0.069181|0.076880|0.071762|0.071511|0.097940|0.064387|0.067633|0.071902|0.087577|0.075082|0.069920|0.151997|0.171197|0.208294|0.141342|0.301945|0.500000| |1.644009|1.599856|1.637427|1.526013|2.584204|2.028059|1.466418|1.738959|2.945402|2.634800|2.183410|2.436681|0.063024|2.342878|2.026273|2.199190|2.061370|3.111497|0.059234|0.069542|2.420001|2.672242|2.972035|5.742626|4.268778|3.962017|0.116957|3.587475|2.991137|3.080805|4.821390|7.176294|9.750839|8.758297|6.938991|17.536854|5.501251|0.049983|0.042995|0.044875|0.037705|0.040707|0.042332|0.057893|0.063258|0.056950|0.051606|0.055388|0.066178|0.052520|0.054683|0.059903|0.071427|0.085464|0.075650|0.079250|0.115415|0.073612|0.076883|0.086509|0.090979|0.079511|0.074874|0.220202|0.208957|0.171899|0.141322|0.300134|0.301860|0.500000| |2.133313|1.963204|1.954448|1.748160|2.967364|2.415247|1.616095|2.097898|3.454057|3.352222|2.803680|2.916953|0.070515|2.870273|2.605201|2.447464|2.298334|3.536218|0.066811|0.074545|3.083222|3.490329|3.383544|5.778488|5.157437|4.408691|0.106132|4.027012|3.043377|4.251100|6.571863|13.329744|9.416907|8.772588|6.863102|5.509646|17.618873|0.066650|0.055432|0.059324|0.041599|0.043832|0.046349|0.071675|0.088275|0.078220|0.064143|0.060979|0.069199|0.060609|0.058050|0.078340|0.093104|0.103901|0.112258|0.106303|0.116437|0.078752|0.078322|0.078964|0.150983|0.103862|0.103937|0.145263|0.140341|0.169246|0.205371|0.141415|0.141205|0.122778|0.500000| 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