Version2.0 2019-11-21T11:50:54Z Gaussian16 RevisionB.01 PWARBURT 28-Sep-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCC[C@@H](CC)C(=O)N(CCN1CCOCC1)CC(=O)N(Cc2ccccc2)Cc3ccc(s3)C C35798488 RHF 6-31G(d) (6D,7F) CCCC[C@@H](CC)C(=O)N(CCN1CCOCC1)CC(=O)N(Cc2ccccc2)Cc3ccc(s3)C C01[X(C29H43N3O3S1)] 231 C1 630 CCCC[C@H](C(=O)N(CC(=O)N(Cc1ccc(s1)C)Cc1ccccc1)CCN1CCOCC1)CC CCCC[C@H](C(=O)N(CC(=O)N(Cc1ccc(s1)C)Cc1ccccc1)CCN1CCOCC1)CC CCCC[C@@H](CC)C(=O)N(CCN1CCOCC1)CC(=O)N(Cc2sc(C)cc2)Cc3ccccc3 InChIKey=BCWKMQLTRHKXIX-AREMUKBSSA-N InChI=1S/C29H43N3O3S/c1-4-6-12-26(5-2)29(34)31(16-15-30-17-19-35-20-18-30)23-28(33)32(21-25-10-8-7-9-11-25)22-27-14-13-24(3)36-27/h7-11,13-14,26H,4-6,12,15-23H2,1-3H3/t26-/m1/s1 InChI=1/C29H43N3O3S/c1-4-6-12-26(5-2)29(34)31(16-15-30-17-19-35-20-18-30)23-28(33)32(21-25-10-8-7-9-11-25)22-27-14-13-24(3)36-27/h7-11,13-14,26H,4-6,12,15-23H2,1-3H3/t26-/m1/s1 CCCC[C@@H](CC)C(=O)N(CCN1CCOCC1)CC(=O)N(Cc2ccccc2)Cc3ccc(s3)C C01[X(C29H43N3O3S1)] 231 C01 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316.76 342.23 350.18 355.60 382.05 385.49 402.39 435.79 447.18 456.25 477.35 518.03 524.48 539.42 565.56 612.02 622.03 636.26 652.16 658.98 673.43 674.76 700.61 726.28 762.28 768.96 772.70 794.65 852.71 857.86 887.60 913.73 971.23 979.19 984.08 1016.34 1043.15 1051.86 1080.88 1126.92 1128.23 1166.33 1168.45 1199.89 1208.97 1213.19 1216.85 1278.85 1291.33 1300.54 1328.23 1335.33 1361.33 1364.46 1390.74 1406.29 1409.22 1434.45 1441.73 1454.18 1473.21 1502.90 1519.15 1530.54 1553.22 1554.06 1567.62 1591.84 1595.55 1606.64 1616.97 1627.03 1628.78 1632.87 1637.09 1640.84 1646.96 1655.51 1657.37 1671.62 1684.08 1703.70 1727.92 1735.29 1757.39 1760.64 1771.79 1792.80 1819.87 1832.42 1846.73 1850.70 1864.14 1873.84 1877.52 1884.62 1903.33 1918.02 1933.15 1942.62 1946.59 1954.21 1969.97 1994.80 2006.91 2033.23 2041.80 2062.37 2064.13 2071.40 2094.84 2098.30 2105.49 2113.81 2119.03 2125.52 2138.15 2143.32 2156.93 2169.55 2192.55 2195.22 2197.48 2212.20 2223.33 2224.65 2248.78 2252.43 2253.62 2255.87 2256.55 2278.67 2295.78 2303.57 2323.80 2333.97 2336.49 2341.64 2349.38 2353.10 2354.52 2357.36 2358.95 2365.70 2365.81 2366.27 2369.91 2371.77 2372.72 2377.87 2379.27 2385.10 2388.37 2397.03 2404.75 2409.68 2448.69 2568.84 2571.24 2607.52 2746.88 2761.51 4495.99 4503.63 4523.27 4568.15 4586.86 4593.25 4598.53 4599.83 4600.11 4615.65 4616.77 4622.05 4637.42 4648.37 4657.09 4660.90 4662.98 4663.61 4676.38 4678.12 4680.87 4691.90 4693.52 4694.54 4694.72 4698.18 4708.53 4724.80 4727.50 4729.14 4729.91 4731.04 4776.64 4807.59 4813.62 4815.69 4817.86 4830.05 4846.74 4858.14 4865.17 4877.29 4882.75 0.740046 0.776012 0.776956 0.663053 -1907.924931 -1907.888966 -1907.888021 -1908.001925 3.820359D-04 MUNgauss RevisionA1.9 retrievium 21-Nov-2019 DUDE CCCC[C@@H](CC)C(=O)N(CCN1CCOCC1)CC(=O)N(Cc2ccccc2)Cc3ccc(s3)C C35798488 RHF 6-31G(d) (6D,10F) C1 513.302487 |X|Y|Z| 82.516816 123.189081 59.435270 84.538195 25 6 7 8 16 20 3 1 1 |36.858105| |12.465312|36.858105| |7.470764|12.447783|36.858105| |4.866767|7.481738|12.444775|36.858105| |3.709827|4.830284|7.368361|12.319316|36.858105| |3.693082|4.573571|7.010190|8.836390|17.574499|0.500000| |3.376773|4.125827|5.872288|7.426318|12.404589|0.247839|36.858105| |2.732456|3.153146|4.153804|4.835742|7.424039|0.192834|12.458532|36.858105| |3.001013|3.809785|4.934345|7.703561|12.487156|0.245429|7.600759|6.186666|36.858105| |2.730564|3.426143|4.181636|6.178938|8.036463|0.164185|6.760081|5.674187|15.815592|73.516695| |2.730279|3.356428|4.144762|5.709042|7.623303