Version2.1 2020-09-01T02:07:20Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 07-Jul-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE C[C@@H]1CCC[NH+](C1)C(C)(C)CNC(=O)Nc2ccccc2CC(=O)N(C)C C56744346 RHF 6-31G(d) (6D,7F) C[C@@H]1CCC[NH+](C1)C(C)(C)CNC(=O)Nc2ccccc2CC(=O)N(C)C C01[X(C21H35N4O2)] 180 C1 475 C[C@@H]1CCC[NH+](C1)C(CNC(=O)Nc1ccccc1CC(=O)N(C)C)(C)C C[C@@H]1CCC[NH+](C1)C(CNC(=O)Nc1ccccc1CC(=O)N(C)C)(C)C C[C@@H]1CCC[NH+](C1)C(C)(C)CNC(=O)Nc2ccccc2CC(=O)N(C)C InChIKey=JWOINCXDPWVZDD-MRXNPFEDSA-O InChI=1S/C21H34N4O2/c1-16-9-8-12-25(14-16)21(2,3)15-22-20(27)23-18-11-7-6-10-17(18)13-19(26)24(4)5/h6-7,10-11,16H,8-9,12-15H2,1-5H3,(H2,22,23,27)/p+1/t16-/m1/s1 InChI=1/C21H34N4O2/c1-16-9-8-12-25(14-16)21(2,3)15-22-20(27)23-18-11-7-6-10-17(18)13-19(26)24(4)5/h6-7,10-11,16H,8-9,12-15H2,1-5H3,(H2,22,23,27)/p+1/t16-/m1/s1/fC21H35N4O2/h22-23,25H/q+1 C[C@@H]1CCC[NH+](C1)C(C)(C)CNC(=O)Nc2ccccc2CC(=O)N(C)C C01[X(C21H35N4O2)] 180 C01 475 C[C@@H]1CCC[NH+](C1)C(CNC(=O)Nc1ccccc1CC(=O)N(C)C)(C)C C[C@@H]1CCC[NH](C1)C(CN[C]([NH][C]1[CH][CH][CH][CH][C]1C[C]([N](C)C)[O])[O])(C)C C[C@@H]1CCC[NH](C1)C(C)(C)CN[C]([O])N[C]2[CH][CH][CH][CH][C]2C[C]([O])N(C)C InChIKey=GANSXVCHVVXBIN-MRXNPFEDSA-N InChI=1S/C21H35N4O2/c1-16-9-8-12-25(14-16)21(2,3)15-22-20(27)23-18-11-7-6-10-17(18)13-19(26)24(4)5/h6-7,10-11,16,25H,8-9,12-15H2,1-5H3,(H2,22,23,27)/t16-/m1/s1 InChI=1/C21H35N4O2/c1-16-9-8-12-25(14-16)21(2,3)15-22-20(27)23-18-11-7-6-10-17(18)13-19(26)24(4)5/h6-7,10-11,16,25H,8-9,12-15H2,1-5H3,(H2,22,23,27)/t16-/m1/s1/f/h22-23H 2642.7556602189 -1183.0185993 1-A 13958.6898 102 373 475 |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| -20.63843 -20.61287 -15.79118 -15.69960 -15.68355 -15.67969 -11.49271 -11.44030 -11.42858 -11.40091 -11.39969 -11.39923 -11.36631 -11.35078 -11.35030 -11.34618 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14.00307 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 5764.3458 19614.4263 22809.2816 1.00000 0.00250 0.00050 -0.00251 0.99997 0.00783 -0.00049 -0.00783 0.99997 1 0.01503 0.00442 0.00380 0.31309 0.09201 0.07912 18.72 35.98 47.79 52.10 75.48 88.48 95.82 131.94 137.64 144.15 156.38 180.00 218.94 232.64 240.32 284.84 306.76 328.46 354.93 372.51 396.20 412.22 423.80 433.38 450.35 472.78 498.05 513.51 532.16 550.37 563.16 600.12 640.18 648.12 660.16 664.85 695.48 711.15 718.32 737.84 740.99 758.49 830.48 845.23 855.85 898.44 955.01 1012.71 1091.09 1131.53 1157.34 1184.84 1194.75 1228.84 1232.23 1240.57 1252.44 1293.35 1334.45 1369.96 1374.42 1384.00 1400.71 1412.81 1421.26 1441.27 1481.09 1497.19 1512.90 1539.62 1548.87 1558.71 1561.75 1569.85 1604.20 1619.92 1645.28 1655.96 1661.31 1677.98 1696.86 1728.18 1732.35 1737.31 1771.98 1802.93 1804.99 1828.39 1837.89 1845.09 1855.13 1866.43 1880.97 1908.38 1914.54 1951.10 1976.68 1994.96 2007.33 2026.56 2048.66 2054.56 2085.09 2092.80 2105.54 2124.05 2134.95 2139.32 2200.88 2213.98 2228.24 2234.11 2250.13 2261.88 