Version2.0 2020-07-25T23:27:13Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 30-May-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1ccc(c(c1)NC(=O)[C@H](c2ccccc2)[NH+]3CCCN(CC3)c4ccc(cn4)C(F)(F)F)OC C15523974 RHF 6-31G(d) (6D,7F) Cc1ccc(c(c1)NC(=O)[C@H](c2ccccc2)[NH+]3CCCN(CC3)c4ccc(cn4)C(F)(F)F)OC C01[X(C27H30F3N4O2)] 192 C1 600 COc1ccc(cc1NC(=O)[C@H](c1ccccc1)[NH+]1CCCN(CC1)c1ccc(cn1)C(F)(F)F)C COc1ccc(cc1NC(=O)[C@H](c1ccccc1)[NH+]1CCCN(CC1)c1ccc(cn1)C(F)(F)F)C COc1ccc(C)cc1NC(=O)[C@@H]([NH+]2CCCN(CC2)c3ccc(cn3)C(F)(F)F)c4ccccc4 InChIKey=VKLIMUWPKGPJNI-VWLOTQADSA-O InChI=1S/C27H29F3N4O2/c1-19-9-11-23(36-2)22(17-19)32-26(35)25(20-7-4-3-5-8-20)34-14-6-13-33(15-16-34)24-12-10-21(18-31-24)27(28,29)30/h3-5,7-12,17-18,25H,6,13-16H2,1-2H3,(H,32,35)/p+1/t25-/m0/s1 InChI=1/C27H29F3N4O2/c1-19-9-11-23(36-2)22(17-19)32-26(35)25(20-7-4-3-5-8-20)34-14-6-13-33(15-16-34)24-12-10-21(18-31-24)27(28,29)30/h3-5,7-12,17-18,25H,6,13-16H2,1-2H3,(H,32,35)/p+1/t25-/m0/s1/fC27H30F3N4O2/h32,34H/q+1 Cc1ccc(c(c1)NC(=O)[C@H](c2ccccc2)[NH+]3CCCN(CC3)c4ccc(cn4)C(F)(F)F)OC C01[X(C27H30F3N4O2)] 192 C01 600 COc1ccc(cc1NC(=O)[C@H](c1ccccc1)[NH+]1CCCN(CC1)c1ccc(cn1)C(F)(F)F)C CO[C]1[CH][CH][C]([CH][C]1[NH][C](=O)[C@H]([C]1[CH][CH][CH][CH][CH]1)[NH]1CCC[N@@](CC1)[C]1[CH][CH][C]([CH][N]1)C(F)(F)F)C CO[C]1[CH][CH][C](C)[CH][C]1NC(=O)[C@H]([C]2[CH][CH][CH][CH][CH]2)[NH]3CCCN(CC3)[C]4[CH][CH][C]([CH][N]4)C(F)(F)F InChIKey=IKCBDYSFJZJUTF-VWLOTQADSA-N InChI=1S/C27H30F3N4O2/c1-19-9-11-23(36-2)22(17-19)32-26(35)25(20-7-4-3-5-8-20)34-14-6-13-33(15-16-34)24-12-10-21(18-31-24)27(28,29)30/h3-5,7-12,17-18,25,34H,6,13-16H2,1-2H3,(H,32,35)/t25-/m0/s1 InChI=1/C27H30F3N4O2/c1-19-9-11-23(36-2)22(17-19)32-26(35)25(20-7-4-3-5-8-20)34-14-6-13-33(15-16-34)24-12-10-21(18-31-24)27(28,29)30/h3-5,7-12,17-18,25,34H,6,13-16H2,1-2H3,(H,32,35)/t25-/m0/s1/f/h32H 3805.0617284054 -1705.5860735 1-A 26224.6534 131 469 600 |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| -26.40663 -26.40027 -26.39836 -20.68590 -20.66872 -15.82500 -15.72309 -15.69438 -15.65706 -11.57305 -11.49359 -11.44484 -11.42531 -11.42083 -11.41322 -11.39091 -11.38621 -11.38606 -11.37696 -11.37615 -11.37186 -11.37100 -11.36749 -11.36068 -11.35901 -11.35737 -11.34992 -11.34888 -11.34814 -11.33247 -11.33189 -11.31534 -11.31394 -11.31380 -11.30930 -11.28981 -1.80167 -1.70092 -1.69444 -1.54138 -1.51194 -1.46272 -1.41451 -1.37987 -1.33971 -1.28533 -1.23996 -1.21659 -1.20212 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1240.08 1266.82 1295.96 1321.69 1334.40 1342.10 1385.40 1392.16 1395.19 1426.84 1467.82 1476.16 1478.51 1502.37 1521.88 1546.25 1550.19 1569.16 1583.80 1589.03 1597.64 1607.26 1611.96 1617.01 1628.24 1644.31 1654.94 1663.05 1671.53 1677.65 1693.78 1716.10 1721.52 1742.53 1762.06 1767.02 1773.23 1795.51 