Version2.0 2020-02-12T07:14:07Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 14-Oct-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE C[C@H](CCCC(C)C)[C@@H]1CC[C@H]2[C@@]1(CC[C@@H]3[C@H]2C[C@H]([C@@]4([C@@]3(CCC[C@@H]4O)C)NC(=O)C)OC(=O)C)C C13423869 RHF 6-31G(d) (6D,7F) C[C@H](CCCC(C)C)[C@@H]1CC[C@H]2[C@@]1(CC[C@@H]3[C@H]2C[C@H]([C@@]4([C@@]3(CCC[C@@H]4O)C)NC(=O)C)OC(=O)C)C C01[X(C31H53N1O4)] 261 C1 646 CC(CCC[C@H]([C@@H]1CC[C@H]2[C@]1(C)CC[C@@H]1[C@H]2C[C@H]([C@@]2([C@]1(C)CCC[C@@H]2O)NC(=O)C)OC(=O)C)C)C CC(CCC[C@H]([C@@H]1CC[C@H]2[C@]1(C)CC[C@@H]1[C@H]2C[C@H]([C@@]2([C@]1(C)CCC[C@@H]2O)NC(=O)C)OC(=O)C)C)C CC(C)CCC[C@@H](C)[C@@H]1CC[C@@H]2[C@@H]3C[C@@H](OC(C)=O)[C@@]4(NC(C)=O)[C@@H](O)CCC[C@]4(C)[C@@H]3CC[C@]12C InChIKey=SBDUIAXWXJSRFV-VPEPXGIPSA-N InChI=1S/C31H53NO4/c1-19(2)10-8-11-20(3)24-13-14-25-23-18-28(36-22(5)34)31(32-21(4)33)27(35)12-9-16-30(31,7)26(23)15-17-29(24,25)6/h19-20,23-28,35H,8-18H2,1-7H3,(H,32,33)/t20-,23+,24+,25-,26-,27+,28-,29-,30-,31+/m1/s1 InChI=1/C31H53NO4/c1-19(2)10-8-11-20(3)24-13-14-25-23-18-28(36-22(5)34)31(32-21(4)33)27(35)12-9-16-30(31,7)26(23)15-17-29(24,25)6/h19-20,23-28,35H,8-18H2,1-7H3,(H,32,33)/t20-,23+,24+,25-,26-,27+,28-,29-,30-,31+/m1/s1/f/h32H C[C@H](CCCC(C)C)[C@@H]1CC[C@H]2[C@@]1(CC[C@@H]3[C@H]2C[C@H]([C@@]4([C@@]3(CCC[C@@H]4O)C)NC(=O)C)OC(=O)C)C C01[X(C31H53N1O4)] 261 C01 646 CC(CCC[C@H]([C@@H]1CC[C@H]2[C@]1(C)CC[C@@H]1[C@H]2C[C@H]([C@@]2([C@]1(C)CCC[C@@H]2O)NC(=O)C)OC(=O)C)C)C CC(CCC[C@H]([C@@H]1CC[C@H]2[C@]1(C)CC[C@@H]1[C@H]2C[C@H]([C@@]2([C@]1(C)CCC[C@@H]2O)NC(=O)C)OC(=O)C)C)C CC(C)CCC[C@@H](C)[C@@H]1CC[C@@H]2[C@@H]3C[C@@H](OC(C)=O)[C@@]4(NC(C)=O)[C@@H](O)CCC[C@]4(C)[C@@H]3CC[C@]12C InChIKey=SBDUIAXWXJSRFV-VPEPXGIPSA-N 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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 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 10461.3163 29195.8870 32474.5031 0.99994 0.00860 0.00688 -0.00855 0.99993 -0.00764 -0.00694 0.00759 0.99995 1 0.00828 0.00297 0.00267 0.17252 0.06181 0.05557 18.74 29.84 37.89 40.87 60.97 70.74 82.08 96.07 100.58 116.22 138.54 148.33 159.98 165.59 171.44 179.50 188.98 213.38 256.94 277.36 300.40 302.34 314.33 325.01 330.98 346.50 347.24 356.25 373.44 385.40 397.14 410.10 426.32 436.15 451.07 459.95 480.58 495.82 504.10 519.51 530.18 544.03 561.69 570.86 580.19 608.52 620.94 633.08 666.04 673.22 691.44 709.79 722.35 732.64 737.94 755.78 764.13 781.04 808.35 816.97 838.22 865.75 875.16 917.59 936.18 939.45 964.32 995.62 1004.83 1030.70 1062.16 1105.35 1139.10 1140.98 1159.42 1228.14 1242.43 1274.33 1286.24 1301.16 1307.13 1351.56 1359.63 1364.34 1402.84 1404.07 1421.37 1448.06 1451.73 1461.62 1472.97 1477.15 1493.95 1502.72 1505.88 1518.65 1525.35 1529.43 1532.91 1557.80 1563.17 1578.12 1582.80 1594.06 1602.00 1611.17 1618.00 1621.53 1629.11 1634.30 1643.50 1661.23 1677.12 1678.49 1691.39 1697.28 1704.02 1715.49 1724.41 1729.18 1763.27 1771.33 1783.56 1790.63 1811.61 1821.23 1847.24 1863.28 1869.39 1873.40 1878.96 1894.93 1908.62 1912.41 1929.85 1933.04 1943.28 1970.67 1979.17 1998.51 2028.12 2037.13 2040.67 2049.19 2051.48 2063.37 2067.20 2081.48 2095.96 2098.12 2113.34 2118.75 2124.51 2137.65 2142.78 2148.73 2158.99 2161.71 2165.57 2167.24 2176.52 2184.54 2193.03 2199.57 2203.23 2212.54 2221.19 2233.29 2236.22 2237.78 2243.64 2247.41 2248.17 2254.65 2258.52 2260.03 2265.28 2267.01 2279.53 2315.57 2319.97 2321.09 2332.94 2343.77 2348.09 2352.48 2354.78 2356.96 2360.76 2362.97 2366.08 2366.99 2369.24 2373.91 2374.53 2377.58 2378.74 2382.86 2385.87 2388.87 2394.27 2397.70 2402.87 2406.00 2432.59 2460.12 2806.85 2854.48 4559.04 4562.04 4567.90 4571.57 4575.79 4587.66 4592.18 4595.23 4596.17 4602.99 4606.27 4609.62 4610.07 4615.43 4617.55 4622.34 4626.74 4627.41 4631.34 4639.29 4647.05 4647.08 4656.24 4659.40 4662.14 4673.96 4676.64 4681.95 4687.10 4687.87 4690.28 4691.14 4692.58 4700.54 4701.82 4705.26 4710.13 4713.08 4714.40 4720.17 4721.49 4732.45 4737.75 4738.48 4741.90 4764.74 4792.15 4804.68 4816.03 4850.37 4873.91 5696.68 5913.41 0.869298 0.905156 0.906100 0.800985 -1557.819511 -1557.783654 -1557.782709 -1557.887824 3.525574D-04 MUNgauss RevisionA2.0 retrievium 12-Feb-2020 DUDE C[C@H](CCCC(C)C)[C@@H]1CC[C@H]2[C@@]1(CC[C@@H]3[C@H]2C[C@H]([C@@]4([C@@]3(CCC[C@@H]4O)C)NC(=O)C)OC(=O)C)C C13423869 RHF 6-31G(d) (6D,10F) C1 503.397460 |X|Y|Z| 64.263437 121.063532 