2264.32 2279.50 2290.57 2291.97 2332.62 2335.84 2341.79 2348.37 2353.05 2353.33 2355.87 2361.92 2363.78 2364.32 2366.26 2369.55 2371.46 2383.56 2385.08 2386.14 2389.15 2395.02 2397.78 2426.86 2448.40 2460.29 2541.88 2591.60 2620.48 2678.26 2717.97 4593.26 4608.13 4617.14 4633.80 4642.78 4647.90 4651.65 4658.23 4676.25 4696.32 4700.28 4701.93 4708.13 4712.48 4717.18 4732.14 4738.86 4747.26 4753.77 4757.07 4758.21 4767.43 4775.38 4776.42 4801.70 4842.08 4842.23 4849.79 4860.19 4875.12 4885.28 4936.25 4939.91 5297.15 5549.52 0.595937 0.622397 0.623341 0.537379 -1182.422662 -1182.396202 -1182.395258 -1182.481221 2.883213D-04 MUNgauss RevisionA2.0 retrievium 01-Sep-2020 DUDE C[C@@H]1CCC[NH+](C1)C(C)(C)CNC(=O)Nc2ccccc2CC(=O)N(C)C C56744346 RHF 6-31G(d) (6D,10F) C1 375.276002 |X|Y|Z| 30.020820 51.566627 101.971945 54.045225 17 6 7 14 3 |36.858105| |12.454156|36.858105| |8.910520|17.501653|0.500000| |7.496302|12.457168|0.247674|36.858105| |4.905199|7.585876|0.191629|12.481014|36.858105| |4.410191|6.526349|0.160423|7.573622|12.504654|36.858105| |4.954523|7.595860|0.193821|6.462756|7.649099|12.667387|53.358707| |4.698247|7.215028|0.217233|6.029101|7.372201|9.436063|25.385763|0.500000| |7.619142|12.434046|0.248796|7.552196|6.551299|7.773449|17.269820|0.257435|36.858105| |3.751962|4.860004|0.128605|4.281294|4.901776|7.439179|16.800242|0.258693|7.371870|36.858105| |3.714359|4.438669|0.120157|3.635751|3.799440|4.913263|10.269927|0.187532|6.607991|12.440393|36.858105| |3.336978|4.066302|0.102569|3.852548|4.335025|6.567324|10.283003|0.159010|5.767410|12.434552|7.614824|36.858105| |3.039166|3.850111|0.108325|3.585984|4.345603|6.031629|10.327208|0.214378|4.933746|12.283410|7.578366|7.590068|36.858105| |2.906379|3.611015|0.107509|3.258251|3.811172|4.666266|8.105745|0.195340|4.350901|7.479110|6.624628|4.986116|13.155365|53.358707| |3.049401|3.859575|0.121841|3.484258|4.112632|4.617802|7.743649|0.211079|4.305996|5.740460|5.152063|4.032737|7.737321|18.972966|36.858105| |3.553802|4.790127|0.157849|4.362580|5.382573|5.744097|9.497707|0.301393|5.093878|5.850685|4.911815|4.113881|6.851637|11.549005|15.582054|73.516695| |2.635178|3.170905|0.100395|2.886701|3.280967|3.506177|5.574870|0.140480|3.394853|4.169871|4.041280|3.189232|5.269225|11.388220|14.240605|14.898103|53.358707| |2.526714|2.974788|0.096175|2.736152|3.040432|3.064386|4.691668|0.116480|3.013032|3.322696|3.248654|2.653198|3.882590|7.120471|7.714840|11.660754|18.288164|36.858105| |2.562324|3.044723|0.099457|2.901067|3.273597|3.140441|4.580497|0.113733|2.953331|3.090156|2.909518|2.522312|3.531609|5.935936|6.255147|11.399587|10.601558|13.736233|36.858105| |2.343284|2.688382|0.087048|2.586319|2.823363|2.644696|3.787749|0.090724|2.543704|2.551436|2.444418|2.148624|2.815748|4.525415|4.328512|7.982985|6.992567|7.930890|13.767853|36.858105| |2.147588|2.394203|0.076610|2.262552|2.405925|2.294172|3.338447|0.078443|2.291422|2.301536|2.272081|1.955907|2.511488