1801.79 1858.41 1859.48 1865.64 1868.14 1885.89 1905.34 1913.58 1922.10 1930.75 1951.52 1952.01 1969.98 1994.77 2017.28 2027.35 2044.32 2065.90 2078.18 2087.78 2116.63 2128.28 2140.12 2147.44 2171.59 2187.83 2210.27 2228.66 2239.11 2255.29 2258.05 2267.05 2276.84 2284.61 2291.49 2312.24 2337.82 2339.93 2342.13 2346.31 2347.25 2364.24 2369.40 2371.29 2378.09 2386.76 2399.60 2402.67 2413.99 2430.62 2522.97 2549.32 2567.17 2591.81 2594.78 2632.03 2634.63 2752.85 4608.41 4615.97 4642.71 4643.04 4672.86 4692.83 4698.84 4730.98 4734.88 4738.18 4740.27 4748.23 4754.34 4805.59 4805.88 4831.83 4838.37 4852.60 4858.24 4863.79 4868.51 4878.05 4884.08 4898.97 4903.21 4908.94 4927.01 4950.21 5223.01 5534.36 0.585498 0.616275 0.617219 0.516552 -1705.000576 -1704.969798 -1704.968854 -1705.069521 3.376388D-04 MUNgauss RevisionA2.0 retrievium 25-Jul-2020 DUDE Cc1ccc(c(c1)NC(=O)[C@H](c2ccccc2)[NH+]3CCCN(CC3)c4ccc(cn4)C(F)(F)F)OC C15523974 RHF 6-31G(d) (6D,10F) C1 499.232086 |X|Y|Z| 68.320661 49.303284 138.296982 77.519959 28 6 7 24 4 |36.858105| |12.606469|36.858105| |7.541390|13.811405|36.858105| |4.997826|7.881074|13.683624|36.858105| |4.421599|6.810053|7.950418|13.845931|36.858105| |5.027511|7.902308|6.913483|7.949688|13.595645|36.858105| |7.570152|13.638115|7.987667|6.876439|7.900946|13.822617|36.858105| |3.813595|5.088064|4.564029|5.213666|7.999558|13.402212|7.685071|53.358707| |3.514760|4.299263|3.694939|3.922473|5.202007|7.681543|6.267955|19.542334|36.858105| |3.820367|4.423074|3.592490|3.582521|4.411764|6.442144|6.450600|11.407733|15.767798|73.516695| |2.736960|3.208852|2.906929|3.142527|4.011413|5.006126|4.180832|10.721991|12.353476|14.334167|36.858105| |2.563129|3.029349|2.828028|3.136660|4.038050|4.752360|3.839902|9.938772|8.756501|10.701214|17.639884|0.500000| |2.517036|2.918652|2.696750|2.927700|3.654989|4.315519|3.658027|8.292776|7.580899|10.407287|12.557729|0.248017|36.858105| |2.195420|2.534687|2.423325|2.682508|3.295751|3.618533|3.046002|6.512231|5.191228|7.416264|7.596632|0.205886|13.716294|36.858105| |2.014932|2.290825|2.214397|2.432586|2.890677|3.082916|2.670531|5.150141|3.968412|6.035715|5.027016|0.133950|7.912530|13.742447|36.858105| |2.060093|2.310591|2.209002|2.378037|2.771651|2.995309|2.675541|4.832872|3.773821|5.999812|4.435344|0.111403|6.856657|7.943683|13.763160|36.858105| |2.319090|2.590714|2.410696|2.544475|2.975953|3.356681|3.062632|5.441521|4.448823|7.285884|5.007541|0.116791|7.921517|6.878477|7.935206|13.726447|36.858105| |2.608311|2.961910|2.689111|2.836289|3.425386|4.086893|3.673013|7.132679|6.430032|10.212567|7.509107|0.155579|13.671235|7.926188|6.863433|7.931131|13.774359|36.858105| |2.528890|2.831123|2.527814|2.637460|3.187999|3.908646|3.568025|7.186180|7.847780|13.073628|12.539412|0.252679|7.440967|5.406344|4.030335|3