|0.202857|5.184036|4.812214|13.946667|15.169628|53.358707| |2.857482|3.436042|4.228675|5.272994|6.409764|0.205907|4.399818|4.123895|7.594599|9.443578|17.788099|36.858105| |2.533869|2.898016|3.549827|4.063846|5.130173|0.176116|3.997857|4.137273|5.536094|7.523134|10.485624|12.456685|36.858105| |2.463124|2.723791|3.219267|3.444525|3.978783|0.134919|3.232874|3.290200|4.023321|5.788335|6.902714|7.698265|13.131287|53.358707| |2.102459|2.271840|2.627157|2.770613|3.187402|0.103917|2.758693|2.919468|3.253417|4.908652|5.353693|5.088994|7.880236|17.830917|36.858105| |1.994513|2.105737|2.364569|2.419651|2.661570|0.085120|2.336581|2.420312|2.664354|4.109629|4.233711|3.914532|5.081678|10.649364|12.535101|36.858105| |2.156677|2.232159|2.503390|2.476131|2.678302|0.086847|2.360974|2.411336|2.577168|3.959479|3.965644|3.664472|4.537115|9.193346|7.915164|13.615033|73.516695| |2.535241|2.636499|2.975217|2.898277|3.075027|0.101773|2.622939|2.596215|2.891832|4.352998|4.451504|4.310216|5.071301|10.643897|6.803744|8.208919|24.210371|36.858105| |2.796574|3.016654|3.598375|3.601185|4.014225|0.141411|3.286731|3.255084|3.711673|5.354121|5.831736|6.102921|7.844488|17.821894|7.996036|6.804290|14.069359|12.531794|36.858105| |2.333165|2.808163|3.253996|4.250448|5.022914|0.131048|3.952461|3.814479|8.018747|12.947692|17.995457|7.716186|5.694328|5.696108|3.495092|2.834716|4.599872|2.814893|3.458100|36.858105| |2.366814|2.883803|3.176527|4.133253|4.305968|0.109833|3.412875|3.130245|6.132779|10.747422|10.550570|5.908211|4.280309|4.765563|2.940081|2.515301|4.151581|2.571378|3.034111|12.407327|36.858105| |2.684433|3.357251|3.622536|4.777008|4.560855|0.116070|3.471290|3.049970|6.009819|9.932224|9.668594|6.094481|4.168755|4.806065|2.883912|2.516941|4.244748|2.697387|3.174678|8.025123|15.829835|73.516695| |2.062434|2.452752|2.627395|3.267921|3.362450|0.086382|2.844457|2.671135|4.459696|8.390754|7.010569|4.227041|3.396119|3.943460|2.544840|2.225600|3.656077|2.217416|2.532878|7.670535|14.029794|15.097133|53.358707| |2.008120|2.372511|2.447531|2.959638|2.892772|0.074480|2.486825|2.299258|3.577589|6.711165|5.316717|3.431988|2.805852|3.399064|2.210895|1.991792|3.317935|2.018467|2.249028|4.967236|7.846259|12.468590|17.733515|36.858105| |1.852788|2.139936|2.182759|2.544903|2.487131|0.065897|2.150139|2.016502|2.957122|5.339646|4.503098|3.105005|2.616281|3.285394|2.168302|1.994280|3.299136|1.993006|2.167087|4.053472|5.650338|9.547384|10.404158|12.557300|36.858105| |1.638500|1.859998|1.888459|2.159896|2.126972|0.056597|1.886758|1.793476|2.481104|4.529340|3.705491|2.566432|2.245185|2.853497|1.928976|1.794259|2.966840|1.766489|1.894055|3.270051|4.142635|6.909916|7.395031|7.540345|13.731630|36.858105| |1.527318|1.707784|1.724355|1.932435|1.902540|0.051329|1.696280|1.623199|2.170609|3.898780|3.251681|2.320485|2.073734|2.697697|1.847667|1.749291|2.888485|1.707605|1.797817|2.786628|3.357959|5.740349|5.522089|5.002433|7.889658|13.716647|36.858105| |1.573603|1.750971|1.762582|1.955655|1.916238|0.052326|1.690548|1.614633|2.160858|3.800080|3.281420|2.414654|2.159677|2.865685|1.957840|1.878094|3.096694|1.836557|1.910081|2.757725|3.292781|5.793479|5.109658|4.421536|6.824487|7.938354|13.781752|36.858105| |1.761041|1.979035|1.995007|2.228032|2.167113|0.059417|1.871995|1.771319|2.453842|4.241039|3.797929|2.848170|2.484663|3.306153|2.210727|2.112827|3.482858|2.096905|2.192517|3.181345|3.915882|7.109805|5.849016|5.010787|7.901525|6.895469|7.953959|13.717375|36.858105| |1.936601|2.225695|2.260333|2.596100|2.515110|0.067982|2.136077|1.997900|2.928308