Version2.2 2021-02-22T17:34:14Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 07-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE COc1ccc(c(c1)C[NH+]2CCC(CC2)(Cc3cccc(c3)C(F)(F)F)CO)F C12575094 RHF 6-31G(d) (6D,7F) COc1ccc(c(c1)C[NH+]2CCC(CC2)(Cc3cccc(c3)C(F)(F)F)CO)F C01[X(C22H26F4N1O2)] 159 C1 487 COc1ccc(c(c1)C[NH+]1CCC(CC1)(CO)Cc1cccc(c1)C(F)(F)F)F COc1ccc(c(c1)C[NH+]1CCC(CC1)(CO)Cc1cccc(c1)C(F)(F)F)F COc1ccc(F)c(C[NH+]2CCC(CO)(CC2)Cc3cccc(c3)C(F)(F)F)c1 InChIKey=BKJWOFDKLWVZHY-UHFFFAOYSA-O InChI=1S/C22H25F4NO2/c1-29-19-5-6-20(23)17(12-19)14-27-9-7-21(15-28,8-10-27)13-16-3-2-4-18(11-16)22(24,25)26/h2-6,11-12,28H,7-10,13-15H2,1H3/p+1 InChI=1/C22H25F4NO2/c1-29-19-5-6-20(23)17(12-19)14-27-9-7-21(15-28,8-10-27)13-16-3-2-4-18(11-16)22(24,25)26/h2-6,11-12,28H,7-10,13-15H2,1H3/p+1/fC22H26F4NO2/h27H/q+1 COc1ccc(c(c1)C[NH+]2CCC(CC2)(Cc3cccc(c3)C(F)(F)F)CO)F C01[X(C22H26F4N1O2)] 159 C01 487 COc1ccc(c(c1)C[NH+]1CCC(CC1)(CO)Cc1cccc(c1)C(F)(F)F)F CO[C]1[CH][CH][C]([C]([CH]1)C[NH]1CC[C@](CC1)(CO)C[C]1[CH][CH][CH][C]([CH]1)C(F)(F)F)F CO[C]1[CH][CH][C](F)[C]([CH]1)C[NH]2CCC(CO)(CC2)C[C]3[CH][CH][CH][C]([CH]3)C(F)(F)F InChIKey=IQTZYOBBHCKFAA-UHFFFAOYSA-N InChI=1S/C22H26F4NO2/c1-29-19-5-6-20(23)17(12-19)14-27-9-7-21(15-28,8-10-27)13-16-3-2-4-18(11-16)22(24,25)26/h2-6,11-12,27-28H,7-10,13-15H2,1H3 InChI=1/C22H26F4NO2/c1-29-19-5-6-20(23)17(12-19)14-27-9-7-21(15-28,8-10-27)13-16-3-2-4-18(11-16)22(24,25)26/h2-6,11-12,27-28H,7-10,13-15H2,1H3 2801.5862929854 -1449.9686936 1-A 20200.7018 108 379 487 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -26.44670 -26.40218 -26.39715 -26.39701 -20.69499 -20.66187 -15.83924 -11.56773 -11.44390 -11.44371 -11.43171 -11.43092 -11.42060 -11.38759 -11.38696 -11.37462 -11.37355 -11.37241 -11.36474 -11.36401 -11.36096 -11.35697 -11.34753 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0.8153 0.8559 0.2675 0.4773 0.8571 0.0322 0.0252 0.6670 0.7968 0.8016 0.8559 0.1612 0.0553 0.8519 0.4781 0.8497 0.8504 0.5448 0.8540 0.6690 0.3786 0.4745 0.4383 0.6392 0.3558 0.3317 0.3047 0.4663 298.150 1.00000 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 6 8 6 6 6 6 6 6 6 7 1 6 6 6 6 6 6 6 6 6 6 6 6 6 9 9 9 6 8 9 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 18.99840 18.99840 18.99840 12.00000 15.99491 18.99840 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 3830.9164 36021.1613 36623.0296 0.99995 -0.00706 -0.00695 0.00666 0.99841 -0.05595 0.00733 0.05590 0.99841 1 0.02261 0.00240 0.00237 0.47110 0.05010 0.04928 12.12 14.99 27.97 37.68 46.35 78.92 108.17 118.56 128.18 175.84 202.44 220.35 238.83 274.62 286.83 309.95 343.90 347.66 360.40 386.18 386.95 424.43 434.39 468.68 499.49 516.25 528.18 549.86 594.71 615.15 623.51 647.19 661.09 670.74 699.34 724.67 735.09 750.97 792.32 812.74 870.76 907.04 913.93 931.89 968.86 1014.59 1018.50 1046.61 1117.17 1123.99 1133.48 1152.35 1187.54 1202.17 1239.87 1264.16 1306.52 1361.69 1372.10 1377.73 1424.99 1444.97 1454.71 1462.63 1483.95 1503.28 1513.29 1539.73 1557.33 1564.13 1571.26 1585.04 1614.45 1621.87 1656.13 1673.01 1678.80 1698.92 1712.75 1743.56 1749.83 1761.48 1793.93 1798.90 1819.27 1850.73 1858.63 1859.14 1878.23 1904.67 1905.45 1927.85 1936.36 