.707144|4.199865|5.822480|53.358707| |2.732896|3.010929|2.618562|2.668003|3.181757|4.014391|3.839504|7.102423|8.157012|16.703426|9.481265|0.185956|6.601208|4.667190|3.688197|3.576903|4.253695|5.997765|25.601208|0.500000| |2.134007|2.339605|2.131154|2.222241|2.614527|3.051258|2.823117|5.269912|5.034569|8.592598|7.441211|0.177294|6.529038|5.407871|4.230730|3.869916|4.221083|5.372622|17.220665|0.256763|36.858105| |2.000052|2.130037|1.926944|1.967528|2.251139|2.609471|2.512768|4.261484|3.942587|7.296984|4.898765|0.120550|4.437660|3.819794|3.264077|3.140656|3.455568|4.128841|10.268641|0.201983|12.430872|36.858105| |1.837307|1.944119|1.776575|1.814006|2.051814|2.333710|2.252440|3.728174|3.304648|6.047099|3.948134|0.104418|3.475908|3.153776|2.726266|2.575472|2.740247|3.170707|7.651895|0.145026|7.377473|12.436324|36.858105| |1.938000|2.069067|1.892768|1.941449|2.209431|2.517440|2.410559|4.045409|3.567554|6.438181|4.211773|0.116184|3.454147|3.128679|2.634734|2.442374|2.586267|3.044307|8.215294|0.148586|6.547828|7.707988|13.161033|53.358707| |2.253924|2.417521|2.170053|2.208822|2.536770|2.977402|2.878784|4.826901|4.415017|8.245578|4.937025|0.132671|3.744255|3.229560|2.669179|2.497224|2.711689|3.301372|10.189864|0.192499|6.338140|6.686177|7.659251|17.969872|36.858105| |2.493931|2.777643|2.495060|2.596738|3.099787|3.730019|3.438950|6.531011|6.348988|10.847528|7.719479|0.211432|4.965048|4.109916|3.202163|2.920217|3.181986|4.061278|17.172799|0.259843|7.544886|6.056894|5.704815|10.460651|12.499148|36.858105| |1.771009|1.892142|1.759706|1.817302|2.050434|2.278180|2.165490|3.598073|3.030820|5.334817|3.518406|0.101870|2.956170|2.793977|2.386782|2.185473|2.259037|2.591951|6.126659|0.110565|4.787717|5.130969|7.696072|18.771568|7.825976|5.751760|36.858105| |1.570685|1.663334|1.559547|1.607663|1.791319|1.960445|1.873502|3.043008|2.514569|4.434944|2.890408|0.083067|2.553352|2.472887|2.176652|2.005991|2.046970|2.285096|4.810757|0.089103|3.944203|4.378008|6.536805|10.634695|5.119995|4.096967|13.557857|36.858105| |1.460463|1.546607|1.466155|1.516860|1.677156|1.805955|1.721069|2.766052|2.228749|3.892395|2.519571|0.073646|2.250256|2.219835|1.976164|1.814219|1.829671|2.016150|3.994984|0.074375|3.171791|3.355270|4.455359|7.078844|3.970367|3.391922|8.001647|13.892138|36.858105| |1.496139|1.593929|1.520816|1.581819|1.749057|1.868167|1.769001|2.849808|2.259895|3.904346|2.524106|0.075345|2.219001|2.195434|1.938787|1.766847|1.778078|1.968190|3.901630|0.072227|2.962406|3.000148|3.762869|6.313452|3.860928|3.423778|6.984935|7.960274|13.671325|36.858105| |1.666710|1.791104|1.702196|1.776210|1.983328|2.134987|2.008692|3.288962|2.617559|4.492581|2.918939|0.088553|2.476607|2.416170|2.087917|1.892000|1.919498|2.163365|4.541649|0.082917|3.304414|3.253173|4.017064|7.374136|4.755946|