|5.085680|4.576558|3.339361|2.793593|3.602544|2.352198|2.192024|3.620523|2.207287|2.372172|3.958776|5.343470|9.782727|8.213074|7.536604|13.667905|7.962336|6.879461|7.925849|13.779364|36.858105| |1.816155|2.112504|2.279030|2.761711|2.943496|0.076758|2.596349|2.539285|3.829903|7.320438|5.974632|3.644395|3.156434|3.675406|2.462659|2.146124|3.476600|2.059162|2.330999|6.521674|7.643222|9.438916|17.844584|7.701313|6.025588|5.121909|3.936728|3.525232|3.782298|4.784712|36.858105| |1.704599|1.971199|2.110999|2.537391|2.690445|0.069063|2.472104|2.428257|3.413922|6.881534|4.929742|2.991757|2.654731|3.117114|2.117848|1.864526|3.061333|1.803558|2.027862|4.849521|5.360640|7.385788|10.430247|6.131739|4.740156|4.453858|3.462221|3.004863|3.086911|3.723493|12.640531|36.858105| |1.528745|1.740705|1.841252|2.157731|2.263719|0.058790|2.118681|2.097900|2.754323|5.445274|3.937623|2.488151|2.265444|2.725916|1.885407|1.686671|2.773460|1.618929|1.790122|3.644732|3.954535|5.828569|7.148493|4.864200|4.189491|4.344303|3.469638|2.918875|2.868981|3.304504|7.465520|14.164943|36.858105| |1.464765|1.659455|1.749661|2.035117|2.129939|0.054922|2.045513|2.030611|2.540860|5.113832|3.506570|2.214499|2.035654|2.455928|1.705617|1.532291|2.544675|1.483353|1.637405|3.101900|3.282900|5.017027|5.502159|3.857825|3.316298|3.429962|2.847434|2.440114|2.396681|2.712158|5.034630|8.193511|13.251385|36.858105| |1.560986|1.782392|1.891919|2.227332|2.343762|0.059451|2.283508|2.257718|2.818580|5.877528|3.769126|2.322567|2.119142|2.522289|1.736790|1.548543|2.589137|1.517601|1.692557|3.291359|3.432201|5.255644|5.540802|3.783360|3.108861|3.071363|2.553433|2.243834|2.256914|2.588952|4.787148|7.621586|8.198644|14.161767|36.858105| |1.795975|2.095112|2.263154|2.764436|2.955499|0.073535|2.809149|2.740749|3.774815|8.262861|5.026876|2.933621|2.596071|3.002045|2.024999|1.773559|2.957403|1.752083|1.992659|4.623978|4.836495|6.996387|7.873320|4.830487|3.651321|3.367028|2.729251|2.443842|2.544877|3.034213|6.692883|10.951062|7.475808|7.473543|10.957062|388.023441| |1.501749|1.701132|1.797919|2.087864|2.186235|0.055302|2.191924|2.171260|2.547976|5.320461|3.315106|2.066812|1.906510|2.285607|1.580498|1.417684|2.392702|1.400656|1.556548|2.763704|2.831474|4.494236|4.328178|3.023343|2.547068|2.519038|2.155942|1.925255|1.936474|2.185340|3.518486|4.799784|5.034513|7.438608|12.689108|48.001783|36.858105| |17.548601|8.773155|5.453381|4.042777|3.148823|0.086224|2.890104|2.389769|2.659580|4.384229|3.336935|2.551528|2.265934|3.021103|1.917711|1.839129|3.516659|2.301128|2.482608|2.146885|2.215771|4.473365|2.668474|1.941153|1.804673|1.605205|1.502870|1.549577|1.727316|1.886836|1.726884|1.628356|1.471031|1.412501|1.499212|12.144883|1.445706|0.500000| |17.534605|8.771805|6.768376|4.493650|3.590429|0.098811|3.453528|2.802118|2.869030|4.698422|3.500727|2.648299|2.400394|3.153184|2.006812|1.896980|3.645970|2.371755|2.621529|2.202735|2.201075|4.350460|2.631879|1.871443|1.721132|1.534837|1.430476|1.464630|1.624182|1.780853|1.724827|1.635245|1.471981|1.421423|1.521632|12.374753|1.477049|0.301705|0.500000| |17.532389|8.771233|6.766608|4.497421|3.598614|0.103881|3.218375|2.675120|2.918114|4.633693|3.710199|2.948331|2.654714|3.599416|2.246449|2.155761|4.221515|2.841782|3.095509|2.314945|2.324371|4.673629|2.747212|1.953690|1.824928|1.613886|1.515269|1.574222|1.768882|1.930292|1.785245|1.659749|1.490384|1.419612|1.502723|12.283688|1.438011|0.301722|0.301680|0.500000| |8.861084|17.516491|8.861746|6.881884|4.510295|0.112947|4.051161|3.068867|3.686966|6.160136|4.316006|3.114579