|4.057053|3.710958|6.535872|6.182937|6.861588|7.946136|13.780936|36.858105| |2.125889|2.359630|0.075075|2.181940|2.309666|2.265121|3.382026|0.079368|2.319075|2.394009|2.423492|2.015876|2.631081|4.386100|3.963282|6.591860|7.045799|7.963882|6.910390|7.976795|13.766295|36.858105| |2.282357|2.584794|0.082416|2.355852|2.530382|2.547951|3.903172|0.093193|2.613025|2.818414|2.873699|2.312386|3.181168|5.622303|5.260982|8.123018|10.728132|13.612514|7.878659|6.823812|7.867240|13.713458|36.858105| |2.157281|2.398402|0.074805|2.155529|2.283756|2.362561|3.687098|0.085793|2.497199|2.775198|2.954355|2.292305|3.111311|5.540822|4.684801|6.936811|8.986527|7.435088|4.972318|4.414297|5.004670|7.565245|12.493305|36.858105| |1.936548|2.157339|0.065737|1.976577|2.125945|2.243006|3.444165|0.078568|2.287781|2.683789|2.821636|2.262976|3.114777|5.517856|4.340673|6.241885|8.140309|5.836414|4.192049|3.685407|3.989051|5.336712|7.423645|12.448478|36.858105| |1.995116|2.253326|0.068014|2.070327|2.260807|2.443941|3.776117|0.085908|2.444645|3.040860|3.174924|2.544300|3.681423|6.774997|5.019549|6.836783|9.313673|5.659062|4.097669|3.438069|3.505196|4.350687|6.019473|8.051208|15.611638|73.516695| |1.710999|1.878021|0.056667|1.741773|1.860940|1.945994|2.927812|0.065670|1.971482|2.268288|2.369726|1.967498|2.587220|4.342306|3.356805|5.056306|5.846428|4.396427|3.473220|3.234658|3.602224|4.677891|5.532827|7.682364|14.249045|15.125096|53.358707| |1.564923|1.713988|0.050980|1.607873|1.726213|1.822451|2.706813|0.059764|1.813788|2.130302|2.206566|1.888272|2.447656|3.989796|2.963516|4.493278|4.907173|3.520885|2.919741|2.713763|2.916492|3.521454|4.024425|4.975717|7.880880|12.452147|17.792902|36.858105| |1.623445|1.757369|0.053163|1.632233|1.721379|1.768962|2.640443|0.059034|1.812469|2.003542|2.094256|1.753475|2.225365|3.635757|2.861632|4.482240|4.835815|3.875754|3.215603|3.172286|3.731520|4.907578|5.100257|6.537428|7.716035|9.439787|17.808725|7.707699|36.858105| |17.542424|8.763344|0.173361|6.766355|4.538513|4.239347|6.217220|0.114799|6.868451|3.597926|3.537038|3.377511|2.876715|3.650471|2.738824|5.556761|3.230681|2.254811|2.277580|2.089087|1.924338|1.910092|2.048608|1.957782|1.786332|3.289826|2.164820|1.470208|1.506773|0.500000| |17.554089|8.749793|0.213373|5.459537|4.067984|3.863518|6.256781|0.123646|6.941345|3.681435|3.884240|3.216986|2.985917|3.980700|3.051062|6.151296|3.639249|2.563181|2.543344|2.331367|2.173916|2.185345|2.354845|2.260807|2.009408|3.660901|2.410442|1.610767|1.684176|0.301040|0.500000| |17.578449|8.822062|0.213557|6.862746|4.528240|3.843319|5.571476|0.111904|5.523938|3.178177|3.116981|2.856029|2.692261|3.561673|2.799535|5.811245|3.366173|2.432186|2.515146|2.349806|2.153396|2.099938|2.212154|2.065832|1.845968|3.345641|2.237784|1.500821|1.575823|0.301957|0.302263|0.500000| |6.951111|8.844744|0.174240|17.504594|8.844595|6.782277|7.640358|0.136716|6.746846|4.012729|3.431318|3.872671|3.300602|3.989300|3.026067|6.439