4.249961|8.350172|7.029327|8.053052|13.854734|36.858105| |1.831389|1.974718|1.850080|1.924354|2.176444|2.397369|2.256157|3.772613|3.101359|5.357090|3.522488|0.105982|2.884988|2.743534|2.321848|2.105711|2.166313|2.494060|5.804925|0.103974|4.162192|4.104723|5.249575|11.317107|7.075668|5.877315|14.424319|7.991655|6.925581|8.010256|14.380016|53.358707| |1.369485|1.454875|1.402699|1.460960|1.598014|1.680310|1.592807|2.522940|1.960903|3.378440|2.154698|0.064368|1.930646|1.933727|1.735487|1.585899|1.583406|1.728453|3.223037|0.060407|2.427966|2.435137|2.914948|4.627062|2.984984|2.746994|4.509001|5.057696|7.593498|12.717823|7.569967|6.913880|36.858105| |1.301180|1.387409|1.346054|1.410533|1.544145|1.610979|1.516547|2.424557|1.872789|3.196982|2.080661|0.062449|1.898601|1.936504|1.753552|1.591850|1.569839|1.695899|3.063710|0.057123|2.346661|2.321561|2.724372|4.175577|2.680096|2.538507|3.916495|4.455740|6.321954|8.155880|5.662194|5.755816|14.382950|97.533100| |1.396100|1.487095|1.442245|1.505894|1.641034|1.711670|1.619476|2.547967|1.952802|3.350151|2.112343|0.063619|1.878460|1.878383|1.681489|1.535540|1.534848|1.679164|3.101919|0.058314|2.273463|2.242090|2.610316|4.191100|2.838359|2.673151|3.919682|4.031211|5.260312|8.156043|6.983104|6.400334|14.421592|20.102803|97.533100| |1.289321|1.356050|1.304711|1.347855|1.461219|1.537640|1.473935|2.284608|1.777969|3.101578|1.929165|0.056708|1.745676|1.737784|1.577483|1.459045|1.463005|1.587117|2.895842|0.055165|2.189883|2.248114|2.694109|4.153564|2.691984|2.431443|3.901017|4.544284|6.609055|8.167807|5.488222|5.636265|14.402539|20.189088|20.065826|97.533100| |3.365921|4.590937|5.184995|7.847721|14.050103|8.177854|5.283645|10.035373|4.897491|7.014583|4.166887|0.123171|3.875718|3.685268|3.199930|2.952435|3.048349|3.460114|4.367265|0.085854|2.679036|2.258934|2.068110|3.036297|2.511206|3.111254|2.095763|1.836218|1.729722|1.812662|2.054404|3.045244|1.661657|3.647505|3.843752|3.388717|73.516695| |2.910166|3.767194|4.492900|6.685247|7.976837|5.238575|3.972200|6.503931|3.606822|5.431384|3.259462|0.097030|3.138137|3.124745|2.831022|2.613919|2.622361|2.851699|3.582348|0.070297|2.283671|1.960747|1.821938|2.659602|2.152585|2.581399|1.868506|1.664308|1.589466|1.672077|1.872090|2.718208|1.557488|3.445289|3.622782|3.185477|24.062251|36.858105| |17.550351|8.837423|5.874709|4.287034|3.964800|4.609018|6.736159|4.981603|3.484953|6.899081|2.731416|0.069793|2.563339|2.216404|2.054602|2.137249|2.443644|2.731593|3.457570|0.077362|2.163164|2.040752|1.852125|2.621038|2.226868|2.447770|1.744303|1.553822|1.436832|1.458952|1.615071|2.424676|1.332022|2.854594|3.033701|2.829689|5.532421|2.692374|0.500000| |17.549621|8.837237|5.880863|4.289403|3.964843|4.605813|6.726202|4.978123|3.478213|6.893658|2.719277|0.070909|2.445592|2.127123|1.935701|