|2.634035|3.324009|2.071032|1.914349|3.560954|2.317180|2.633606|2.719718|2.832100|5.814047|3.330969|2.393761|2.131029|1.861771|1.697955|1.722269|1.929107|2.178395|2.108239|1.999334|1.769015|1.702552|1.843565|15.358830|1.775058|0.212737|0.210669|0.172923|0.500000| |8.858548|17.516319|8.854717|6.895230|4.525914|0.120614|3.687379|2.905097|3.791988|6.017704|4.724438|3.632785|2.978122|3.854200|2.334818|2.178503|4.085271|2.744353|3.109905|2.938066|3.108254|6.655226|3.572865|2.572387|2.336740|2.007258|1.844129|1.907193|2.183977|2.468369|2.220753|2.044428|1.801111|1.699605|1.810633|15.188429|1.709099|0.212750|0.172907|0.210534|0.304142|0.500000| |6.878945|8.862391|17.481937|8.845544|6.786850|0.211516|5.239978|4.016848|4.662054|6.781853|5.695202|4.607424|3.957023|5.032476|2.948336|2.662873|5.120733|3.533552|4.365723|3.233045|3.096737|6.245944|3.471488|2.359081|2.143449|1.855150|1.710136|1.766400|2.010376|2.256236|2.229049|2.035916|1.781383|1.679515|1.797132|15.217517|1.696948|0.140525|0.169169|0.204026|0.173804|0.211792|0.500000| |6.897112|8.881584|17.531392|8.800119|6.717947|0.176373|6.465398|4.479252|4.464082|6.978776|5.012122|3.661824|3.236921|3.991385|2.462051|2.217320|4.183757|2.735145|3.272484|2.945886|2.821369|5.531716|3.246459|2.218089|1.980679|1.737940|1.591211|1.616072|1.805848|2.027765|2.114073|1.990250|1.749458|1.681574|1.828394|15.379434|1.760627|0.140780|0.204605|0.169573|0.212176|0.173985|0.303977|0.500000| |4.521634|6.836915|8.818996|17.541954|8.861873|0.174538|7.049797|4.563311|6.858155|11.477544|6.716391|4.298866|3.424371|3.981218|2.430587|2.142685|3.866358|2.489748|2.998280|3.973104|3.994348|8.077832|4.438602|3.004752|2.532044|2.164292|1.919340|1.916771|2.158413|2.523389|2.757495|2.603222|2.215888|2.119496|2.354462|20.800959|2.232945|0.108341|0.119208|0.110995|0.206268|0.170976|0.173265|0.210059|0.500000| |4.565935|6.941374|8.889831|17.527223|8.802090|0.204514|5.478100|4.038178|7.446884|10.469430|8.510591|6.013290|4.262163|4.970162|2.875029|2.524001|4.551628|3.035624|3.747626|4.704469|4.855522|10.846825|5.028880|3.367730|2.889714|2.396041|2.133542|2.177629|2.529167|2.999450|3.004576|2.689727|2.269458|2.105180|2.277083|20.264482|2.098007|0.109382|0.111777|0.120269|0.173061|0.210513|0.211737|0.173567|0.305317|0.500000| |3.797597|4.510591|6.634150|6.958793|8.885215|0.212886|17.551851|8.896368|5.543256|8.850641|5.709068|3.834383|3.562399|4.114659|2.600180|2.250945|4.129525|2.595087|3.198849|3.296646|2.945929|5.435134|3.399139|2.237086|1.966277|1.738110|1.578171|1.581181|1.746979|1.970168|2.281803|2.179030|1.898755|1.841607|2.037305|17.361063|1.975283|0.088201|0.111824|0.099857|0.121849|0.106882|0.161735|0.234704|0.181766|0.140135|0.500000| |3.196179|3.942685|5.184610|6.783915|8.884581|0.175007|17.591950|8.858824|7.062684|13.334910|6.439386|3.864399|3.438206|3.842160|2.446237|2.100204|3.742084|2.318025|2.823867|3.848743|3.432541|6.164209|3.970433|2.571464|2.185254|1.924347|1.715170|1.691332|1.860003|2.133958|2.660529|2.596435|2.220690|2.173766|2.471939|21.746938|2.403155|0.077665|0.090976|0.082600|0.113243|0.098281|0.123021|0.156793|0.210776|0.143193|0.303111|0.500000| |2.470732|2.868141|3.646106|4.423486|6.675305|0.169346|8.763588|17.562787|6.833921|11.764984|7.333859|4.312551|4.330932|4.531905|2.984020|2.436103|4.212435|2.520760|3.148598|4.398395|3.448765|5.762252|4.016475|2.477856|2.151715|1.912736|1.718419|1.697686|1.857754|2.108791|2.856967|2.738702|2.335748|2.253860|2.524659|22.242884|2.402280|0.060989|0.069311|0.067246|0.078153|0.075244|0.098156|0.104737|0.117969|