47.709298 71.866546 17 6 17 |36.858105| |12.389198|36.858105| |8.939040|17.522215|0.500000| |7.594610|12.325262|0.245682|36.858105| |5.876248|7.353319|0.198422|12.433157|36.858105| |4.184025|4.826897|0.127540|7.480301|12.437848|36.858105| |3.346312|3.676520|0.102641|4.832042|7.347525|12.396156|36.858105| |2.722406|2.956818|0.081161|3.770884|4.862877|7.563755|12.434824|36.858105| |3.328517|3.404926|0.095618|4.155232|6.047875|7.456378|12.431567|7.576777|36.858105| |7.457556|12.295898|0.244441|7.461736|4.876309|3.753423|2.965387|2.524126|2.715470|36.858105| |6.600769|9.030614|0.176465|7.386190|4.653081|3.793903|2.937494|2.554043|2.670232|17.518174|0.500000| |6.539486|7.298070|0.174953|4.851677|3.671132|2.947649|2.451976|2.124666|2.326639|12.338250|0.249733|36.858105| |4.320946|4.974480|0.129005|3.819524|3.025137|2.542800|2.161424|1.917671|2.027117|7.817861|0.184680|12.469292|36.858105| |3.969072|5.036530|0.140102|3.991815|3.211815|2.689374|2.294323|2.028045|2.106836|7.572001|0.167498|7.894535|12.412196|36.858105| 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|2.323203|2.462231|0.077516|2.136006|2.101952|1.824087|1.749918|1.552257|1.718504|2.466492|0.060150|2.605391|2.639183|2.901110|0.074518|2.611581|2.794725|3.560153|4.022907|0.095016|3.774815|0.101987|4.526470|6.729376|0.204277|8.931068|5.434834|4.879963|5.494453|8.918766|17.633211|0.500000| |2.064852|2.225275|0.068282|1.960915|1.893351|1.673305|1.593878|1.437986|1.540967|2.320341|0.057403|2.454466|2.623386|2.938970|0.078759|2.551976|2.699060|3.339711|4.125738|0.102898|3.866821|0.113295|4.198557|6.145509|0.158075|7.626516|5.985382|5.136970|6.184475|7.998432|13.539598|0.261067|73.516695| |2.321388|2.657298|0.081039|2.351461|2.196012|1.937677|1.799521|1.626923|1.683291|2.928685|0.071821|2.993115|3.426939|4.335254|0.123186|3.569586|3.874399|4.861036|7.640939|0.212759|6.157215|0.195542|5.103905|5.980504|0.127276|7.314510|12.258189|7.717564|6.356913|5.247767|6.036906|0.127241|11.262392|36.858105| |3.160526|3.533999|0.119779|2.947949|2.899799|2.400361|2.259298|1.941367|2.185187|3.431583|0.079783|3.477404|3.372652|3.927771|0.095229|3.680378|4.193156|6.186527|6.300880|0.131494|5.349304|0.126429|6.566056|7.900809|0.202343|12.845343|7.730447|6.554281|5.477991|6.550929|7.923093|0.210200|9.163186|4.926112|53.358707| |3.204315|3.382904|0.113671|2.816177|2.828825|2.336504|2.226693|1.902669|2.214979|3.160715|0.074468|3.266316|3.044846|3.329036|0.080746|3.184018|3.481898|4.625568|4.470429|0.099744|4.196302|0.101878|5.417204|6.302558|0.194938|7.455724|5.023023|4.555936|4.210669|5.284851|6.241478|0.200243|7.774173|3.723108|19.131938|36.858105| |2.953574|3.002506|0.096908|2.505556|2.487021|2.088283|1.991489|1.724056|2.002388|2.864968|0.068582|3.077089|2.896563|3.047289|0.074702|2.837781|2.974932|3.739245|3.797722|0.087160|3.794968|0.095768|5.076614|6.313482|0.228770|6.426180|4.286783|3.796117|3.693398|4.752098|6.038595|0.219329|7.959727|3.431494|11.443959|15.850897|73.516695| |3.402694|3.547712|0.121792|3.030314|3.205858|2.613589|2.542911|2.125084|2.579344|3.104421|0.073899|3.067679|2.756200|2.985948|0.072704|3.036060|3.396413|4.324758|3.794163|0.087923|3.499196|0.084456|4.178210|4.324410|0.127720|4.935640|3.968395|3.900867|3.575117|4.184491|4.350737|0.132346|5.890863|3.039782|10.731087|12.550519|14.280692|36.858105| |2.588322|2.793439|0.084146|2.337254|2.146055|1.854716|1.706740|1.527286|1.642953|3.108451|0.075166|3.572338|4.095911|4.464556|0.115786|3.420420|3.308405|3.977602|5.351535|0.126531|6.583052|0.216574|8.078729|13.276021|0.259442|7.631078|6.190641|4.217716|3.891971|4.187313|6.040470|0.150782|11.468536|6.489937|6.968776|4.335141|7.983068|3.273609|73.516695| |2.278423|2.391448|0.071163|2.037365|1.894764|1.659285|1.543208|1.391612|1.500204|2.608283|0.064536|2.991201|3.340305|3.462920|0.091689|2.784068|2.694915|3.141955|3.927668|0.097168|4.542850|0.144061|5.442261|7.923317|0.213094|5.634685|4.562208|3.477727|3.433919|3.826984|5.431351|0.145388|11.516207|4.940486|5.663488|3.797483|7.405914|2.925645|25.701388|36.858105| |2.203026|2.271033|0.067989|1.942618|1.834475|1.607485|1.509344|1.358730|1.482483|2.408277|0.059752|2.736926|2.927501|2.996276|0.078364|2.509662|2.464069|2.885675|3.435249|0.084504|3.809576|0.113623|4.716275|6.899110|0.222043|5.295170|4.032707|3.246844|3.319982|3.914501|5.638270|0.166860|11.639254|4.112875|5.654846|4.023206|8.351087|3.056684