1941.06 1948.74 1970.49 1983.32 2010.48 2021.06 2039.92 2050.89 2101.75 2113.07 2121.52 2127.27 2135.59 2151.58 2165.01 2194.25 2209.93 2240.01 2255.49 2297.91 2301.19 2307.33 2319.40 2322.25 2344.21 2348.38 2352.41 2357.54 2367.20 2375.03 2375.63 2381.52 2395.85 2403.21 2424.13 2429.48 2586.24 2588.61 2629.75 2629.79 4578.00 4615.48 4621.60 4628.95 4635.64 4635.79 4670.39 4696.34 4707.43 4719.25 4734.28 4737.08 4776.70 4791.42 4803.55 4815.25 4816.87 4827.40 4855.21 4872.31 4879.09 4899.60 4916.24 4928.26 5316.02 5913.23 0.490263 0.515569 0.516513 0.430189 -1449.478430 -1449.453124 -1449.452180 -1449.538505 2.895355D-04 MUNgauss RevisionA2.1 retrievium 22-Feb-2021 DUDE COc1ccc(c(c1)C[NH+]2CCC(CC2)(Cc3cccc(c3)C(F)(F)F)CO)F C12575094 RHF 6-31G(d) (6D,10F) C1 412.189967 |X|Y|Z| 133.556916 32.209908 36.409302 53.904217 20 6 7 19 1 |36.858105| |13.524598|73.516695| |8.000900|25.336546|36.858105| |6.691245|14.007525|13.734759|36.858105| |4.497009|9.243875|7.912260|13.696885|36.858105| |3.807477|8.290989|6.923796|8.015227|13.936222|36.858105| |3.975599|9.431236|7.889647|6.841580|7.897226|13.740978|36.858105| |5.255043|14.654295|13.642292|7.927415|6.874283|8.024019|13.802396|36.858105| |3.105155|7.008585|5.004145|4.441189|5.041112|7.606285|12.648155|7.550605|36.858105| |2.684556|5.802732|3.991199|3.750097|4.358524|6.190607|7.603984|5.298627|12.659148|53.358707| |2.649702|5.609074|3.927423|3.908316|4.832171|7.093070|7.301546|4.928013|9.380554|25.694643|0.500000| |2.744414|5.932804|3.948715|3.620418|3.972831|5.099962|6.210721|5.081656|7.593975|17.275318|0.258420|36.858105| |2.326622|4.809828|3.104994|2.981559|3.298172|3.984216|4.316696|3.676097|4.954534|10.436770|0.199716|12.499054|36.858105| |2.003234|4.086215|2.588173|2.489827|2.746354|3.289389|3.546063|3.042566|4.300665|8.657106|0.162840|7.380252|12.317802|36.858105| |1.995393|4.083677|2.628576|2.552601|2.888411|3.577141|3.822286|3.133725|4.962052|10.393322|0.199308|6.523570|7.633757|12.360231|36.858105| |2.245289|4.717306|3.092474|2.927872|3.319039|4.333778|4.975105|3.888332|7.649283|17.256938|0.259368|7.709864|6.553737|7.407179|12.502472|36.858105| |1.920823|3.922394|2.415673|2.263712|2.413364|2.828656|3.157256|2.843901|3.829924|6.846728|0.121417|6.029496|7.555718|12.221375|7.364168|5.935137|36.858105| |1.685251|3.391752|2.062004|1.946390|2.067475|2.384661|2.617851|2.384878|3.143542|5.250646|0.096236|4.161800|4.832497|7.204498|5.911849|4.785661|12.552114|36.858105| |1.640092|3.305367|2.005081|1.884909|2.000197|2.316175|2.561410|2.332013|3.140635|5.026405|0.091322|3.713787|3.960368|5.439618|5.433775|4.826820|7.507044|13.690547|36.858105| |1.470962|2.926755|1.758038|1.664443|1.757916|2.001347|2.178344|2.007760|2.597323|4.007960|0.074877|2.927341|3.108450|4.017367|4.083282|3.684895|4.994998|7.880155|13.773220|36.858105| |1.367086|2.692405|1.608215|1.534012|1.615562|1.813681|1.946189|1.808488|2.258360|3.488618|0.066466|2.607367|2.849757|3.623326|3.503911|3.073318|4.411812|6.802435|7.938917|13.750994|36.858105| |1.392382|2.737553|1.636330|1.565525|1.648963|1.844376|1.969362|1.832036|2.258283|3.558454|0.068218|2.747601|3.125487|4.025109|3.619197|3.060882|5.009863|7.900242|6.920371|7.983195