Version2.0 2020-01-23T06:32:54Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 13-Sep-2019 #N HF/6-31G(d) OPT=(MaxStep=1,RFO) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1cc(c(o1)C(F)(F)F)C(=O)N2C[C@H](C3(C2)CC[NH2+]CC3)C(=O)NCc4ccc(cc4)OC(F)F C39673385 RHF 6-31G(d) (6D,7F) Cc1cc(c(o1)C(F)(F)F)C(=O)N2C[C@H](C3(C2)CC[NH2+]CC3)C(=O)NCc4ccc(cc4)OC(F)F C01[X(C24H27F5N3O4)] 183 C1 594 FC(Oc1ccc(cc1)CNC(=O)[C@@H]1CN(CC21CC[NH2+]CC2)C(=O)c1cc(oc1C(F)(F)F)C)F FC(Oc1ccc(cc1)CNC(=O)[C@@H]1CN(CC21CC[NH2+]CC2)C(=O)c1cc(oc1C(F)(F)F)C)F Cc1oc(c(c1)C(=O)N2C[C@@H](C(=O)NCc3ccc(OC(F)F)cc3)C4(CC[NH2+]CC4)C2)C(F)(F)F InChIKey=SXOPXDKOUAESOU-SFHVURJKSA-O InChI=1S/C24H26F5N3O4/c1-14-10-17(19(35-14)24(27,28)29)21(34)32-12-18(23(13-32)6-8-30-9-7-23)20(33)31-11-15-2-4-16(5-3-15)36-22(25)26/h2-5,10,18,22,30H,6-9,11-13H2,1H3,(H,31,33)/p+1/t18-/m0/s1 InChI=1/C24H26F5N3O4/c1-14-10-17(19(35-14)24(27,28)29)21(34)32-12-18(23(13-32)6-8-30-9-7-23)20(33)31-11-15-2-4-16(5-3-15)36-22(25)26/h2-5,10,18,22,30H,6-9,11-13H2,1H3,(H,31,33)/p+1/t18-/m0/s1/fC24H27F5N3O4/h30-31H/q+1 Cc1cc(c(o1)C(F)(F)F)C(=O)N2C[C@H](C3(C2)CC[NH2+]CC3)C(=O)NCc4ccc(cc4)OC(F)F C01[X(C24H27F5N3O4)] 183 C01 594 FC(Oc1ccc(cc1)CNC(=O)[C@@H]1CN(CC21CC[NH2+]CC2)C(=O)c1cc(oc1C(F)(F)F)C)F FC(Oc1ccc(cc1)CNC(=O)[C@@H]1CN(CC21CC[NH2]CC2)C(=O)c1cc(oc1C(F)(F)F)C)F Cc1oc(c(c1)C(=O)N2C[C@@H](C(=O)NCc3ccc(OC(F)F)cc3)C4(CC[NH2]CC4)C2)C(F)(F)F InChIKey=VEVPDTFYXCIFLH-SFHVURJKSA-N InChI=1S/C24H27F5N3O4/c1-14-10-17(19(35-14)24(27,28)29)21(34)32-12-18(23(13-32)6-8-30-9-7-23)20(33)31-11-15-2-4-16(5-3-15)36-22(25)26/h2-5,10,18,22H,6-9,11-13,30H2,1H3,(H,31,33)/t18-/m0/s1 InChI=1/C24H27F5N3O4/c1-14-10-17(19(35-14)24(27,28)29)21(34)32-12-18(23(13-32)6-8-30-9-7-23)20(33)31-11-15-2-4-16(5-3-15)36-22(25)26/h2-5,10,18,22H,6-9,11-13,30H2,1H3,(H,31,33)/t18-/m0/s1/f/h31H 4106.0506142133 -1884.3789648 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|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|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| 7.5907 10.0626 17.8973 20.2462 33.2344 34.0484 38.5830 43.0488 48.9627 77.1901 86.9391 95.0894 99.3393 112.4571 127.7897 130.5217 138.1581 151.6772 172.9766 173.6417 180.0138 205.3435 212.1967 225.9702 249.0519 274.0068 281.3070 284.4022 299.4971 312.0875 322.5978 333.0627 367.2329 377.5117 392.9252 399.6768 403.8894 436.1529 442.8890 460.6019 472.0030 484.9260 493.2744 520.6651 524.0084 528.5675 568.4481 575.8909 589.5009 592.1615 622.0235 629.9056 659.1549 684.8548 697.2570 728.5575 741.1863 747.6229 787.7142 802.0050 810.8353 817.3802 833.1952 849.3915 864.3253 871.3165 875.8094 878.7469 899.2514 906.4546 928.0503 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10.92 14.48 25.75 29.13 47.82 48.99 55.51 61.94 70.45 111.06 125.09 136.81 142.93 161.80 183.86 187.79 