|15.236676|15.973523|73.516695| |2.036081|2.136756|0.062272|1.854880|1.714845|1.524901|1.416934|1.292841|1.371780|2.367858|0.059912|2.702230|3.112649|3.177228|0.087770|2.548067|2.428216|2.717925|3.373865|0.087986|3.899624|0.129433|4.209885|5.145477|0.134494|4.114325|3.752472|2.982419|2.955236|3.128066|4.023747|0.105739|8.759030|4.396662|4.366784|2.937263|5.573422|2.389907|14.525074|12.661057|14.179918|36.858105| |3.834972|5.159405|0.129257|4.958447|3.710179|3.267955|2.653026|2.393324|2.325292|7.549793|0.221951|5.478757|6.037650|7.583847|0.215023|12.326465|7.700605|4.959095|4.559340|0.135158|4.892239|0.119764|3.789009|2.995785|0.073877|2.885961|3.317868|2.936467|2.385236|2.212893|2.347959|0.060879|3.910728|3.064816|3.911046|2.539292|4.107818|2.454040|5.032759|2.385051|3.828901|2.264119|36.858105| |17.586936|8.684830|0.215514|5.488935|4.597689|3.439715|2.890116|2.393987|2.916322|6.626299|0.155275|7.101895|4.562020|4.047329|0.092018|4.467289|3.915174|3.816803|3.316676|0.081090|3.757421|0.088604|4.283754|3.357531|0.093832|3.013358|2.824619|2.497727|2.170208|2.248007|2.482666|0.070075|3.924020|2.416445|4.651912|3.550506|5.934750|3.681643|5.054530|2.505930|4.334847|2.207362|3.529894|0.500000| |17.562171|8.755734|0.210600|7.105026|6.593504|4.599286|3.743703|2.958737|3.897103|5.444913|0.139237|4.790489|3.488523|3.319955|0.078674|3.925464|3.706393|3.500801|2.910990|0.073046|3.073420|0.073515|3.296437|2.736955|0.075878|2.605050|2.508007|2.322868|2.025817|2.071725|2.204957|0.061964|3.478395|2.147457|4.092024|3.120022|5.095482|3.466042|4.181153|2.098619|3.655608|1.874376|3.287797|0.303420|0.500000| |17.528427|8.754338|0.173880|6.758621|5.055670|3.927950|3.118408|2.618000|3.092186|6.882519|0.195877|6.277571|4.232569|3.715785|0.087815|4.385192|3.713588|3.324148|2.887200|0.073754|3.209622|0.077680|3.350913|2.694578|0.073644|2.479402|2.431187|2.197026|1.911855|1.933084|2.087439|0.058033|3.370800|2.141141|3.705877|2.740088|4.578692|2.856254|4.245806|2.126188|3.638393|1.935524|3.790416|0.301801|0.302352|0.500000| |5.556062|8.752030|0.198741|17.572686|8.917737|6.912686|4.574480|3.752168|3.730264|7.267241|0.208386|4.590599|3.873721|4.250517|0.105102|6.481745|6.595655|4.669395|3.590061|0.096912|3.528472|0.083579|3.200813|2.626420|0.067913|2.628995|2.833904|2.688016|2.223439|2.120336|2.184958|0.058335|3.502145|2.451636|3.921108|2.677153|4.223899|2.822244|4.158495|2.026522|3.400567|1.862605|6.123905|0.122779|0.141569|0.144393|0.500000| |7.377182|8.852980|0.175297|17.491472|8.844810|6.933711|4.507185|3.683486|4.003214|6.476708|0.204035|4.559393|3.591146|3.563383|0.087670|4.784003|4.401615|3.568254|2.922981|0.077452|3.014948|0.072874|2.903185|2.399149|0.063752|2.335201|2.411403|2.266400|1.937235|1.896181|1.976863|0.053833|3.187543|2.117786|3.496285|2.489555|4.026115|2.655468|3.814498|1.895835|3.219845|1.745782|4.519651|0.145309|0.193465|0.214338|0.306032|0.500000| |6.510904|6.807179|0.186614|8.828730|17.557903|8.832817|6.635098|4.436779|6.666662|4.436585|0.116661|3.557082|2.874786|2.963068|0.072627|3.681290|3.893150|3.589139|2.831710|0.072801|2.773973|0.066695|2.813874|2.427729|0.065975|2.451218|2.450530|2.387033|2.065061|2.061433|2.106033|0.058302|3.303415|2.082781|3.896352|2.886528|4.555089|3.350431|3.736345|1.873650|3.258998|1.686688|3.220075|0.140758|0.235630|0.150767|0.174252|0.209135|0.500000| |5.113405|6.706980|0.211340|8.859400|17.484513|8.854206|6.845156|4.578016|5.547756|4.665829|0.117847|3.564339|3.012229|3.322359|0.081725|4.312520|5.169906|4.681925|3.410388|0.088078|3.147541|0.074438|3.064232|2.647723|0.070137|2.778237|2.882990|2.880138|2.410185|2.343920|2.347998|0.063691|3.639613|2.390459|4.464956|3.152860|4.799035|3.645578|4.040913|1.991542|3.430698|1.786351|3.692024|0.118915|0.153840|0.119007|0.214349|0.173665|0.304201|0.500000| |3.761641|4.549574|0.119751|7.030862|8.893517|17.501117|8.884918|7.163874|5.481862|3.774833|0.107663|2.914325|2.580415|2.781996|0.072095|3.596139|3.980342|3.311450|2.655400|0.072721|2.509185|0.061853|2.354556|2.062736|0.054459|2.127721|2.265400|2.272694|1.948778|1.858309|1.852644|0.049899|2.978705|1.990314|3.205235|2.246912|3.567185|2.462101|3.302347|1.654900|2.828370|1.531528|3.586870|0.087424|0.109026|0.099660|0.214112|0.178325|0.174017|0.209925|0.500000| |4.167155|4.504158|0.113696|6.790630|8.849776|17.485388|8.845313|6.865137|6.841044|3.585117|0.104255|2.870756|2.461595