1.964627|2.207255|2.505454|3.509312|0.077816|2.163108|2.052128|1.904051|2.757816|2.385041|2.600622|1.850322|1.633515|1.517159|1.557342|1.742440|2.613064|1.421732|3.017540|3.267231|3.018316|5.532387|2.690650|0.302143|0.500000| |17.590239|8.846476|7.234746|4.735036|3.957799|4.175097|5.574752|4.419716|2.971769|5.603107|2.397496|0.063247|2.235710|1.989607|1.847491|1.886721|2.092944|2.307713|3.023127|0.065820|1.908897|1.796757|1.665911|2.386566|2.010054|2.201874|1.620435|1.450121|1.358968|1.395124|1.544636|2.284939|1.287948|2.760486|2.963174|2.736666|5.496073|2.775510|0.301996|0.302005|0.500000| |6.966821|8.942805|17.722790|8.952552|5.670022|4.973545|5.660777|4.940755|3.062349|5.363811|2.497562|0.067806|2.347021|2.141075|1.985645|1.989443|2.151848|2.355076|3.017266|0.063711|1.904654|1.744189|1.621280|2.341041|1.950756|2.199313|1.611080|1.441015|1.362682|1.413313|1.570260|2.301688|1.313454|2.838958|3.043863|2.763260|7.447125|3.903228|0.151614|0.151864|0.221272|0.500000| |4.089131|5.639200|8.929593|17.766207|8.929850|5.641080|4.957827|5.744551|3.296833|5.351046|2.771290|0.078039|2.627434|2.475755|2.280434|2.217946|2.325603|2.535122|3.200081|0.065398|2.022875|1.798802|1.672836|2.431104|2.002008|2.325740|1.691204|1.509769|1.436527|1.502381|1.676110|2.442018|1.400584|3.057622|3.259537|2.909971|12.471249|7.415771|0.099487|0.099556|0.113090|0.217505|0.500000| |7.040082|8.901449|5.674974|4.960224|5.638033|8.976780|17.799572|9.514876|6.841434|14.793304|4.414922|0.108255|3.790145|3.060624|2.671698|2.707948|3.174776|3.896977|5.360819|0.123105|3.060547|2.764790|2.447942|3.548392|3.174709|3.751615|2.296121|1.974668|1.793013|1.827084|2.075502|3.216549|1.630059|3.474087|3.703118|3.406017|7.608808|3.325631|0.191760|0.191207|0.140891|0.124383|0.107715|0.500000| |3.285861|4.289906|4.130882|5.007198|7.835873|9.381495|5.760274|25.999715|9.530519|10.830664|7.640147|0.225242|6.318523|5.395209|4.162896|3.731995|4.000592|5.054457|6.685278|0.127591|3.778621|2.995920|2.649875|3.913024|3.322746|4.491412|2.608377|2.222277|2.038978|2.112640|2.432267|3.749892|1.881431|4.107735|4.284318|3.805479|16.281349|5.612591|0.087446|0.087192|0.080263|0.093497|0.117996|0.143372|0.500000| |2.096618|2.426597|2.349670|2.631250|3.236890|3.469136|2.888957|6.221127|4.797261|6.804106|7.054126|0.228256|8.889465|17.698815|8.934704|5.653309|4.953431|5.632450|7.069012|0.119654|5.181181|3.669355|3.169390|4.405172|3.296826|4.245757|2.968902|2.616567|2.373872|2.377495|2.634216|4.042097|2.093827|4.750966|4.589519|4.177721|6.631976|3.209390|0.058017|0.056839|0.053094|0.057854|0.068148|0.079756|0.148684|0.500000| |1.838349|2.079128|2.039399|2.250893|2.633894|2.732208|2.376934|4.438727|3.333048|5.133566|4.104177|0.114720|5.638348|8.924271|17.733254|8.912430|5.642636|4.948299|4.658567|0.086718|3.638456|