248|3.460289|2.394259|2.504552|2.257251|2.005563|1.947754|2.096063|1.949521|1.810583|3.380511|2.190797|1.500323|1.509453|0.205605|0.140927|0.173529|0.500000| |6.801124|8.844255|0.216460|17.573003|8.838882|5.513661|6.628450|0.134346|5.505590|3.499139|3.078512|3.168173|3.073237|3.930428|3.157349|6.967749|3.678359|2.642911|2.866867|2.623255|2.289106|2.170320|2.296783|2.077070|1.891650|3.478086|2.287112|1.546315|1.591901|0.165904|0.139904|0.203661|0.303355|0.500000| |4.061676|5.507694|0.140398|8.800827|17.566125|8.979902|7.600206|0.148273|4.911765|4.083612|3.218810|3.863256|3.773772|4.492018|3.508166|7.767255|3.941103|2.717722|2.959885|2.606334|2.226036|2.118372|2.289318|2.068949|1.951690|3.683391|2.355545|1.621053|1.607020|0.108697|0.094745|0.107933|0.215461|0.209224|0.500000| |4.486755|6.762067|0.201342|8.811956|17.556007|8.890349|9.408594|0.218450|5.713771|4.627908|3.684027|3.877493|4.408060|5.579803|4.741658|11.924203|5.120676|3.551415|3.966182|3.350626|2.767846|2.616423|2.869985|2.517809|2.315516|4.354183|2.737968|1.846247|1.861126|0.110544|0.107381|0.118714|0.173309|0.214805|0.303221|0.500000| |4.291292|5.825166|0.134839|6.870961|8.826491|17.634812|12.355313|0.182388|7.167144|6.667943|4.619761|7.218019|5.126761|5.361312|3.756235|7.789322|4.051135|2.627595|2.667290|2.300725|2.032878|2.015905|2.244778|2.118326|2.029655|3.922798|2.425969|1.685580|1.627177|0.121725|0.103735|0.102885|0.201145|0.140066|0.214764|0.173810|0.500000| |3.558862|4.881888|0.128775|5.515881|8.847864|17.689345|12.304881|0.223216|5.637910|7.104398|4.579503|6.413697|6.941710|6.930095|4.945271|10.614122|5.058072|3.184882|3.271371|2.712987|2.333075|2.302703|2.609023|2.408752|2.330722|4.577258|2.750584|1.908257|1.818919|0.095041|0.089361|0.088805|0.139717|0.123635|0.215616|0.215588|0.301726|0.500000| |7.009244|8.881536|0.218130|5.522888|4.915282|5.640455|12.332800|0.219601|17.707972|6.976217|7.843424|5.236137|4.765409|6.072952|4.362696|8.707368|4.778203|3.100156|2.946954|2.544514|2.336400|2.410341|2.741378|2.677466|2.423300|4.586574|2.822581|1.893509|1.905578|0.170479|0.210260|0.142840|0.139201|0.123949|0.108157|0.128287|0.145647|0.126472|0.500000| |6.910148|8.763740|0.173976|6.772834|5.775400|7.112570|12.343245|0.180536|17.594282|6.650417|5.954921|6.234039|4.418966|5.109157|3.587255|7.240058|3.961172|2.595618|2.549473|2.232230|2.029949|2.053076|2.289040|2.214455|2.064607|3.929343|2.454758|1.680745|1.661756|0.204462|0.171213|0.140709|0.197266|0.138692|0.129545|0.132790|0.217950|0.145301|0.301820|0.500000| |3.993939|4.525407|0.117057|3.638648|3.610188|4.548223|8.952936|0.155166|6.934880|8.733731|17.604178|7.122517|5.495885|6.567900|4.063535|7.175641|4.538886|2.806548|2.566237|2.210469|2.070922|2.191263|2.536035|2.606321|2.475289|4.842233|2.888879|1.985131|1.907958|0.108845|0.118030|0.090957|0.098324|0.085301|0.085746|0.094550|0.125676|0.113374|0.240884|0.190380|0.500000| |3.072063|3.548140|0.097143|3.040014|3.218319