198.78 218.23 248.87 249.83 259.00 295.44 305.30 325.12 358.33 394.23 404.74 409.19 430.91 449.02 464.15 479.20 528.37 543.16 565.33 575.05 581.11 627.53 637.22 662.70 679.11 697.70 709.71 749.12 753.93 760.49 817.87 828.58 848.16 851.99 894.95 906.29 948.38 985.35 1003.20 1048.23 1066.40 1075.66 1133.34 1153.91 1166.61 1176.03 1198.78 1222.08 1243.57 1253.63 1260.09 1264.32 1293.82 1304.19 1335.26 1350.50 1352.87 1369.49 1374.68 1419.28 1454.45 1465.79 1517.64 1528.45 1543.60 1549.48 1562.34 1574.64 1593.58 1598.72 1606.30 1609.22 1637.25 1638.93 1653.43 1674.29 1692.50 1692.67 1732.65 1752.97 1760.64 1777.86 1822.04 1825.48 1852.87 1853.55 1864.32 1886.80 1888.45 1901.44 1914.13 1920.61 1931.69 1933.32 1950.58 1960.04 1972.21 1984.82 2001.95 2019.37 2033.98 2041.47 2081.15 2086.10 2094.36 2098.64 2119.75 2163.03 2176.26 2181.45 2207.72 2221.32 2229.80 2231.52 2241.08 2248.92 2257.66 2259.68 2265.49 2277.38 2279.41 2297.18 2324.76 2344.78 2346.97 2360.39 2365.95 2386.83 2396.74 2411.85 2433.35 2439.95 2452.40 2541.69 2568.31 2624.39 2629.67 2662.59 2773.43 2794.25 4595.15 4614.70 4634.81 4643.98 4669.05 4669.89 4704.48 4719.27 4722.19 4725.09 4733.32 4756.33 4766.74 4770.46 4803.13 4805.04 4807.68 4814.80 4840.79 4850.92 4895.39 4907.48 4954.18 4969.21 5275.78 5367.08 5585.03 0.544339 0.575599 0.576543 0.474792 -1883.834626 -1883.803366 -1883.802422 -1883.904172 3.412712D-04 MUNgauss RevisionA2.0 retrievium 23-Jan-2020 DUDE Cc1cc(c(o1)C(F)(F)F)C(=O)N2C[C@H](C3(C2)CC[NH2+]CC3)C(=O)NCc4ccc(cc4)OC(F)F C39673385 RHF 6-31G(d) (6D,10F) C1 516.192173 |X|Y|Z| 81.511621 123.810958 37.411396 72.276011 25 6 7 8 21 3 1 |36.858105| |12.796798|36.858105| |7.319449|14.190248|36.858105| |5.135172|8.542626|13.218638|36.858105| |5.353183|8.778755|8.622090|14.207521|36.858105| |7.891004|14.155238|8.666372|8.632819|14.231646|73.516695| |3.964436|5.360579|5.159380|7.319720|12.777170|14.138714|36.858105| |3.257327|4.262519|4.489630|6.602846|8.253915|9.646231|14.424219|97.533100| |3.651025|4.628368|4.325011|5.547485|8.171980|11.624394|14.337438|20.104877|97.533100| |3.785087|4.763278|4.340967|5.430515|8.192258|12.278234|14.525781|20.050478|20.158608|97.533100| |3.726528|5.194756|7.346033|12.719845|7.378625|9.218390|5.691969|14.339811|10.219613|9.912294|36.858105| |3.393850|4.472482|6.140745|8.139581|5.534939|7.652224|4.540433|11.480932|8.228872|8.644818|15.885192|73.516695| |3.161972|4.156916|5.306126|7.772413|5.839996|7.625323|5.176744|13.885921|10.233771|8.843014|14.049558|15.173288|53.358707| |3.128378|4.025428|4.760760|6.438950|5.618083|7.623635|5.240936|13.131943|11.724437|8.687787|7.552241|9.407309|17.806630|36.858105| |2.498327|3.034531|3.465207|4.294388|3.921598|5.685793|3.931025|10.197463|9.063378|7.020425|5.155286|7.428299|10.978188|12.316370|36.858105| |2.