0.107614|0.173328|0.211588|0.500000| |2.726689|3.076405|4.077612|4.496235|6.742626|0.206412|8.756236|17.520914|5.473849|8.369979|6.365921|4.319884|4.648946|5.054355|3.307936|2.701304|4.826755|2.914010|3.737119|3.646045|2.971022|5.180881|3.440680|2.181478|1.948246|1.734414|1.585228|1.591556|1.751750|1.958064|2.409706|2.265355|1.971994|1.890710|2.066747|17.623854|1.973302|0.065867|0.077453|0.075902|0.080991|0.079224|0.115561|0.121059|0.112383|0.106967|0.210838|0.172844|0.300785|0.500000| |2.550254|2.869395|3.638210|4.032689|5.440407|0.141723|8.799173|17.549702|4.698089|8.185151|5.179845|3.339238|3.377690|3.817821|2.558495|2.169788|3.862859|2.309266|2.803589|3.193656|2.707045|4.691457|3.234163|2.081186|1.836322|1.654068|1.503607|1.489702|1.618336|1.809209|2.288085|2.233853|1.961644|1.928633|2.151790|18.101926|2.111805|0.062536|0.074001|0.068879|0.078857|0.072778|0.096679|0.112344|0.110015|0.094517|0.214875|0.212229|0.302357|0.301960|0.500000| |2.667229|3.169993|3.677875|4.445308|4.884301|0.147636|3.582686|3.364633|5.828372|8.063454|12.523392|17.627304|8.896000|9.689374|4.905110|3.948819|6.408451|4.216347|5.468798|7.591170|6.566557|12.299370|6.353633|3.802819|3.547080|2.865810|2.600544|2.756213|3.348702|3.974052|3.923521|3.098556|2.581480|2.253851|2.321968|20.713525|2.039784|0.067504|0.067947|0.076577|0.080396|0.095774|0.110122|0.088264|0.104812|0.146745|0.088756|0.090787|0.098199|0.096513|0.078440|0.500000| |3.386019|4.169320|5.324801|6.538827|7.338545|0.252226|4.695100|4.125933|7.187551|8.901050|12.417011|17.680102|8.771218|9.356062|4.550623|3.712345|6.539678|4.566849|6.594465|5.799050|5.058788|10.153247|5.075025|3.185699|2.889014|2.399243|2.183009|2.281822|2.692028|3.128478|3.168195|2.683239|2.264526|2.046595|2.157242|19.085657|1.949603|0.082321|0.085582|0.098183|0.101151|0.123828|0.169245|0.121644|0.136944|0.215524|0.117527|0.112235|0.113706|0.120588|0.093183|0.307540|0.500000| |2.603683|2.959671|3.749935|4.236212|5.764980|0.211475|4.667105|5.107565|5.748117|7.760361|9.480855|8.808609|17.426556|12.237266|6.674719|4.512826|7.559081|4.671960|7.242789|4.994798|3.779126|6.552895|4.163817|2.556361|2.352864|2.046190|1.887041|1.943811|2.201286|2.463763|2.878011|2.503505|2.149259|1.966526|2.072824|17.959531|1.893022|0.063896|0.069707|0.075566|0.074822|0.082135|0.116324|0.097802|0.098801|0.116600|0.114921|0.106819|0.145319|0.171056|0.112175|0.173647|0.208665|0.500000| |2.236446|2.541206|3.029969|3.498142|4.358015|0.138443|3.586527|3.843530|5.050663|7.284218|9.748518|8.946764|17.562980|12.564221|7.648021|4.850213|7.231379|4.239604|5.720978|6.158244|4.378390|7.149575|4.862805|2.880201|2.699413|2.335338|2.154918|2.229378|2.540211|2.848017|3.457818|2.864695|2.438688|2.167373|2.238103|19.517155|1.991024|0.056325|0.059250|0.064370|0.065470|0.072517|0.090918|0.077987|0.085143|0.101705|0.087842|0.088391|0.116916|0.116931|0.088879|0.214066|0.174046|0.303654|0.500000| |2.067359|2.216225|2.592884|2.708517|3.183557|0.104582|2.845612|3.111212|3.179892|4.830437|5.037834|4.528468|6.996373|12.243201|17.414187|8.884770|12.501695|5.876316|7.065963|3.248392|2.704046|4.690133|3.209188|2.050673|1.987661|1.783298|1.701938|1.782955|1.987880|2.119441|2.304428|2.021569|1.806672|1.653756|1.695690|13.986142|1.557823|0.052123|0.055540|0.061226|0.056326|0.062220|0.080629|0.068840|0.066311|0.076136|0.074916|0.069393|0.087665|0.100645|0.076152|0.115552|0.114901|0.193578|0.188892|0.500000| |1.945589|2.118730|2.424736|2.612553|3.007848|0.095007|2.620935|2.794276|3.201183|4.918225|5.386080|4.897001|7.237974|12.471685|17.