|4.072542|7.527293|0.143518|4.820729|8.928025|17.586781|6.826419|7.243996|8.878070|4.749071|7.579898|5.318455|3.102554|2.732475|2.308077|2.172132|2.345341|2.795495|2.957864|2.920665|5.974579|3.347366|2.326640|2.142526|0.082316|0.089161|0.073609|0.080709|0.073228|0.078192|0.087557|0.108265|0.110823|0.151420|0.126466|0.303479|0.500000| |3.870000|4.624427|0.132709|3.636085|3.742438|4.535370|9.519307|0.198911|6.451723|8.707584|17.609618|5.503735|6.681255|9.656333|5.935490|9.877134|6.366119|3.736218|3.258214|2.712101|2.535012|2.741894|3.310017|3.423531|3.157018|6.238790|3.534505|2.361042|2.296916|0.098408|0.115798|0.090884|0.092451|0.087167|0.086968|0.104648|0.113805|0.117158|0.232693|0.148542|0.299792|0.303543|0.500000| |3.072939|3.768103|0.095611|3.813542|4.533168|7.053301|9.015722|0.145819|4.928427|8.688506|5.505805|17.593695|7.068031|6.277601|3.843542|7.078333|4.167393|2.572983|2.494406|2.128096|1.918600|1.954662|2.224079|2.173232|2.164045|4.323021|2.581811|1.833485|1.692929|0.086571|0.080598|0.074754|0.107318|0.087769|0.116990|0.111226|0.223817|0.212297|0.120079|0.146333|0.141772|0.142525|0.122143|0.500000| |2.896439|3.382267|0.087316|3.174439|3.491560|4.816855|7.516515|0.127530|4.561110|8.897639|7.240224|17.591563|6.793049|6.442807|3.705483|6.413956|4.128280|2.512420|2.349718|2.015286|1.859727|1.938089|2.228494|2.255974|2.266709|4.573831|2.696017|1.923735|1.754013|0.081498|0.079320|0.069826|0.088650|0.074851|0.088341|0.089447|0.142738|0.135389|0.122839|0.134993|0.189116|0.212343|0.143871|0.303017|0.500000| |3.668540|4.340330|0.104687|4.081678|4.309228|6.220192|9.511652|0.143493|6.320580|8.737159|6.724891|17.580745|5.491835|5.533299|3.482142|6.477857|3.845021|2.419508|2.324382|2.014346|1.843934|1.890833|2.138212|2.118375|2.065381|4.054207|2.466787|1.733618|1.636627|0.106920|0.097456|0.085541|0.118975|0.092015|0.106920|0.103593|0.210707|0.153633|0.155808|0.217057|0.204780|0.160508|0.139948|0.300846|0.303450|0.500000| |2.667871|3.236262|0.089724|3.048920|3.580995|4.786564|7.608400|0.150704|4.078598|8.978909|6.744374|7.458152|17.619085|12.727381|5.792510|8.905529|6.100856|3.387461|3.058928|2.503359|2.277066|2.405229|2.882044|2.902675|3.007955|6.427189|3.454310|2.461439|2.165083|0.071449|0.073391|0.066103|0.080144|0.073712|0.089647|0.099135|0.121856|0.151529|0.111602|0.106675|0.142244|0.208969|0.157537|0.194899|0.217706|0.146637|0.500000| |2.946350|3.785765|0.106279|3.744537|4.862909|6.871696|9.741398|0.204505|4.588859|8.726295|5.513414|6.692942|17.610392|12.429757|7.104178|12.393738|6.738203|3.798940|3.628345|2.884364|2.515693|2.573066|3.052999|2.888770|2.897344|5.991961|3.329845|2.327366|2.124448|0.077709|0.078493|0.073667|0.095303|0.089417|0.120079|0.138232|0.155432|0.258821|0.116905|0.115552|0.122542|0.143979|0.140172|0.202085|0.159113|0.139721|0.305366|0.500000| |2.561146|3.065495|0.090525|2.787103|3.182417|3.792569|6.279026|0.143445|3.624444|5.840590|5.716457|4.346505|9.100717|26