391410|2.833994|3.172037|3.730775|3.464563|5.242348|3.432682|8.453198|8.189369|6.271151|4.207872|6.229684|7.993043|8.761642|17.558939|0.500000| |2.338376|2.813304|3.314239|4.002316|3.461840|5.088860|3.354229|8.777506|7.309285|6.226414|5.267933|8.225507|11.034332|7.825365|12.272373|0.241654|36.858105| |2.576306|3.196427|3.909119|5.021623|4.113712|5.788734|3.909776|10.719441|7.959472|7.190591|7.858334|12.499899|17.855434|7.848645|7.933364|0.158370|12.380645|36.858105| |2.346249|2.767769|3.295496|3.712425|3.140202|4.811031|2.906053|7.172659|6.379768|5.492645|4.640263|7.458210|8.489869|6.214683|7.582156|0.203768|12.305940|7.507303|36.858105| |2.121760|2.449966|2.908639|3.166372|2.681398|4.193977|2.480645|6.104831|5.351512|4.836787|3.948241|6.913148|6.457890|4.315501|4.880025|0.130021|7.407769|6.020678|12.496890|36.858105| |1.846563|2.106058|2.430958|2.669678|2.342484|3.676733|2.241593|5.590410|4.875213|4.438578|3.264322|5.781332|5.295109|3.623513|4.359204|0.116689|6.435896|5.097942|7.676254|12.653041|53.358707| |1.742367|1.966191|2.259344|2.442102|2.149190|3.410955|2.052086|5.081833|4.437791|4.120001|2.949243|5.359305|4.588339|3.097478|3.565215|0.095568|4.903970|4.281533|5.671616|9.173209|25.683463|0.500000| |1.763406|1.992863|2.267373|2.470812|2.203522|3.492076|2.123615|5.243394|4.696132|4.212691|2.932859|5.092036|4.760368|3.426899|4.228225|0.119059|5.752504|4.341311|6.999529|9.196646|25.677043|0.328364|0.500000| |1.837011|2.118113|2.430573|2.758906|2.453881|3.778621|2.413391|6.212577|5.216927|4.772817|3.447382|6.107781|5.734253|3.839900|4.826703|0.121296|7.476219|6.024560|6.513408|7.589137|17.192242|0.254253|0.255645|36.858105| |1.973513|2.308119|2.635799|3.085857|2.780773|4.199878|2.788470|7.310162|6.135421|5.380182|3.857627|6.436847|6.964156|4.973647|7.336982|0.174154|12.381371|7.405914|7.620944|6.483072|10.449204|0.157503|0.195466|12.516404|36.858105| |2.279771|2.732339|2.999763|3.736996|3.662098|5.312902|4.023877|10.991801|9.532252|7.315464|4.308017|6.445333|8.108401|7.607981|12.438006|0.246831|7.355295|6.074482|4.898194|3.714723|4.915581|0.085021|0.098213|4.266717|6.386678|36.858105| |2.157164|2.578565|2.835742|3.552175|3.480670|5.023461|3.913413|11.324866|8.822717|7.331702|4.221375|6.586789|7.590453|5.942871|7.943956|0.165073|6.603343|6.239444|4.339869|3.537218|4.847753|0.085251|0.094566|4.473747|6.499657|15.812707|73.516695| |2.199462|2.583286|2.738702|3.303915|3.386300|5.089151|3.808714|9.760777|9.723226|7.055531|3.542448|5.346663|6.131783|5.951986|7.866040|0.209332|5.072836|4.320911|3.934132|3.076838|4.086681|0.072243|0.083923|3.386809|4.639656|14.221280|15.130866|53.358707| |2.003104|2.310342|2.391917|2.840295|3.002372|4.609847|3.517446|8.966607|9.070280|6.839443|2.977295|4.632477|4.830096|4.262103|4.995231|0.132831|3.788546|3.451047|3.