559264|8.907854|10.171563|5.059263|5.735004|3.706019|3.074467|5.217747|3.674794|2.315681|2.287295|2.042910|1.958820|2.071644|2.329083|2.472271|2.669411|2.267215|2.019310|1.808483|1.826405|15.139955|1.646535|0.049699|0.051626|0.057033|0.054347|0.060703|0.073930|0.063184|0.064669|0.075795|0.067661|0.065632|0.081359|0.086038|0.068317|0.136371|0.115974|0.164202|0.235432|0.300632|0.500000| |1.807364|1.892986|2.110355|2.155151|2.372152|0.074707|2.133552|2.240594|2.382472|3.741599|3.720736|3.287376|4.178643|7.680472|8.843251|17.604466|16.910378|5.892121|5.060308|2.541544|2.260383|3.978573|2.772572|1.831339|1.839296|1.677124|1.644108|1.756463|1.946657|2.000991|1.996089|1.753854|1.602699|1.463051|1.473593|11.862790|1.354662|0.046554|0.048158|0.053941|0.048256|0.054017|0.065152|0.055676|0.053741|0.061831|0.057243|0.053677|0.062854|0.069270|0.056567|0.091656|0.086343|0.107239|0.115603|0.217247|0.210844|0.500000| |1.961437|2.079729|2.296776|2.366532|2.550414|0.080202|2.213887|2.254480|2.595165|4.027033|4.174085|3.878837|4.713519|9.539680|8.881672|17.500362|16.551723|7.292751|5.911240|2.860141|2.597265|4.645396|3.145507|2.084210|2.122584|1.905710|1.874699|2.041274|2.317159|2.374892|2.216592|1.904321|1.725788|1.555195|1.560119|12.693720|1.419532|0.050672|0.051352|0.058760|0.052619|0.060595|0.071342|0.059178|0.058466|0.069783|0.059039|0.055918|0.063427|0.068585|0.056201|0.114296|0.101754|0.111776|0.126990|0.173980|0.217637|0.300174|0.500000| |2.663296|2.689290|3.002490|2.816772|2.928399|0.096400|2.544782|2.495570|2.678245|4.071857|3.983240|3.706361|4.170109|7.679525|5.061688|5.892235|16.913921|17.605633|8.845878|2.517405|2.331695|4.383861|2.758083|1.867481|1.837578|1.638477|1.585491|1.698765|1.925183|2.021035|1.879072|1.668699|1.505824|1.391665|1.428526|11.647086|1.329450|0.066996|0.069428|0.084639|0.065115|0.077016|0.100300|0.077437|0.067425|0.080772|0.071450|0.062470|0.066207|0.077798|0.062405|0.099303|0.112427|0.112125|0.098013|0.131836|0.110711|0.132299|0.147729|0.500000| |2.503108|2.619867|2.879641|2.835283|2.927239|0.094458|2.465699|2.401459|2.814408|4.266021|4.391510|4.281840|4.702430|9.527916|5.906015|7.288227|16.550568|17.501927|8.879290|2.837927|2.661420|5.025359|3.131669|2.115856|2.120524|1.870656|1.821026|1.985496|2.294756|2.394724|2.116435|1.836215|1.649913|1.501555|1.526787|12.528427|1.401435|0.063952|0.064108|0.077703|0.064068|0.077475|0.093746|0.072368|0.068052|0.084623|0.067326|0.061455|0.065434|0.073227|0.059453|0.123167|0.125762|0.114985|0.111873|0.134606|0.132347|0.147701|0.217620|0.300206|0.500000| |3.274782|3.600482|4.359347|4.289760|4.586486|0.164497|3.573830|3.363700|4.087110|5.776978|6.310266|6.820130|7.156812|12.411486|5.725999|5.058359|10.184349|8.932020|17.580882|3.620303|3.261379|6.285032|3.633522|2.389206|2.280818|1.969657|1.856842|1.973836|2.288844|2.508390|2.395449|2.083209|1.827241|1.672581|1.737810|14.663223|1.598608|0.079583|0.083435|0.101998|0.085000|0.104657|0.154111|0.105799|0.095886|0.126716|0.097323|0.084954|0.089210|0.105011|0.079821|0.167055|0.238163|0.183640|0.143364|0.143159|0.127658|0.110689|0.132363|0.211798|0.217877|0.500000| |2.784114|2.960593|3.615220|3.545910|4.089751|0.147612|3.492544|3.563947|3.640441|5.287768|5.463255|5.259928|6.981712|12.268083|7.084612|5.884701|12.510179|8.881446|17.410371|3.218219|2.782655|5.106925|3.196210|2.083473|1.986983|1.754031|1.660400|1.744487|1.973957|2.135326|2.189319|1.938387|1.717438|1.587735|1.652138|13.764792|1.533669|0.067974|0.074122|0.085417|0.072146|0.082313|0.121942|0.094509|0.082452|0.098244|0.095920|