|13.775897|36.858105| |1.533679|3.040807|1.830471|1.745196|1.844358|2.082541|2.239607|2.069160|2.589761|4.215973|0.079975|3.366899|3.995779|5.456971|4.461602|3.628494|7.554894|13.751619|8.002400|6.902649|7.925430|13.748252|36.858105| |1.280573|2.490029|1.478700|1.424753|1.494516|1.646985|1.736542|1.630101|1.944809|3.023218|0.058931|2.346937|2.675226|3.268247|2.931126|2.511782|3.811894|5.054115|4.475329|5.039668|7.565046|12.661653|7.681782|36.858105| |1.190890|2.304822|1.362635|1.314256|1.374765|1.507276|1.585506|1.494923|1.768704|2.698311|0.052742|2.059339|2.288849|2.732887|2.546647|2.238561|3.115670|4.003501|3.859463|4.632807|6.984769|8.114956|5.278257|14.450751|97.533100| |1.283332|2.489388|1.467284|1.408061|1.464083|1.601695|1.694446|1.609581|1.875627|2.894876|0.056257|2.297966|2.611906|3.077280|2.682805|2.344818|3.654949|4.536583|3.897903|4.144124|5.518504|8.145346|6.620181|14.392204|20.095001|97.533100| |1.262691|2.444774|1.459455|1.420525|1.500714|1.649160|1.715569|1.599222|1.905974|2.991862|0.059282|2.314553|2.697389|3.295653|2.951397|2.467320|3.610774|4.509104|3.905048|4.185035|5.613062|8.152049|6.493525|14.359213|20.101593|20.176695|97.533100| |1.790624|3.565647|2.233523|2.200630|2.429424|2.804545|2.886165|2.525623|3.293176|6.042183|0.123879|4.917145|7.663623|12.374936|7.627327|4.913899|7.441488|6.020195|4.523032|3.667561|3.557472|4.156221|5.546363|3.550659|6.543459|7.433592|8.595792|36.858105| |1.620274|3.203315|1.992518|1.967878|2.170083|2.491282|2.552851|2.241889|2.943185|5.161353|0.105698|3.878511|5.152025|7.959296|7.007609|4.506653|6.123132|6.228789|4.946237|4.192011|4.147129|4.812397|6.057989|4.040421|7.444386|7.932527|10.130131|13.661986|73.516695| |3.008528|6.236387|4.648399|5.270650|8.095692|14.141455|8.155432|5.306328|6.900201|9.013694|0.246774|4.975998|4.172022|3.562161|4.084661|4.843831|2.932994|2.495527|2.427792|2.098543|1.900242|1.930087|2.177385|1.718957|3.535510|3.717562|3.909985|3.079980|4.916024|97.533100| |17.674244|16.978720|5.891691|4.891724|3.610854|3.201046|3.414652|4.428458|2.794260|3.320342|0.066130|2.517665|2.155497|1.878249|1.859604|2.081411|1.829584|1.617672|1.578327|1.423008|1.325555|1.348250|1.478563|1.243523|2.609709|2.815506|2.747375|1.683501|2.720960|5.876729|0.500000| |17.581032|16.420505|7.051647|6.696910|4.565605|3.764084|3.795192|4.778439|2.977371|3.477061|0.070805|2.540246|2.172780|1.896503|1.917365|2.159837|1.807370|1.601033|1.569416|1.415405|1.314501|1.332334|1.458799|1.226642|2.577159|2.752736|2.727315|1.705115|2.768242|6.757988|0.299929|0.500000| |17.578155|16.415637|7.007450|6.684113|4.549932|3.742789|3.769039|4.742637|2.950489|3.586153|0.073171|2.742735|2.365531|2.013259|1.982463|2.194080|1.914882|1.672479|1.611409|1.445012|1.351699|1.386514|1.531866|1.281406|2.673442|2.896984|2.856670|1.818324|2.904919|6.730345|0.299989|0.298237|0.500000| |7.395496|12.472196|8.875994|17.776537|8.963065|5.702119|4.940467|5.630080|3.553756|4.238692|0.090298|3.056019|2.613234|2.213805|2.250949|2.521691|2.028363|1.765583|1.708625|1.524673|1.416667|1.447627|1.602629|1.329272|2.769543|2.964862|2.988789|1.996427|3.195018|9.580152|0.144998|0.221005|0.222674|0.500000| |3.881435|7.429386|5.625865|8.856932