055972|2.534502|3.442696|0.062399|0.070628|2.870375|3.696422|7.745761|12.111824|17.715679|36.858105| |1.991513|2.254639|2.271976|2.628626|2.850476|4.531489|3.335423|7.945677|9.064764|6.630729|2.637201|4.108410|4.119502|3.660598|3.973155|0.111146|3.078458|2.846291|2.634462|2.210205|2.960056|0.054340|0.061124|2.383798|2.939666|5.169260|8.036738|10.613830|12.616820|36.858105| |2.201537|2.492319|2.449319|2.831622|3.196773|5.148239|3.859744|8.738343|11.292702|7.704785|2.729842|4.208080|4.143373|3.686571|3.681682|0.101479|2.867469|2.748925|2.495559|2.099238|2.753945|0.050898|0.056295|2.188799|2.645540|4.485839|7.057737|8.244959|7.550770|13.668543|36.858105| |2.109278|2.322357|2.236922|2.502723|2.828752|4.752071|3.304913|7.178909|9.512796|6.853082|2.367074|3.699209|3.501213|3.049819|2.999684|0.084482|2.422309|2.328399|2.180533|1.864657|2.442251|0.045576|0.050149|1.907968|2.248099|3.432343|5.492836|5.903927|5.021305|7.903318|13.825932|36.858105| |1.858111|2.015162|1.957855|2.154616|2.370499|4.016598|2.679360|5.914666|7.321023|5.612623|2.070268|3.282301|3.070614|2.642914|2.684660|0.077219|2.213740|2.091051|2.022195|1.748011|2.316143|0.043385|0.048040|1.798583|2.100392|3.037413|4.888652|5.195959|4.437129|6.843981|7.957994|13.721283|36.858105| |1.725051|1.880862|1.860830|2.057200|2.214731|3.697703|2.479505|5.636638|6.584442|5.146574|2.024545|3.227644|3.053051|2.626058|2.782531|0.080973|2.299890|2.127213|2.088762|1.806402|2.428999|0.045357|0.050817|1.897193|2.232093|3.212879|5.162084|5.634736|5.002725|7.865266|6.865477|7.922682|13.788396|36.858105| |1.778082|1.972465|1.982566|2.234711|2.385742|3.885786|2.699070|6.326520|7.125235|5.496323|2.243921|3.557795|3.461557|3.010949|3.311900|0.095861|2.677226|2.439928|2.365580|2.020618|2.739140|0.050662|0.057322|2.176309|2.625271|4.044079|6.418837|7.603771|7.556446|13.766847|7.991269|6.914027|7.987845|13.717729|36.858105| |1.774664|1.887128|1.812101|1.955665|2.151011|3.730757|2.389128|5.181348|6.420484|5.108099|1.859407|2.975313|2.709670|2.291991|2.291794|0.065953|1.935226|1.844432|1.800537|1.577125|2.084111|0.039349|0.043215|1.601437|1.836192|2.514368|4.100548|4.111940|3.366502|4.590945|5.296110|8.215968|13.900629|7.798375|5.179141|73.516695| |1.594671|1.680232|1.623187|1.734344|1.877882|3.268334|2.050081|4.485469|5.362496|4.402606|1.664191|2.689634|2.422530|2.026190|2.053178|0.059522|1.765074|1.671497|1.660451|1.469964|1.956240|0.037108|0.040786|1.494764|1.696254|2.228188|3.659715|3.583917|2.901253|3.753509|3.990109|5.301411|7.967381|6.560533|4.444161|25.117705|36.858105| |1.475082|1.559606|1.517626|1.629670|1.755250|3.028863|1.927877|4.283748|4.966630|4.167127|1.582115|2.576000|2.306218|1.906127|1.957582|0.056334|1.701129|1.612235|1.588885|1.417543|1.906609|0.036261|0.039767|1.467419|1.659828|2.155857|3.595457|3