2.898986|2.502879|3.306040|2.421242|2.849400|2.251246|2.084557|1.919400|1.888124|2.012743|2.995609|1.709052|3.929164|3.726066|3.491967|5.259017|2.706077|0.051771|0.049129|0.047306|0.051312|0.059556|0.065460|0.100679|0.216061|0.500000| |1.900012|2.105127|2.031501|2.174869|2.477634|2.624836|2.382658|4.086433|3.130790|5.093082|3.547909|0.091197|4.944626|5.649021|8.922542|17.731668|8.911656|5.646012|4.193743|0.083405|3.245087|2.748268|2.303158|2.959549|2.202100|2.513006|1.970457|1.835589|1.674939|1.628284|1.725641|2.582680|1.475824|3.348557|3.214201|3.073186|4.673680|2.390251|0.054898|0.050222|0.048841|0.051454|0.057037|0.066683|0.087296|0.124325|0.214825|0.500000| |2.302112|2.519547|2.332268|2.414392|2.750912|3.089848|2.919322|4.778394|3.862519|6.641568|4.083186|0.096537|5.641358|4.956121|5.645418|8.905567|17.733379|8.941794|4.911038|0.104772|3.625126|3.144191|2.520811|3.213881|2.476966|2.822768|2.068229|1.891972|1.696536|1.643912|1.763063|2.691884|1.472237|3.277454|3.212017|3.086089|4.894004|2.402764|0.068469|0.060578|0.057932|0.058412|0.061444|0.084720|0.095481|0.107553|0.124080|0.214825|0.500000| |2.892713|3.238646|2.842689|2.912235|3.472397|4.324161|4.093581|7.298316|6.999894|12.596398|6.925542|0.140358|8.864756|5.632523|4.946995|5.648399|8.946654|17.713661|8.016594|0.188116|5.110438|4.187152|3.193210|4.179463|3.431168|4.145824|2.575237|2.256580|1.981595|1.933196|2.132500|3.367187|1.694262|3.703885|3.711200|3.523078|5.954634|2.739617|0.085663|0.077418|0.069906|0.068872|0.071203|0.126345|0.133557|0.123698|0.107445|0.124315|0.216452|0.500000| |2.118927|2.327443|2.127878|2.224676|2.617461|3.038287|2.800637|5.232899|4.918947|8.291370|7.239444|0.164678|7.954889|6.460917|5.149518|4.808786|5.334918|6.812648|12.452851|0.217307|17.723339|8.875514|5.532262|6.544133|4.731181|5.589683|3.796637|3.295722|2.742620|2.571901|2.811851|4.614427|2.166321|4.775328|4.588338|4.434068|4.785794|2.300384|0.060280|0.058878|0.052751|0.052853|0.056351|0.083858|0.105147|0.157392|0.117980|0.108710|0.123080|0.168847|0.500000| |1.986291|2.190006|2.030368|2.144394|2.522475|2.866810|2.607334|4.928131|4.442497|7.267034|6.595762|0.181120|5.825341|5.457143|4.221983|3.664102|3.766694|4.555911|12.346768|0.180918|17.622205|8.718950|7.086480|9.220392|5.939959|7.093566|5.363195|4.414224|3.554735|3.322597|3.706987|6.350695|2.689474|5.920449|5.614670|5.354454|4.702066|2.284957|0.055361|0.055871|0.049826|0.050618|0.054806|0.076772|0.101703|0.158282|0.104533|0.086408|0.089527|0.116315|0.302410|0.500000| |2.152250|2.264495|2.014540|2.026750|2.305701|2.719756|2.684729|4.378930|4.134942|8.149125|4.775249|0.113352|4.264208|3.525717|3.046521|3.021292|3.446057|4.183868|9.951884|0.232506|8.833657|17.550245|8.753380|8.888530|6.671760|5.880964|4.454452|3.788754|2.988273|2.723691|2.976890|5.063