|17.746513|8.995629|5.639971|4.955145|4.121684|5.137344|0.119072|3.451799|3.017876|2.557876|2.696493|2.999996|2.230278|1.935163|1.869745|1.659298|1.536866|1.571053|1.746461|1.435023|2.978016|3.156694|3.265446|2.325032|3.722978|16.542141|0.088490|0.112096|0.111903|0.215105|0.500000| |4.888574|13.606410|8.966551|5.662533|4.954158|5.667030|8.888402|17.730640|6.917115|6.718364|0.121149|4.928262|3.552090|3.002047|3.052662|3.811130|2.917267|2.454354|2.418093|2.077213|1.860471|1.876493|2.117353|1.662112|3.433916|3.708968|3.631670|2.465513|3.910877|9.580805|0.122202|0.120804|0.119820|0.124268|0.107584|0.500000| |2.831207|6.183496|4.316500|4.010019|4.659375|6.813747|8.892475|5.902283|17.622532|12.450205|0.222685|5.601686|4.172079|3.883170|4.773264|7.391925|3.455007|2.967807|3.053868|2.571711|2.221367|2.186312|2.461161|1.884244|3.893546|4.046168|4.164055|3.073073|5.059136|15.639651|0.071126|0.077369|0.074316|0.091305|0.109987|0.150998|0.500000| |3.077144|7.042638|4.732277|3.964924|4.178847|5.597121|8.863003|7.235892|17.640869|12.375234|0.182351|7.075728|4.624685|4.129894|4.567646|6.893033|3.960545|3.263187|3.309367|2.717224|2.336108|2.319353|2.657348|1.982985|4.064418|4.328634|4.309674|3.129778|5.007615|11.200758|0.078687|0.080858|0.080070|0.090270|0.096343|0.218945|0.301586|0.500000| |2.706013|5.905361|3.781269|3.327561|3.492764|4.329149|5.534845|4.942699|7.020062|12.448508|0.181954|17.631690|8.720845|6.583249|5.749127|7.055898|6.555729|4.466306|4.033825|3.123853|2.741747|2.866588|3.522338|2.417347|4.777539|5.369795|5.249355|4.405072|6.416597|9.215254|0.070232|0.069061|0.074047|0.078876|0.084173|0.144398|0.145722|0.216120|0.500000| |3.156556|6.936901|4.748101|4.323736|4.680521|5.900188|7.173682|6.070764|7.119505|12.376831|0.223409|17.653482|8.816095|5.424968|4.897342|5.622812|4.618846|3.408380|3.077588|2.516255|2.282343|2.406433|2.883716|2.106308|4.197016|4.691109|4.699103|4.114999|5.864118|11.905637|0.079107|0.079820|0.088874|0.099449|0.109829|0.155800|0.144086|0.179370|0.302288|0.500000| |2.298849|4.706418|2.960894|2.819364|3.020544|3.492133|3.785590|3.414678|4.123775|7.613820|0.145797|8.984547|17.558552|8.724987|5.517970|4.902745|7.106035|4.605716|3.671708|2.940345|2.763579|3.100685|3.998894|2.707242|5.168327|6.110744|6.121860|6.767068|8.175499|7.925789|0.059721|0.058980|0.065532|0.069717|0.077096|0.093269|0.097055|0.111288|0.212311|0.214438|0.500000| |2.322762|4.732202|3.100633|3.093417|3.531738|4.232843|4.273039|3.562582|4.633446|9.441456|0.212398|8.956653|17.519988|8.789021|6.793427|5.721649|5.505676|3.994735|3.383812|2.761269|2.570994|2.806784|3.468338|2.464692|4.795061|5.386847|5.713958|7.341091|8.885556|10.404771|0.059154|0.060730|0.066354|0.075647|0.091760|0.092360|0.111495|0.114400|0.173474|0.218303|0.304605|0.500000| |1.814799|3.676669|2.326988|2.256649|2.518352|3.042088|3.240944|2.735082|4.132639|7.590757|0.145639|4.891832|5.526575|8.773448|17.631507|8.957332|6.846228|6.651155|6.646746|4.960070|4.114724|4.113006|4.931853|3.224638|6.332575|6.433079|7.262091|6.736388|13.484560|7.725995|0.047380|0.048689|0.049881|0.055955|0.065925|0.075046|0.114831|0.109550|0.128759|0.107806|0.123092|0.138959|0.500000| |1.971782|3.991010|2.595116