|2.532357|0.064898|3.158884|3.270105|2.835873|2.341541|0.063021|2.290725|0.056796|2.222761|1.947064|0.052312|1.966528|2.031473|2.004668|1.753124|1.709479|1.726104|0.047189|2.782794|1.795888|2.974384|2.147108|3.466257|2.374342|3.117100|1.579951|2.723179|1.461349|3.093749|0.094199|0.128104|0.113993|0.168592|0.206384|0.213441|0.173656|0.304115|0.500000| |3.204824|3.621015|0.105263|4.567043|6.849488|8.909691|17.483460|8.931283|8.919690|2.943374|0.079215|2.437399|2.172688|2.352922|0.060719|2.846001|3.291034|3.078468|2.467496|0.066191|2.264081|0.056047|2.201087|2.003540|0.053737|2.129237|2.214520|2.309127|2.023605|1.954796|1.898848|0.051711|3.002645|1.912828|3.317202|2.382524|3.736187|2.751589|3.159968|1.601107|2.785752|1.462865|2.673131|0.078372|0.098069|0.081288|0.123517|0.112614|0.167163|0.209319|0.212933|0.174259|0.500000| |2.687831|2.847893|0.076466|3.628995|4.471372|6.828758|8.768381|17.521825|6.837479|2.450354|0.070017|2.079113|1.870016|1.946444|0.051241|2.309069|2.459268|2.226301|1.896911|0.051854|1.816599|0.046071|1.761330|1.600417|0.043187|1.646782|1.706742|1.734777|1.554208|1.507304|1.489241|0.040719|2.421530|1.534164|2.465983|1.785154|2.904596|1.977226|2.598860|1.337449|2.321470|1.248001|2.309627|0.065387|0.081274|0.073320|0.099000|0.102937|0.116701|0.111617|0.175783|0.203242|0.173632|0.500000| |2.430002|2.602606|0.072547|3.175605|4.014196|5.485054|8.758242|17.541707|6.933850|2.245747|0.062547|1.927997|1.754357|1.855705|0.048957|2.171561|2.386996|2.225226|1.890473|0.051633|1.772884|0.045018|1.723595|1.592127|0.043000|1.668502|1.730255|1.797395|1.621618|1.568696|1.524745|0.041674|2.465626|1.546801|2.518685|1.824110|2.946799|2.047154|2.574983|1.327675|2.315577|1.233661|2.135152|0.060453|0.073443|0.064664|0.087426|0.085670|0.105519|0.109058|0.144331|0.140181|0.213359|0.301635|0.500000| |2.610565|2.911395|0.079749|3.733767|4.575212|6.916541|8.751908|17.541526|5.490735|2.548203|0.072025|2.125495|1.945709|2.081829|0.055257|2.502342|2.768581|2.476712|2.082797|0.057643|1.947137|0.049277|1.850948|1.685228|0.044960|1.761888|1.863619|1.924984|1.705736|1.625857|1.587829|0.042949|2.576585|1.669979|2.631600|1.868312|3.003612|2.058285|2.736537|1.397830|2.412708|1.304487|2.526115|0.063963|0.076913|0.070022|0.108111|0.100335|0.110915|0.122570|0.216728|0.169464|0.213352|0.301522|0.301591|0.500000| |3.746111|3.758511|0.108183|4.408885|6.636748|6.694819|8.714804|5.485795|17.566587|2.901240|0.077640|2.501268|2.147109|2.227294|0.056380|2.613145|2.837332|2.749513|2.261157|0.059035|2.161560|0.053491|2.202789|2.003015|0.055141|2.072531|2.059110|2.083678|1.864211|1.869519|1.857501|0.051839|2.926345|1.777410|3.284629|2.482577|3.964620|2.964722|3.127502|1.602966|2.828532|1.452107|2.382952|0.091520|0.126337|0.093672|0.106126|0.114857|0.229282|0.173652|0.137652|0.166365|0.213669|0.139068|0.141791|0.122383|0.500000| |2.828706|2.887626|0.082095|3.391485|4.598500|5.449069|8.779192|7.005483|17.541864|2.373929|0.064674|2.072252|1.834422|1.912052|0.049397|2.212478|2.409750|2.325936|1.959618|0.052122|1.857574|0.046727|1.865436|1.725688|0.047356|1.799711|1.810270|1.862434|1.690368|1.678211|1.644002|0.045665|2.621907|1.591099|2.791515|2.086442|3.367940|2.433482|2.742310|1.418024|2.501830|1.299297|2.083951|0.070627|0.090182|0.073375|0.086970|0.090701|0.136943|0.124162|0.123254|0.140428|0.212164|0.171968|0.211426|0.142201|0.302534|0.500000| |3.322122|3.282560|0.089330|4.012158|5.435863|6.793602|8.770888|6.792777|17.517880|2.645591|0.073614|2.286736|1.983281|2.026162|0.052031|2.375160|2.501398|2.347469|1.981537|0.052651|1.923402|0.048243|1.932738|1.752826|0.048100|1.788789|1.796765|1.805145|1.624955|1.616249|1.613393|0.044833|2.588239|1.586973|2.750479|2.054814|3.346565|2.353953|2.793619|1.441215|2.530375|1.325021|2.253765|0.080283|0.108693|0.088214|0.098992|0.113256|0.170482|0.130245|0.140584|0.204086|0.173564|0.200611|0.168299|0.139037|0.301495|0.301666|0.500000| |6.768778|6.989909|0.188118|4.502868|3.620766|2.856741|2.428927|2.081589|2.345373|8.741119|0.176758|17.606104|8.851089|6.809100|0.138053|6.285898|4.814024|4.780025|4.545402|0.107483|6.103181|0.136559|7.304435|4.711982|0.124299|3.842981|3.637034|2.966634|2.511205|2.573938|2.973066|0.081744|4.760931|3.124391|5.502963|3.881279|6.530725|3.577534|7.065647|3.302532|5.446931|2.875892|4.442344|0.235772|0.140348|0.164238|0.114919|0.114706|0.100239|0.099866|0.077104|0.076489|