0.081683|0.093587|0.118472|0.085441|0.125418|0.156758|0.213632|0.146603|0.208295|0.143549|0.131942|0.134807|0.217119|0.173921|0.300908|0.500000| |2.151629|2.526524|2.893234|3.583116|4.183633|0.115509|3.399886|3.404628|5.845640|9.321455|12.565469|7.431991|6.180085|6.266337|3.937225|3.136628|4.924215|2.957584|3.592535|17.564583|8.879391|11.314646|9.136197|4.535868|4.003807|3.284088|2.863010|2.875009|3.322576|4.030736|6.406161|4.543467|3.542629|2.959755|3.037722|28.702838|2.547776|0.055260|0.056457|0.060088|0.067301|0.073660|0.081780|0.073262|0.092011|0.109477|0.080965|0.090389|0.107953|0.093490|0.080396|0.223630|0.148586|0.141378|0.206676|0.099163|0.121220|0.078052|0.088863|0.072091|0.083348|0.101109|0.091473|0.500000| |2.185647|2.607487|3.017339|3.909162|4.724040|0.119606|4.008997|4.002690|7.534000|14.481833|12.572399|5.715894|4.762818|4.871037|3.124022|2.553405|4.163314|2.502589|3.030596|17.685700|8.796317|10.780473|9.552749|4.624004|3.699712|3.103769|2.630442|2.542617|2.840143|3.459922|6.874888|5.571376|4.045850|3.490306|3.815163|40.482568|3.162970|0.056009|0.058138|0.059707|0.071374|0.074316|0.081882|0.077923|0.105472|0.114398|0.091331|0.111844|0.134461|0.102950|0.094168|0.149457|0.128461|0.124308|0.145930|0.083047|0.092299|0.064840|0.070685|0.063016|0.069204|0.086894|0.080654|0.302403|0.500000| |1.874730|2.195660|2.256070|2.702382|2.654541|0.067877|2.350979|2.189234|3.242486|6.284637|4.646261|2.967774|2.497883|3.030558|2.002692|1.810498|3.026269|1.824663|2.022810|4.254397|5.941992|9.381989|12.541605|17.599519|8.901035|7.314442|4.775543|3.982133|4.189670|5.593680|7.278608|7.080164|5.827890|4.619179|4.464516|39.141745|3.466989|0.050552|0.048989|0.050355|0.062329|0.065203|0.059920|0.057643|0.077696|0.083161|0.058880|0.068512|0.065725|0.057220|0.055752|0.088705|0.077088|0.064397|0.071545|0.052219|0.058250|0.046690|0.052240|0.047238|0.052693|0.059282|0.052721|0.107965|0.116942|0.500000| |2.215727|2.663173|2.702573|3.300936|3.100185|0.078862|2.625368|2.363932|3.773425|7.033201|5.444540|3.538107|2.817576|3.423924|2.191309|1.982650|3.349072|2.066129|2.309442|4.768472|7.686525|14.754908|12.596390|17.686105|8.880355|5.825426|4.275719|3.977295|4.645810|6.857583|5.692982|4.856639|3.954371|3.347369|3.404378|30.798254|2.835979|0.059699|0.056827|0.059397|0.075156|0.081387|0.071507|0.067144|0.094051|0.106821|0.065939|0.075751|0.069777|0.062084|0.059296|0.108009|0.094085|0.071725|0.078309|0.056541|0.062746|0.050329|0.057494|0.053469|0.060270|0.069333|0.059339|0.116824|0.120846|0.303103|0.500000| |1.573922|1.784949|1.815203|2.080202|2.058617|0.054335|1.853771|1.768548|2.405916|4.481921|3.524251|2.392821|2.111349|2.659649|1.809117|1.675636|2.778957|1.647367|1.773073|3.114020|3.858780|6.317180|7.025990|7.000447|8.921497|17.693577|8.918675|5.649903|4.961818|5.652108|5.177467|4.954810|5.141332|4.021426|3.483527|26.136028|2.809392|0.042843|0.041229|0.042826|0.050062|0.052985|0.049173|0.046795|0.058596|0.063261|0.047350|0.053024|0.052609|0.047164|0.045601|0.072669|0.062215|0.054134|0.061175|0.046938|0.053171|0.043754|0.048967|0.042645|0.048004|0.051094|0.046072|0.085634|0.084668|0.224966|0.149817|0.500000| |1.410146|1.563855|1.576844|1.752984|1.731778|0.046748|1.564376|1.506053|1.958692|3.538328|2.900324|2.065496|1.874796|2.446700|1.695120|1.612749|2.668402|1.565624|1.639531|2.459318|2.876689|4.899560|4.668935|4.084701|5.628023|8.909321|17.710305|8.918484|5.648190|4.954829|3.451846|3.177299|3.315028|2.777650|2.453401|18.039879|2.092215|0.038637|0.036881|0.038830|0.043333|0.046570|0.043395|0.040730|