.448964|2.868582|3.650824|3.704331|4.614542|6.680280|6.472977|4.470171|15.286212|14.305434|97.533100| |1.576895|1.661778|1.618168|1.721837|1.840075|3.195386|1.977494|4.346843|5.142903|4.189789|1.662344|2.683358|2.440362|2.058630|2.112326|0.062332|1.813228|1.691135|1.723879|1.521525|2.026084|0.038350|0.042565|1.536035|1.745491|2.261861|3.667048|3.653805|2.881811|3.667937|3.731915|4.657368|6.714413|6.447092|4.472832|15.296497|14.288591|20.039698|97.533100| |17.571615|8.960672|5.805102|4.483626|4.858118|12.497490|3.804618|7.033700|7.767877|8.657965|3.368475|5.598557|3.887155|2.789431|2.274424|0.060171|2.142314|2.374704|2.122123|1.942234|2.333691|0.045189|0.045443|1.720025|1.837821|2.120026|3.616444|2.790630|1.899165|1.892128|2.097222|2.020083|1.780793|1.648724|1.693225|3.040697|1.538795|3.217571|3.397000|0.500000| |17.566495|8.947077|5.797528|4.477602|4.842583|12.449412|3.779385|6.938685|8.279189|8.067491|3.347726|5.334582|4.034910|3.050486|2.459607|0.066444|2.259661|2.429302|2.274395|2.036857|2.426151|0.046572|0.047728|1.769234|1.915514|2.253571|3.745796|3.015383|2.022171|2.044760|2.283415|2.221292|1.955964|1.798407|1.834615|3.347548|1.687881|3.479805|3.759639|0.301587|0.500000| |17.609992|8.990831|6.840214|4.615984|4.442113|10.214346|3.370816|6.511501|7.005522|7.190969|3.543426|5.894318|4.101668|2.939367|2.385522|0.063822|2.279981|2.501667|2.337743|2.146550|2.523060|0.048881|0.049103|1.820102|1.929356|2.148299|3.619627|2.801061|1.865698|1.843051|2.005598|1.921661|1.716258|1.609599|1.661114|2.919106|1.490098|3.111763|3.337877|0.300558|0.300392|0.500000| |6.305686|8.810471|17.811057|8.471504|5.870658|10.475355|4.046281|8.359997|7.903642|7.916143|6.483425|10.661263|6.608650|4.264997|3.250422|0.083730|3.237522|3.784572|3.355788|3.048785|3.404446|0.065164|0.064466|2.446228|2.590257|2.767089|4.668267|3.419425|2.191774|2.074147|2.198933|2.021246|1.798029|1.725285|1.835847|2.972765|1.513900|3.194927|3.417182|0.141255|0.140788|0.189044|0.500000| |3.371937|4.302148|5.127325|6.280112|5.339940|7.762821|4.621206|10.592035|10.587171|7.909825|6.595921|8.538258|12.314598|17.563794|8.719820|0.224905|6.431285|6.090707|6.254762|4.309926|4.743581|0.083453|0.092916|3.489120|4.297162|5.635064|8.030253|6.696476|3.660065|3.315383|3.386766|2.910274|2.553341|2.516334|2.814246|4.000715|2.001600|4.191685|4.620151|0.081316|0.092548|0.089049|0.130224|0.500000| |3.253683|4.222263|4.694795|6.535937|6.584760|8.600781|6.758284|16.613875|16.271484|10.409777|6.632828|8.421287|12.246058|17.676245|8.738687|0.192861|5.714616|5.954331|4.625928|3.479066|4.151064|0.074010|0.081078|3.277566|4.162530|7.546438|10.556520|8.928963|4.808521|4.212218|4.444022|3.564345|2.973905|2.893330|3.321683|4.526197|2.205750|4.641927|4.980751|0.081314|0.089222|0.082519|0.111558|0.303438|0.500000| |2.402381