0.067706|0.056238|0.052934|0.057320|0.071210|0.058281|0.063538|0.500000| |6.568454|6.221968|0.143296|4.474090|3.424443|2.816471|2.346583|2.053162|2.258191|8.684951|0.227596|17.560289|8.716258|5.638417|0.126469|5.613745|4.048121|3.654707|3.491738|0.088780|4.430807|0.108231|4.595253|3.390632|0.090185|2.889607|2.847804|2.417464|2.085949|2.102113|2.361851|0.064746|3.904045|2.579888|4.040614|2.871971|4.915038|2.743309|5.520167|2.697565|4.449316|2.481289|4.638286|0.198863|0.133362|0.198314|0.115013|0.124785|0.094219|0.089683|0.076611|0.078211|0.063776|0.056574|0.051764|0.056696|0.067109|0.055857|0.062680|0.304467|0.500000| |3.766191|4.077299|0.109378|3.202813|2.646449|2.251681|1.955011|1.744986|1.858486|5.587161|0.136255|8.673670|17.566912|8.639025|0.197211|5.582152|4.103368|3.986464|4.498579|0.114590|6.997276|0.191263|6.728724|4.657994|0.115376|3.622606|3.640181|2.854753|2.450434|2.447922|2.874170|0.076532|4.930486|3.493455|4.557552|3.056695|5.320545|2.694288|8.344254|3.843493|5.868276|3.610623|4.562858|0.114635|0.086790|0.102329|0.088947|0.084441|0.071119|0.073655|0.062984|0.060739|0.054720|0.047325|0.044768|0.048968|0.054801|0.047149|0.050563|0.216077|0.198945|0.500000| |3.897572|4.414742|0.110611|3.626679|2.851269|2.464529|2.085120|1.878227|1.944707|6.797553|0.187691|8.848342|17.539376|8.822784|0.224475|6.837385|4.445365|3.835299|4.037265|0.109596|5.475906|0.144416|4.663897|3.473657|0.086872|2.978883|3.154880|2.607150|2.216144|2.155837|2.421304|0.064079|4.137402|3.032123|3.878297|2.599868|4.419746|2.400260|6.111688|2.907114|4.562486|2.805753|6.455612|0.110184|0.088789|0.111178|0.104259|0.097904|0.074750|0.077563|0.070240|0.067169|0.057695|0.051283|0.047595|0.053238|0.056510|0.048933|0.053306|0.174484|0.217366|0.304414|0.500000| |3.417423|4.685647|0.138454|4.542072|3.897202|3.373824|2.876478|2.543898|2.472943|5.375228|0.131546|4.168903|4.383146|6.386512|0.174034|8.891632|17.519487|9.000574|6.984117|0.225288|5.568945|0.129481|4.120714|3.423274|0.082043|3.643584|4.631923|4.326716|3.212305|2.827356|2.886823|0.072577|4.651723|3.952036|5.019058|3.056492|4.715545|2.960249|5.518805|2.556510|4.128715|2.354256|7.747947|0.089352|0.085917|0.087153|0.153514|0.104960|0.092189|0.120366|0.103530|0.083148|0.085336|0.065481|0.064039|0.075264|0.071119|0.062417|0.064035|0.108196|0.095894|0.102248|0.113132|0.500000| |4.495809|7.011211|0.217568|7.175774|5.984078|4.666819|3.748604|3.117681|3.146873|6.742783|0.157478|4.606499|4.223982|5.438737|0.132013|8.741344|17.604137|8.881670|5.519353|0.147779|4.792582|0.107731|4.042172|3.291426|0.081848|3.462686|3.978881|3.788022|2.919073|2.696718|2.753561|0.071492|4.316093|3.247375|5.200354|3.307944|5.008360|3.397598|5.076133|2.391346|3.963764|2.158779|6.599344|0.111583|0.113940|0.109541|0.252950|0.145526|0.131651|0.195612|0.141451|0.109595|0.111781|0.079246|0.076637|0.090797|0.092035|0.076993|0.080217|0.121751|0.106133|0.097585|0.107030|0.306648|0.500000| |3.370760|4.378710|0.149559|3.996157|3.889701|3.221729|2.933746|2.502420|2.612099|4.296351|0.100044|3.665137|3.609877|4.801459|0.120032|5.431038|8.972403|17.544852|8.736960|0.210405|5.504053|0.123620|4.685758|4.206379|0.100688|5.161200|6.638734|7.042873|4.584174|3.999974|3.908016|0.096688|5.783119|4.586782|8.000225|4.430759|6.280372|4.329168|6.195309|2.846046|4.729533|2.482933|4.186303|0.091664|0.088319|0.081559|0.118918|0.090842|0.096476|0.131391|0.092855|0.077592|0.091009|0.063148|0.064726|0.071789|0.077797|0.066927|0.065704|0.105787|0.084904|0.090386|0.088161|0.221069|0.219498|0.500000| |4.505480|6.037865|0.235298|4.700290|4.347627|3.336564|2.944149|2.449036|2.716765|5.737370|0.121894|4.997737|4.557404|5.901117|0.131066|6.567289|8.876102|17.610137|8.741230|0.175191|7.019232|0.141330|6.772982|5.310139|0.127766|5.862487|6.215263|5.318752|3.891264|3.791753|4.078812|0.105516|5.918720|4.277579|10.079749|5.693924|7.840404|5.416580|7.160439|3.209111|5.354957|2.707928|4.398291|0.127097|0.113713|0.103328|0.129984|0.104930|0.112052|0.142453|0.092247|0.081945|0.088347|0.062987|0.062802|0.068517|0.083270|0.068282|0.069303|0.155057|0.109931|0.112800|0.104590|0.175477|0.214055|0.303733|0.500000| |4.532259|5.096657|0.169346|3.703961|3.303636|2.631511|2.341031|2.000389|2.256921|5.407655|0.115536|6.293351|5.738360|6.292469|0.132755|5.375832|5.136731|6.591226|6.746536|0.137846|8.683928|0.175248|17.633149|8.920712|0.217147|6.786625|5.645892|