629|2.244086|4.767112|4.713984|4.715198|4.028800|1.954120|0.061517|0.061740|0.053268|0.050590|0.051066|0.083985|0.083244|0.092255|0.074551|0.073693|0.089117|0.124876|0.201452|0.173924|0.500000| |1.853760|1.962215|1.788711|1.825879|2.070038|2.364497|2.282097|3.798928|3.410989|6.259095|4.171287|0.103643|4.102534|3.662035|3.271531|3.209826|3.491943|3.971724|7.676918|0.153947|8.958335|17.571243|8.956148|7.711002|4.864098|4.557071|4.257876|3.924801|3.088719|2.725590|2.864224|4.705502|2.260475|4.926073|4.656221|4.746121|3.707426|1.832819|0.052895|0.052437|0.046604|0.045280|0.046697|0.069157|0.074993|0.096243|0.081345|0.079180|0.089447|0.109976|0.231379|0.197471|0.306832|0.500000| |1.773373|1.847749|1.683121|1.699863|1.896993|2.151526|2.114776|3.356744|2.936871|5.507850|3.343127|0.087765|2.999382|2.720283|2.410284|2.324133|2.489466|2.832021|6.163245|0.124243|5.453921|8.868836|17.516425|12.267586|6.362032|4.629366|6.320430|5.926597|4.171562|3.478790|3.614146|6.145248|2.752132|5.735730|5.541334|5.893161|3.362843|1.678181|0.049858|0.051321|0.044802|0.042956|0.043618|0.064179|0.065730|0.075133|0.061798|0.058534|0.064918|0.080668|0.124170|0.141393|0.220097|0.210186|0.500000| |1.690790|1.794898|1.660979|1.709044|1.928361|2.156150|2.059728|3.433346|2.966435|5.286933|3.598610|0.097774|3.289954|3.114796|2.733153|2.548684|2.640207|2.974980|6.486075|0.119621|6.528144|8.951658|17.620210|12.589012|5.701075|4.746170|7.381315|7.358360|4.921655|3.960441|4.031040|6.815253|3.067857|6.605879|6.037677|6.351153|3.500925|1.755248|0.047277|0.048339|0.042916|0.042285|0.044147|0.061279|0.069054|0.088264|0.070903|0.063856|0.067235|0.081154|0.144579|0.196388|0.175087|0.227326|0.302893|0.500000| |2.342665|2.465774|2.176513|2.176670|2.472871|2.941968|2.934467|4.671337|4.347419|8.715524|4.605776|0.117125|3.618814|3.049674|2.571778|2.471203|2.744508|3.346028|9.452095|0.207843|5.939794|7.024371|7.312343|12.469197|17.567262|8.810608|5.847056|4.346104|3.427564|3.268055|3.826082|7.029757|2.613800|5.322156|5.598240|5.442800|4.265925|2.055584|0.065086|0.069318|0.057657|0.054470|0.054516|0.092282|0.087295|0.083961|0.064310|0.060765|0.070787|0.099877|0.128903|0.142518|0.227821|0.141756|0.188590|0.145467|0.500000| |2.244340|2.394545|2.159996|2.190281|2.486521|2.880556|2.807497|4.532809|3.956543|7.352949|4.183289|0.116564|3.224798|2.844758|2.383896|2.230227|2.398291|2.866338|7.576707|0.146486|4.720552|4.878163|5.713251|12.548144|17.672312|9.068329|7.547067|4.967578|4.054285|4.135752|5.353512|10.945337|3.190932|6.263515|6.971311|6.470957|4.355467|2.118554|0.060805|0.066771|0.055892|0.054214|0.055347|0.085120|0.086879|0.081636|0.060858|0.055221|0.061384|0.082723|0.104592|0.128344|0.136812|0.106724|0.143041|0.128526|0.304714|0.500000| 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