|2.951009|3.489519|4.505081|3.911863|5.488112|3.947547|11.469936|7.946285|7.403230|6.600867|11.136482|12.378128|6.326109|6.701203|0.136382|8.771893|17.613248|5.507434|4.782225|6.116693|0.108040|0.107981|5.779304|7.099064|6.283874|13.331515|5.967519|3.645843|2.927711|2.803778|2.349208|2.104933|2.149847|2.488491|3.285158|1.672173|3.661020|3.776311|0.062601|0.062973|0.064204|0.092273|0.135403|0.150551|0.500000| |2.536572|3.107792|3.876001|4.714023|3.750361|5.444545|3.446323|9.082143|6.930822|6.549639|7.395967|13.982550|12.485315|5.843151|5.681404|0.126640|8.604014|17.637552|7.098708|6.796234|7.418684|0.131844|0.122689|6.066727|6.212748|4.535102|8.327858|4.736654|2.888291|2.451444|2.386251|2.066696|1.874483|1.900942|2.145608|2.980148|1.531688|3.327763|3.489067|0.065092|0.065644|0.069665|0.108743|0.141234|0.129262|0.302183|0.500000| |2.661692|3.181259|3.899979|4.310399|3.511741|5.398503|3.114927|7.486801|6.790804|5.821617|5.323333|8.280881|9.463846|6.919708|6.889815|0.185875|8.717829|7.028119|17.587548|9.025496|7.631572|0.127259|0.143286|4.888144|5.512861|4.467161|6.973605|5.045397|2.901405|2.565541|2.494132|2.198399|2.019554|2.052165|2.291393|3.219466|1.662127|3.547976|3.873970|0.065743|0.071390|0.074179|0.112140|0.217198|0.138625|0.140602|0.190897|0.500000| |2.197113|2.541227|2.935877|3.240149|2.840512|4.444425|2.670623|6.482959|6.029586|5.090899|3.808954|6.098679|6.693267|5.427310|7.047153|0.225641|8.773620|5.492394|17.511611|8.913168|9.368407|0.143841|0.204053|5.682801|6.819619|4.726013|7.187022|5.455156|3.091567|2.698449|2.520106|2.217986|2.085950|2.178304|2.467093|3.298536|1.722033|3.700525|4.070156|0.055239|0.060084|0.060738|0.082497|0.157689|0.118009|0.122992|0.141294|0.303928|0.500000| |2.200317|2.558897|3.094954|3.370300|2.792098|4.342271|2.552405|6.317689|5.379988|5.003702|4.357533|8.049478|6.808451|4.189573|4.435568|0.113085|6.605821|6.533178|8.733298|17.645736|12.441723|0.225556|0.181230|6.916613|5.679342|3.490578|6.097314|3.911597|2.409220|2.104147|2.022837|1.798327|1.674051|1.715463|1.910384|2.695299|1.409228|3.061389|3.256304|0.056173|0.057849|0.062111|0.091369|0.114325|0.094797|0.143157|0.238663|0.214427|0.173209|0.500000| |2.058331|2.332744|2.742154|2.882754|2.461413|3.939368|2.258165|5.435461|4.912694|4.448009|3.437296|6.029761|5.375718|3.725680|4.070845|0.113640|5.424496|4.589359|8.771416|17.625372|12.364471|0.222230|0.224901|5.575583|4.890217|3.175714|5.319342|3.724389|2.285720|2.037145|1.946035|1.753721|1.656668|1.708239|1.887299|2.681260|1.414545|3.060997|3.310319|0.052191|0.055157|0.058494|0.081117|0.107700|0.085505|0.105219|0.141432|0.212960|0.217056|0.301636|0.500000| |1.887941|2.189063|2.537910|2.896382|2.543800|3.891976|2.487471|6.467166|5.259610|4.947920|3.721252|6.868342|6.004033|3.764906|4.421156|0.107607|6.716708|6.606