4.201724|3.446444|3.653500|4.496541|0.122352|6.678370|4.288028|10.101359|6.469469|10.171870|5.104205|10.288054|4.385271|7.248184|3.465200|3.768986|0.146356|0.109128|0.106232|0.098240|0.089970|0.090748|0.098408|0.071489|0.068052|0.067683|0.052882|0.051764|0.055285|0.069148|0.057229|0.059446|0.239996|0.135134|0.157769|0.120372|0.115758|0.123890|0.140500|0.238979|0.500000| |3.765476|4.014236|0.118967|3.070422|2.683292|2.231933|1.987620|1.744713|1.919132|4.722649|0.107706|6.412145|7.100281|6.588739|0.144903|4.749238|4.096612|4.651353|5.479100|0.123846|8.771392|0.217678|17.597919|9.008238|0.217104|5.503577|4.796018|3.511112|3.022264|3.176233|4.021735|0.108936|6.603044|4.250546|6.726574|4.483029|7.977668|3.602210|13.448363|5.548460|8.478421|4.430320|3.601813|0.121352|0.089734|0.095087|0.083058|0.078167|0.073592|0.077263|0.061345|0.059074|0.056621|0.046733|0.045259|0.048482|0.057701|0.049029|0.051423|0.225287|0.143628|0.243455|0.142652|0.098997|0.097853|0.104341|0.141979|0.304837|0.500000| |2.321382|2.739334|0.085763|2.546856|2.482118|2.214987|2.099489|1.892486|1.920947|2.846731|0.070227|2.677571|2.851579|3.635646|0.100826|3.498975|4.396608|5.786061|6.832583|0.203318|4.480734|0.118650|3.814782|4.030234|0.094740|5.465861|8.827438|17.532481|8.809230|5.485116|4.779849|0.106974|7.533868|7.234496|6.654226|3.666067|5.583247|3.282518|6.581421|3.093832|5.068105|2.765105|3.050246|0.064971|0.061245|0.058702|0.075121|0.062226|0.064040|0.078089|0.064008|0.055497|0.063922|0.048498|0.050260|0.054546|0.056080|0.050797|0.049243|0.076857|0.064537|0.076070|0.071709|0.130684|0.106832|0.189736|0.131393|0.101685|0.088107|0.500000| |2.610621|3.073579|0.100729|2.806552|2.819743|2.444050|2.341662|2.054269|2.170432|3.033387|0.073184|2.839526|2.873906|3.569271|0.093086|3.553762|4.579700|6.814740|6.681100|0.162935|4.472810|0.110810|4.189986|4.477130|0.108237|6.675670|8.639504|17.556951|8.930428|6.771486|5.595420|0.128823|7.690038|5.529203|9.867357|5.040694|7.075360|4.566081|6.624935|3.118781|5.300648|2.661936|2.949814|0.073609|0.069844|0.064339|0.080526|0.067371|0.073701|0.091357|0.069077|0.060475|0.072336|0.052229|0.054702|0.058292|0.064653|0.057319|0.054905|0.084217|0.068135|0.076459|0.070799|0.123819|0.116101|0.246261|0.169721|0.119358|0.094054|0.306567|0.500000| |1.953016|2.184291|0.067328|2.005439|1.969095|1.773339|1.708685|1.555865|1.613384|2.256591|0.056403|2.241437|2.389535|2.827918|0.078226|2.596623|2.949423|3.673488|4.421032|0.120466|3.539825|0.100261|3.359062|4.026919|0.098631|5.559696|6.640388|8.795542|17.588502|8.843310|6.594525|0.136426|11.757802|7.067134|6.090189|3.570237|5.803028|3.031989|6.992824|3.539029|5.971783|3.142118|2.298480|0.055972|0.051940|0.049855|0.057449|0.050316|0.052419|0.060390|0.050242|0.045351|0.051255|0.040379|0.041859|0.044200|0.047280|0.043185|0.041805|0.065626|0.055405|0.066732|0.060292|0.083560|0.073997|0.108735|0.094309|0.087391|0.080547|0.214296|0.174482|0.500000| |1.978792|2.219904|0.069389|2.074195|2.095887|1.894379|1.859944|1.685723|1.754834|2.217784|0.055458|2.146965|2.214081|2.605961|0.070769|2.514673|2.961941|3.723649|4.018876|0.107713|3.148817|0.084898|3.039703|3.481248|0.088251|4.823712|5.447863|8.855907|17.527871|8.859319|5.459781|0.124266|8.375427|4.801584|6.206595|3.719532|5.802317|3.350564|5.668532|2.878324|5.013989|2.534811|2.222188|0.056135|0.053504|0.050075|0.059227|0.051608|0.055782|0.065451|0.053495|0.047886|0.056721|0.043268|0.045712|0.047806|0.051542|0.047342|0.044908|0.063025|0.053267|0.060685|0.056033|0.083286|0.076811|0.117876|0.096945|0.083149|0.072706|0.211952|0.220332|0.304822|0.500000| |1.921031|2.075542|0.064534|1.885274|1.888681|1.688589|1.651448|1.490863|1.601403|2.075674|0.051760|2.101653|2.158322|2.431865|0.064953|2.262121|2.510058|3.121298|3.472697|0.088372|3.009880|0.082889|3.171533|4.015513|0.108209|5.490312|4.801248|5.487472|8.818506|17.568423|8.965643|0.212026|13.560188|4.409951|6.659968|4.327238|7.345686|3.566949|6.574873|3.567123|6.648175|2.993681|1.974917|0.055993|0.051891|0.048653|0.052561|0.047584|0.051565|0.057741|0.046829|0.043403|0.049417|0.038803|0.040451|0.041655|0.047550|0.043169|0.041486|0.063225|0.052709|0.061091|0.054062|0.068073|0.064993|0.090898|0.086718|0.085728|0.077408|0.123215|0.139014|0.217159|0.210070|0.500000| |2.234684|2.441298|0.078146|2.200982|2.240163|1.965712|1.927797|1.707822|1.870391|2.376951|0.058341|2.364184|2.362745