.026497|9.386348|10.861454|10.757901|4.981700|4.007022|3.132103|2.888750|3.200745|4.151302|4.331274|4.602569|10.831804|4.848750|3.324837|2.883523|0.066312|0.072316|0.064659|0.070837|0.069735|0.078572|0.094073|0.092534|0.114519|0.104975|0.089566|0.120053|0.173108|0.167924|0.112238|0.121474|0.099851|0.239988|0.191172|0.500000| |2.386039|2.803633|0.086568|2.559476|2.871613|3.123232|4.937568|0.118533|3.053875|3.896207|3.900143|3.062010|4.991657|10.784336|9.461417|10.781242|25.819189|9.282185|5.864811|4.323862|4.064133|4.830385|7.351698|7.395525|7.786713|18.561209|7.004913|4.311849|3.968452|0.060536|0.067754|0.062078|0.063851|0.066502|0.071512|0.088821|0.075564|0.092319|0.088680|0.074385|0.089450|0.109669|0.123286|0.081328|0.083195|0.074989|0.125539|0.126692|0.251249|0.500000| |2.702642|3.308541|0.107734|3.248835|3.832891|3.619312|5.110425|0.128810|3.190361|3.355426|3.028017|2.733636|3.881409|6.293778|6.745790|13.726324|9.721110|8.948365|17.791486|8.925827|5.654973|4.977219|5.629420|4.062800|3.614894|6.566412|4.132512|2.647883|2.780836|0.066868|0.073029|0.073503|0.076949|0.088793|0.096273|0.134191|0.083438|0.106742|0.086014|0.076243|0.073942|0.078105|0.092425|0.076269|0.069621|0.069547|0.091399|0.115368|0.113687|0.148697|0.500000| |2.295760|2.622846|0.084256|2.590705|2.829958|2.582764|3.595903|0.084953|2.432749|2.387105|2.256307|2.044930|2.600939|4.031870|3.744943|7.165817|5.670955|5.649522|8.946068|17.726108|8.915191|5.658948|4.927137|3.534199|3.066113|5.178251|3.757794|2.386138|2.728689|0.057060|0.062610|0.064826|0.062828|0.074338|0.073809|0.093690|0.062678|0.073515|0.066587|0.059804|0.057319|0.058962|0.068495|0.056811|0.053009|0.053630|0.064445|0.075234|0.077021|0.099289|0.215725|0.500000| |1.994416|2.184298|0.069139|2.081987|2.186024|2.068100|2.974515|0.068735|2.072242|2.049036|2.027348|1.770533|2.205088|3.475495|3.076863|5.484809|4.922036|4.947167|5.645661|8.905404|17.730722|8.923131|5.619991|4.094496|3.388208|5.308762|4.344256|2.642869|3.427760|0.049912|0.056027|0.056121|0.051692|0.059122|0.056810|0.069041|0.051488|0.058149|0.058547|0.051538|0.051984|0.053955|0.062210|0.048368|0.046878|0.046739|0.056095|0.061524|0.069014|0.092152|0.124173|0.214116|0.500000| |1.965201|2.139277|0.067209|1.974252|2.061638|2.030308|3.029075|0.069833|2.109137|2.166562|2.225476|1.850161|2.350387|3.852050|3.334266|5.541148|5.705068|5.655924|4.971483|5.672231|8.961811|17.716265|8.936631|7.073800|5.112454|7.145076|6.569363|3.574959|5.618603|0.049372|0.056522|0.054038|0.049483|0.054634|0.052841|0.063830|0.050849|0.057054|0.061291|0.052420|0.056525|0.060346|0.069569|0.049685|0.049819|0.048511|0.060589|0.063421|0.079210|0.113591|0.107936|0.124500|0.216457|0.500000| |2.033176|2.213317|0.068713|1.990216|2.074299|2.121880|3.280720|0.075184|2.275834|2.447384|2.625657|2.060700|2.669976|4.548454|3.756398|5.834177|6.611367|5.582933|4.195427|4.006945|4.816129|7.384294|8.921555|17.652363|8.757511|10.489921|9.855317|4.