479|5.752504|6.946978|12.418113|0.224010|0.181101|17.625334|8.747021|3.965978|7.653968|4.271622|2.706263|2.261142|2.109868|1.842206|1.722714|1.797623|2.047288|2.739512|1.433815|3.166913|3.290164|0.049326|0.049988|0.052042|0.071253|0.094175|0.089848|0.182535|0.202764|0.128970|0.132319|0.207993|0.142836|0.500000| |1.666794|1.897259|2.140726|2.402774|2.180536|3.399733|2.172917|5.558113|4.735570|4.362823|2.911079|5.180481|4.692590|3.228081|4.005614|0.103788|5.451857|4.589367|4.891426|5.577998|12.361369|0.222789|0.224488|17.628063|8.773080|3.767963|7.130698|4.230298|2.721071|2.269721|2.063807|1.811129|1.726377|1.836856|2.105165|2.739847|1.449174|3.225145|3.353184|0.043648|0.044782|0.045849|0.059702|0.082228|0.079055|0.128459|0.127211|0.107727|0.127691|0.142850|0.126494|0.301240|0.500000| |1.866784|2.153330|2.417642|2.775024|2.549097|3.920987|2.568618|6.575305|5.798478|4.987439|3.313966|5.469098|5.818243|4.492862|6.811336|0.184999|8.796388|5.444891|6.845099|5.708069|9.440229|0.144624|0.207221|8.906052|17.491629|6.093878|10.197018|6.528613|3.797440|3.042694|2.677289|2.288282|2.172756|2.347657|2.779175|3.366038|1.761573|3.883002|4.123344|0.048237|0.050890|0.050714|0.065990|0.112066|0.107018|0.143903|0.130910|0.139548|0.200734|0.131893|0.128860|0.173073|0.215278|0.500000| |1.923605|2.252566|2.540236|3.020237|2.784633|4.171606|2.882193|7.770629|6.319159|5.601212|3.751740|6.294691|6.630670|4.679311|6.616228|0.151122|8.793817|6.881519|5.521948|4.862659|7.619642|0.126941|0.143966|8.992790|17.660296|7.026136|14.956133|6.717584|4.085535|3.125099|2.778032|2.327474|2.164696|2.309981|2.754879|3.339822|1.728810|3.837356|3.966650|0.050232|0.051809|0.051799|0.068365|0.108695|0.114596|0.216319|0.155877|0.123013|0.139632|0.127095|0.107554|0.212582|0.212891|0.303933|0.500000| |2.250660|2.621189|2.758702|3.253068|3.329444|5.116809|3.627982|8.825161|9.502057|6.717346|3.393683|5.090657|5.800477|5.928397|7.505867|0.234465|4.761497|3.964943|3.959903|3.048004|3.973936|0.070282|0.082785|3.166080|4.223855|9.387530|10.859278|26.069729|9.013065|7.512522|6.110821|4.567360|4.071401|4.397592|5.756123|5.717548|2.799094|5.936140|6.555505|0.057738|0.063758|0.058584|0.070507|0.146256|0.179449|0.107083|0.090763|0.105700|0.115983|0.078034|0.076704|0.080910|0.080584|0.124745|0.118202|0.500000| |2.049679|2.384203|2.465948|2.980567|3.197305|4.827751|3.903545|10.393346|9.861439|7.652622|3.137555|4.903880|5.008163|4.225520|4.702734|0.118177|3.706433|3.569089|2.937673|2.474613|3.354877|0.061269|0.067651|2.840218|3.600186|7.328365|13.346850|12.550425|17.630399|8.853209|6.924386|4.663328|3.972799|4.235186|5.753735|5.532755|2.672857|5.982577|5.842675|0.054440|0.056957|0.052737|0.062254|0.098428|0.135316|0.108493|0.082730|0.078012|0.080330|0.066573|0.061577|0.076108|0.074597|0.098687|0.113718|0