|2.696624|0.070185|2.576105|2.951808|3.857319|4.040657|0.098454|3.362670|0.088051|3.610490|4.439225|0.119678|6.645673|5.514148|6.716807|8.869655|17.553889|8.861747|0.223705|10.271570|4.322802|9.833498|6.162428|9.295244|5.066786|6.584618|3.379813|6.242070|2.770698|2.190132|0.065075|0.060808|0.055511|0.060890|0.054639|0.061273|0.069946|0.054109|0.049890|0.058400|0.044068|0.046251|0.047485|0.056252|0.050233|0.047883|0.072132|0.058610|0.065703|0.058432|0.078127|0.077272|0.115591|0.110555|0.102425|0.085206|0.138568|0.197087|0.174295|0.218725|0.303826|0.500000| |2.034176|2.155769|0.065654|1.889298|1.819477|1.607791|1.530176|1.381421|1.490527|2.248159|0.055813|2.421862|2.578824|2.806211|0.074785|2.424111|2.508281|3.040031|3.675091|0.091510|3.629909|0.106889|4.104019|6.084714|0.169118|6.482144|4.916116|4.173869|4.770278|6.121822|9.883231|0.254019|35.745961|5.145545|6.370918|4.232164|8.172773|3.196410|11.872062|7.763199|15.771347|5.553362|2.095024|0.060974|0.053516|0.052087|0.052333|0.048341|0.049986|0.054172|0.044505|0.042044|0.044759|0.036519|0.037017|0.038528|0.044293|0.039618|0.039312|0.073903|0.060780|0.076960|0.063572|0.066997|0.063088|0.081132|0.085746|0.101836|0.104506|0.098304|0.101886|0.138472|0.107201|0.169551|0.135777|0.500000| |2.370182|2.692980|0.080683|2.352118|2.155053|1.898577|1.745193|1.580810|1.637116|3.059643|0.075211|3.231236|3.872996|4.856450|0.141332|3.727765|3.801919|4.531938|7.138098|0.198889|7.047455|0.265834|5.621243|6.344387|0.132224|6.398615|8.627799|5.542541|4.727873|4.258959|5.160922|0.115776|10.006318|17.697171|6.026960|3.486397|5.873575|2.847749|14.188411|5.711036|7.859759|5.299989|3.210917|0.069046|0.060132|0.061294|0.067988|0.059403|0.056934|0.064197|0.054124|0.049329|0.050992|0.041710|0.041577|0.045017|0.047971|0.042802|0.043210|0.092952|0.077198|0.112976|0.094661|0.106663|0.087668|0.113219|0.112957|0.123534|0.134765|0.147353|0.122362|0.142645|0.105241|0.103001|0.101067|0.137106|0.500000| |2.206732|2.554415|0.077111|2.317364|2.167051|1.939416|1.803085|1.644803|1.667920|2.821543|0.070268|2.800652|3.211136|4.121234|0.122234|3.521149|3.911999|4.685578|6.921191|0.228943|5.317982|0.164512|4.214646|4.548243|0.101942|5.416533|8.840462|7.397473|5.925599|4.514909|4.697330|0.103755|8.635393|17.538193|5.627955|3.216317|5.226049|2.747573|8.563393|3.901537|5.942518|3.665316|3.138493|0.062762|0.056926|0.056960|0.068230|0.058017|0.056456|0.065598|0.055994|0.049802|0.053388|0.042977|0.043433|0.047306|0.048503|0.043879|0.043628|0.079297|0.067517|0.088758|0.081020|0.116662|0.091123|0.127387|0.110001|0.102244|0.100122|0.232936|0.148183|0.187997|0.132548|0.108370|0.106599|0.113022|0.303276|0.500000| |2.108090|2.359620|0.071735|2.105323|1.994788|1.775142|1.668968|1.516385|1.575983|2.549307|0.063238|2.629328|2.948598|3.534078|0.099551|2.989997|3.215615|3.956054|5.499950|0.149494|4.750378|0.148393|4.352349|5.476866|0.123394|6.797004|8.635823|6.806543|6.965725|5.928767|6.849235|0.139166|14.990038|17.709268|6.232526|3.593546|6.052272|2.912534|10.992388|5.190801|7.864447|4.636164|2.614300|0.061244|0.054754|0.054191|0.060383|0.053134|0.053087|0.060114|0.050353|0.045888|0.049256|0.039780|0.040328|0.043070|0.046227|0.041672|0.041317|0.076866|0.064200|0.084789|0.073343|0.090456|0.077407|0.106825|0.100835|0.104043|0.104308|0.171147|0.138296|0.244209|0.142003|0.144083|0.127128|0.175806|0.305987|0.301823|0.500000| |3.235059|3.749881|0.130409|3.194498|3.198543|2.630944|2.483458|2.114865|2.367546|3.560994|0.082665|3.430116|3.297330|3.957140|0.096383|3.906395|4.772847|7.600612|6.758402|0.142004|5.164260|0.119527|5.655850|5.988925|0.149537|9.003548|7.689718|7.525152|5.677778|6.081340|6.249258|0.159199|7.814623|4.748690|26.218735|9.585076|10.936850|7.772201|7.643664|3.525966|6.147414|2.849309|3.038273|0.094371|0.086272|0.076912|0.087593|0.075840|0.086269|0.103652|0.072043|0.065427|0.075646|0.054235|0.055907|0.058738|0.072657|0.061622|0.060055|0.107948|0.081005|0.088293|0.078298|0.115813|0.122464|0.218570|0.252678|0.180311|0.120371|0.154922|0.271935|0.124524|0.136306|0.126580|0.193972|0.109231|0.115841|0.116349|0.119515|0.500000| |4.178985|4.291404|0.152814|3.547833|3.769861|2.952329|2.819708|2.305574|2.881570|3.569475|0.083760|3.487140|3.003289|3.206738|0.076563|3.350501|3.697666|4.569415|3.826933|0.088540|3.638428|0.085957|4.363636|4.168253|0.121578|4.452306|3.740597|3.568699|3.162566|3.530382|3.745406