0.048569|0.053152|0.040579|0.044040|0.044250|0.040847|0.039025|0.063375|0.054162|0.047828|0.054214|0.043683|0.049904|0.042447|0.047794|0.040571|0.046136|0.046793|0.042367|0.070139|0.065563|0.113668|0.098853|0.215579|0.500000| |1.476759|1.624210|1.629915|1.784242|1.750372|0.048112|1.556442|1.493956|1.946045|3.409213|2.938299|2.187106|1.991463|2.680697|1.854148|1.803977|2.979217|1.753856|1.798793|2.424212|2.804432|4.959047|4.237603|3.538297|4.926414|5.642169|8.916689|17.712793|8.895649|5.640131|2.983479|2.601367|2.563610|2.186611|2.012951|15.352495|1.751784|0.040520|0.038262|0.041197|0.044279|0.048978|0.045574|0.041707|0.048475|0.054752|0.040699|0.043119|0.043441|0.041099|0.038469|0.068769|0.057757|0.050014|0.057023|0.046974|0.054416|0.047186|0.054650|0.045222|0.052769|0.051327|0.045727|0.070551|0.062489|0.090618|0.090538|0.124176|0.214713|0.500000| |1.784571|1.987051|1.995888|2.194815|2.127198|0.059073|1.830942|1.732851|2.365194|4.021640|3.674284|2.845792|2.506456|3.421322|2.287696|2.226415|3.678341|2.221958|2.283260|2.985204|3.552471|6.608273|5.024235|4.089204|5.631145|4.963088|5.652582|8.904689|17.709819|8.935653|3.267277|2.696163|2.503258|2.131119|2.029238|16.249046|1.766456|0.048684|0.045518|0.050248|0.053256|0.061240|0.056492|0.050032|0.058399|0.069322|0.047813|0.050081|0.050098|0.048021|0.043952|0.093731|0.075502|0.061339|0.070480|0.056631|0.066535|0.056737|0.068801|0.056567|0.068609|0.066188|0.056544|0.087342|0.073410|0.096310|0.109657|0.107664|0.124135|0.214596|0.500000| |2.156985|2.512845|2.560774|2.969676|2.843440|0.077159|2.351626|2.171612|3.314933|5.610474|5.285302|3.954270|3.173910|4.085114|2.590956|2.398481|3.981242|2.473535|2.689755|4.465504|6.242522|12.565545|8.440164|7.017750|8.916747|5.659991|4.955692|5.639249|8.920641|17.720803|4.606185|3.551771|3.065420|2.561865|2.507270|21.424326|2.138619|0.058024|0.054558|0.059943|0.067554|0.078593|0.071402|0.062801|0.078894|0.097977|0.060153|0.064696|0.063338|0.059325|0.054061|0.135472|0.103606|0.076644|0.088169|0.064265|0.074843|0.059914|0.072346|0.062575|0.075154|0.080323|0.066343|0.124599|0.103925|0.141188|0.198376|0.124285|0.107561|0.124040|0.215400|0.500000| |1.697203|1.948467|2.076183|2.455650|2.582178|0.068540|2.288755|2.248025|3.225663|5.988259|5.054796|3.274352|2.902833|3.490066|2.375605|2.105995|3.389932|1.992171|2.212286|5.131457|5.971503|8.121796|12.501395|7.148534|6.792245|6.193228|4.733571|4.122609|4.286821|5.270123|17.564632|9.034203|7.191167|4.696375|4.172235|36.310356|3.145371|0.045114|0.044689|0.046600|0.053783|0.057189|0.056907|0.053520|0.067639|0.074398|0.056780|0.064577|0.069247|0.060066|0.056745|0.100198|0.079830|0.072908|0.088535|0.061263|0.072117|0.054712|0.061134|0.050429|0.057384|0.062713|0.057372|0.150437|0.142329|0.187566|0.143703|0.170436|0.114054|0.095476|0.100181|0.132109|0.500000| |1.824776|2.115854|2.327800|2.824616|3.124205|0.082467|2.755649|2.764164|4.146718|7.772425|6.744112|4.034375|3.587132|4.068183|2.745816|2.338526|3.738209|2.196589|2.518819|7.877993|7.335359|8.941226|12.462848|5.639051|4.750292|4.102784|3.374025|3.141960|3.405518|4.152243|17.659704|8.948495|6.014172|4.426565|4.337616|42.874236|3.307850|0.047797|0.048340|0.050131|0.058134|0.061306|0.063854|0.060252|0.077125|0.084388|0.066590|0.077337|0.088062|0.073339|0.068522|0.118894|0.094160|0.090377|0.113296|0.071499|0.084048|0.060441|0.066590|0.055201|0.062165|0.070959|0.065936|0.234068|0.243974|0.145028|0.128071|0.112861|0.083467|0.075675|0.084491|0.115317|0.305534|0.500000| 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