.183398|0.500000| |1.809928|2.062924|2.146560|2.507220|2.600255|4.044835|2.969840|7.555167|7.403765|5.910396|2.666847|4.243894|4.298065|3.657374|4.441722|0.120512|3.583766|3.201157|2.917976|2.471570|3.450634|0.062750|0.071551|2.906615|3.715481|6.555045|11.058614|12.388461|17.583671|8.886821|5.602572|4.192135|3.983149|4.751411|7.250689|5.511020|2.764646|6.307406|6.246620|0.047835|0.050618|0.047275|0.055418|0.088880|0.109084|0.094621|0.075625|0.075455|0.082962|0.064851|0.062048|0.075152|0.078349|0.108916|0.115840|0.194510|0.303557|0.500000| |2.443813|2.825116|2.763436|3.277825|3.827666|6.017383|4.906239|11.009632|15.441156|9.541151|3.110523|4.720478|4.683295|4.166284|3.949430|0.104861|3.051408|3.017285|2.617593|2.191643|2.841693|0.052479|0.057395|2.269988|2.747558|4.813570|7.661802|8.301950|6.990300|8.883349|17.707267|8.979496|5.662106|4.947412|5.663282|7.627869|3.345284|7.007779|7.058942|0.064718|0.069962|0.061081|0.067688|0.103898|0.147245|0.085927|0.072119|0.073469|0.072011|0.059291|0.056037|0.061520|0.058812|0.075523|0.080481|0.163723|0.201958|0.141187|0.500000| |2.228347|2.426914|2.288443|2.530864|2.919028|5.026844|3.414644|7.140834|9.987190|7.242536|2.337704|3.658254|3.381374|2.904747|2.763324|0.077191|2.266348|2.218421|2.063117|1.776920|2.307740|0.043296|0.047140|1.790730|2.082276|3.070650|4.975710|5.033094|4.085266|5.619943|8.895441|17.743905|8.960028|5.657095|4.975584|13.591383|4.961951|9.458917|9.549679|0.059640|0.065831|0.055836|0.057057|0.077951|0.094684|0.061931|0.055207|0.058477|0.057836|0.047957|0.046624|0.048429|0.047081|0.058295|0.059583|0.107656|0.109962|0.096269|0.215165|0.500000| |1.585526|1.712059|1.696843|1.854929|1.975849|3.325169|2.177826|4.952392|5.662290|4.561229|1.833521|2.952265|2.750546|2.332982|2.487879|0.072882|2.103616|1.938519|1.936592|1.695212|2.295511|0.043096|0.048295|1.781424|2.068250|2.816453|4.578493|4.770089|4.094199|5.631300|4.955032|5.632406|8.885875|17.804172|8.933871|12.374557|7.142565|17.517681|17.126078|0.042174|0.045898|0.041377|0.044077|0.062668|0.070054|0.054309|0.048605|0.052674|0.056433|0.044627|0.044832|0.046767|0.048306|0.060852|0.059166|0.103174|0.098064|0.113358|0.107547|0.124238|0.500000| |1.657139|1.834668|1.863740|2.093401|2.195361|3.567120|2.447086|5.820872|6.274934|4.996543|2.138776|3.426117|3.320268|2.847193|3.239363|0.094488|2.677339|2.399629|2.366956|2.039007|2.811930|0.052004|0.059368|2.244563|2.706337|3.962319|6.381707|7.224544|6.993672|8.926513|5.661970|4.972415|5.682279|8.972908|17.704869|7.432756|3.847438|9.019897|8.994258|0.043843|0.047223|0.043361|0.048410|0.073858|0.084852|0.068204|0.058843|0.062713|0.069195|0.053204|0.052900|0.058056|0.061072|0.081059|0.079163|0.148637|0.147108|0.221099|0.124159|0.107895|0.217678|0.500000| 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