686226|7.538356|0.051367|0.059546|0.054538|0.050302|0.053752|0.052533|0.063038|0.053431|0.059553|0.067951|0.056557|0.065779|0.072905|0.083778|0.054281|0.056465|0.053583|0.069833|0.069305|0.097597|0.144808|0.096428|0.091119|0.114743|0.228583|0.500000| |2.359261|2.628226|0.082124|2.307948|2.425783|2.545948|4.098042|0.095665|2.789682|3.124036|3.446573|2.525345|3.451291|6.302533|5.211718|7.554701|9.510213|6.839608|4.635243|3.979454|4.273031|5.817879|8.869433|17.575957|9.111933|13.552352|8.051830|4.304128|5.006102|0.059230|0.069547|0.061942|0.057919|0.061085|0.060261|0.073753|0.063354|0.071341|0.084928|0.068100|0.083494|0.095768|0.114738|0.065379|0.069147|0.064776|0.088812|0.086424|0.136774|0.216149|0.109498|0.090598|0.098871|0.149906|0.304527|0.500000| |1.490149|1.633402|0.048532|1.549730|1.671367|1.751303|2.562230|0.056521|1.713499|1.995990|2.032035|1.784494|2.297250|3.683711|2.770231|4.268183|4.549410|3.343569|2.864800|2.706259|2.902800|3.411327|3.755248|4.289829|6.145048|9.955331|12.375996|17.570156|6.840652|0.038950|0.042327|0.039908|0.040194|0.041602|0.043930|0.049770|0.045007|0.051190|0.049216|0.044225|0.051008|0.059034|0.059929|0.048616|0.050251|0.045575|0.064008|0.061733|0.083832|0.107875|0.072480|0.066759|0.073880|0.095904|0.113097|0.102237|0.500000| |1.481667|1.605014|0.047487|1.502030|1.596545|1.683936|2.502193|0.054739|1.698343|1.970972|2.065317|1.765383|2.221111|3.551269|2.608568|4.018515|4.193722|3.017084|2.548861|2.404250|2.599767|3.106435|3.451126|4.290645|6.046173|9.612238|12.418133|17.574976|7.079071|0.038814|0.042536|0.039501|0.039146|0.040177|0.041719|0.047082|0.043615|0.048629|0.049452|0.043988|0.052205|0.060698|0.061169|0.047437|0.050218|0.045365|0.062410|0.058422|0.081498|0.099861|0.064665|0.059406|0.066597|0.089676|0.118190|0.106632|0.300253|0.500000| |1.613626|1.779907|0.052672|1.669947|1.806387|1.934764|2.883860|0.063463|1.908975|2.313582|2.392873|2.050409|2.708393|4.443094|3.199557|4.756326|5.241576|3.562708|2.931121|2.650066|2.765459|3.282080|3.878962|4.749420|7.661396|14.906422|12.462328|17.718732|5.639591|0.042237|0.046052|0.042697|0.043366|0.044266|0.047061|0.053458|0.049720|0.056677|0.055317|0.049224|0.059210|0.071135|0.070556|0.055278|0.058516|0.051778|0.076842|0.070986|0.106031|0.132319|0.075155|0.064949|0.068969|0.089852|0.118374|0.119996|0.300444|0.300324|0.500000| |1.617760|1.732363|0.052297|1.595100|1.662853|1.709717|2.571083|0.057157|1.788802|1.952916|2.075089|1.712716|2.131614|3.455425|2.689646|4.247453|4.435120|3.500612|2.921390|2.888157|3.389908|4.412161|4.560116|6.106985|6.498177|8.350450|12.249048|6.176705|17.558852|0.041729|0.046993|0.043589|0.041099|0.043207|0.043006|0.049628|0.043914|0.048406|0.052699|0.045651|0.052942|0.059023|0.063490|0.045605|0.047725|0.044696|0.057708|0.056025|0.075840|0.100037|0.070807|0.069653|0.087704|0.143768|0.215966|0.138410|0.146645|0.176945|0.134737|0.500000| 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