|0.110861|5.280707|2.894180|9.045932|8.915800|11.626012|17.543163|5.640781|2.804281|5.118358|2.319787|2.659957|0.126820|0.119853|0.093944|0.089174|0.085343|0.112070|0.118808|0.075980|0.074397|0.083924|0.059757|0.060996|0.061563|0.093940|0.074017|0.073107|0.114943|0.086403|0.080291|0.072215|0.087002|0.104828|0.122673|0.167582|0.156305|0.105709|0.085813|0.114793|0.076094|0.082338|0.084520|0.112972|0.080136|0.076782|0.073328|0.075578|0.188131|0.500000| |3.063716|3.076198|0.101464|2.681750|2.858319|2.387144|2.360733|1.994785|2.448413|2.708416|0.065832|2.714723|2.447727|2.588865|0.063923|2.615017|2.855862|3.473978|3.148089|0.074939|2.975340|0.073693|3.537246|3.732325|0.113795|4.109606|3.327746|3.298167|3.162541|3.765329|3.886649|0.122573|5.430973|2.669916|7.894414|8.961985|13.457874|17.635446|5.224978|2.717202|5.161559|2.239870|2.169028|0.092423|0.088117|0.072762|0.069146|0.066720|0.084379|0.088157|0.062103|0.061033|0.070298|0.051887|0.053895|0.053289|0.078152|0.065009|0.062529|0.087128|0.069037|0.067219|0.060009|0.070451|0.079785|0.096832|0.115519|0.115727|0.088034|0.078565|0.104068|0.075920|0.083634|0.092997|0.125903|0.083451|0.070069|0.067392|0.072444|0.153495|0.301170|0.500000| |3.154906|3.404905|0.117035|3.023671|3.283399|2.711915|2.688219|2.241995|2.689195|2.976070|0.071480|2.844842|2.596564|2.882892|0.071221|2.993771|3.492510|4.503456|3.826391|0.090132|3.348421|0.081087|3.763740|3.885208|0.109684|4.702018|4.037884|4.261939|3.877466|4.399427|4.225637|0.122894|5.726289|3.060645|9.961748|8.738505|10.558654|17.568164|5.391113|2.700249|4.942725|2.247469|2.450382|0.091513|0.089865|0.074298|0.079527|0.072862|0.093411|0.107005|0.071466|0.067314|0.082760|0.057165|0.060358|0.060573|0.085407|0.071124|0.066999|0.089422|0.070534|0.069657|0.063569|0.085731|0.098527|0.133522|0.151054|0.123436|0.089421|0.099579|0.146809|0.089030|0.103939|0.103027|0.154416|0.084324|0.077932|0.078324|0.081329|0.234000|0.301044|0.299146|0.500000| |1.936544|2.061559|0.060207|1.812779|1.681701|1.505246|1.402638|1.285397|1.349220|2.285435|0.058045|2.543095|2.949882|3.118394|0.088294|2.516483|2.438164|2.732819|3.456734|0.092530|3.834907|0.129719|3.896443|4.727546|0.118728|4.093775|3.945881|3.164489|3.173449|3.258697|4.086415|0.103164|9.345985|5.005561|4.267388|2.802893|5.190195|2.302105|12.841992|8.980013|11.153727|17.565929|2.263196|0.057567|0.049710|0.051133|0.051055|0.047238|0.045616|0.048905|0.042258|0.039924|0.040387|0.034370|0.034115|0.036195|0.039509|0.035585|0.036096|0.074128|0.064496|0.092512|0.074713|0.066800|0.059941|0.070177|0.074036|0.089781|0.109129|0.082618|0.076697|0.096760|0.075134|0.087155|0.078521|0.156271|0.169869|0.116264|0.152358|0.078623|0.061706|0.059651|0.061140|0.500000| |1.876248|1.941185|0.056349|1.699682|1.583996|1.417605|1.325498|1.214034|1.291347|2.120899|0.054177|2.408567|2.707568|2.715307|0.074796|2.242476|2.145252|2.379508|2.854274|0.074803|3.221845|0.102747|3.516401|4.225333|0.116649|3.507738|3.163596|2.620833|2.654806|2.851753|3.579401|0.097169|7.768711|3.598282|3.876350|2.684933|5.181983|2.215871|10.436819|8.956782|13.324974|17.642206|2.015790|0.056507|0.048378|0.049775|0.047186|0.044728|0.043532|0.045661|0.039418|0.037885|0.037926|0.032634|0.032294|0.033937|0.037938|0.034105|0.034738|0.071190|0.062501|0.086315|0.068779|0.057799|0.053771|0.061153|0.066398|0.083574|0.103399|0.067689|0.065920|0.078224|0.064358|0.077644|0.070889|0.141197|0.114439|0.085844|0.107142|0.070562|0.059564|0.058618|0.057797|0.298900|0.500000| 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|3.722092|4.667777|0.113601|4.397516|3.307236|2.953956|2.416980|2.205109|2.159352|7.010058|0.231018|5.706286|6.604319|6.931943|0.201866|8.679712|5.525288|4.042202|3.899614|0.113532|4.442308|0.113131|3.574964|2.832524|0.070709|2.651913|2.964813|2.600630|2.167553|2.039666|2.188133|0.057242|3.694656|2.810492|3.555873|2.352406|3.879584|2.260164|4.860426|2.335441|3.741757|2.250893|17.560304|0.096288|0.087672|0.106410|0.141615|0.118243|0.082025|0.089188|0.088431|0.079924|0.066670|0.060022|0.054871|0.064102|0.061377|0.053906|0.058982|0.122803|0.141502|0.136912|0.227065|0.150831|0.136895|0.095903|0.103852|0.097397|0.098475|0.074269|0.071896|0.058578|0.056027|0.051077|0.055856|0.055599|0.083471|0.079057|0.067561|0.075147|0.068016|0.056214|0.061905|0.061997|0.055911|0.067773|0.500000| 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