|2.591073|3.007473|3.715674|3.753398|3.028024|4.625451|9.367799|0.210825|5.686331|6.793132|8.827477|17.518173|8.926607|5.431737|4.599573|4.257701|3.444176|3.067346|3.183208|3.791392|2.680874|5.298578|5.525955|6.233690|7.340239|12.197815|10.089682|0.050675|0.053023|0.054788|0.063726|0.079589|0.079866|0.126993|0.112916|0.132246|0.127746|0.138825|0.197641|0.305865|0.500000| |2.177517|4.534445|2.982024|2.869835|3.301887|4.321918|4.780714|3.693437|7.209973|12.389537|0.225048|5.626049|4.916711|5.439784|8.826761|17.623704|4.542461|4.000882|4.233594|3.420681|2.855778|2.779077|3.166421|2.313986|4.727527|4.822416|5.139138|4.110298|7.090447|11.347521|0.055952|0.059068|0.058723|0.068909|0.083904|0.099184|0.233303|0.173072|0.144521|0.126875|0.108024|0.128571|0.213540|0.218049|0.500000| |2.223765|4.702777|3.009774|2.766178|3.023619|3.831342|4.608156|3.825083|7.073470|12.444802|0.182308|7.049911|5.758352|6.589041|8.718199|17.626829|6.420657|5.260263|5.600916|4.102841|3.299769|3.226206|3.821563|2.597186|5.221372|5.484287|5.598702|4.396949|7.281265|9.051196|0.057974|0.059062|0.059818|0.066546|0.075302|0.109222|0.184562|0.209734|0.213370|0.144469|0.128785|0.132648|0.211867|0.173143|0.301942|0.500000| |2.062667|4.281972|2.632819|2.411353|2.542671|3.014942|3.501648|3.181233|4.397919|7.647217|0.127165|6.812403|6.987180|8.760390|6.721652|6.570966|17.548525|8.999920|7.176431|4.755790|4.004393|4.259966|5.746634|3.304485|6.306934|7.218698|6.918097|5.457033|8.338166|6.869922|0.054691|0.053677|0.056545|0.059455|0.064215|0.092851|0.107690|0.132865|0.237596|0.140637|0.180029|0.140469|0.170314|0.137409|0.135814|0.224127|0.500000| |1.909068|3.869588|2.353223|2.203875|2.317594|2.657149|2.942024|2.720538|3.405402|5.864117|0.106809|5.505211|7.151938|8.889818|5.460886|4.621597|17.547722|8.963046|5.691425|4.236270|3.999872|4.772053|7.237695|3.841544|6.952862|8.733707|8.204605|6.862264|9.514497|6.090939|0.050757|0.049524|0.053297|0.055320|0.059665|0.077710|0.084437|0.097965|0.166360|0.124535|0.223452|0.147056|0.139799|0.123540|0.102666|0.135743|0.306418|0.500000| |1.747314|3.559425|2.171534|2.022988|2.149784|2.526275|2.848185|2.571416|3.621030|5.711647|0.100719|4.048834|4.058623|5.359207|5.847960|5.788373|6.942095|8.888734|17.690675|8.972760|5.658422|4.974993|5.666218|3.571951|7.163149|7.226527|7.226452|4.171320|7.792211|5.939789|0.046606|0.046512|0.047323|0.050515|0.055315|0.074615|0.098648|0.108101|0.124686|0.091893|0.101762|0.095778|0.195158|0.123812|0.140826|0.204564|0.213066|0.143613|0.500000| |1.432466|2.845454|1.704348|1.612303|1.699379|1.930669|2.102272|1.943694|2.507502|3.762286|0.070434|2.682669|2.766457|3.443238|3.647591|3.449388|4.078636|5.623756|8.926877|17.729856|8.926673|5.666989|4.968474|4.097764|9.018559|7.791981|7.874818|3.129965|6.285985|4.548822|0.038570|0.038472|0.038887|0.041087|0.044584|0.055999|0.070106|0.073173|0.079498|0.064804|0.072312|0.069191|0.121930|0.087189|0.091958|0.107232|0.112644|0.097484|0.216934|0.500000| |1.273462|2.491242|1.480655|1.416924|1.487838|1.656229|1.765775|1.650698|2.024917|3.072489|0.059075|2.277594|2.459333|3.023333|2.973061|2.661596|3.534012|4.918660|5.647096|8.906993|17.761580|8.913722|5.640894|6.968431|17.857390|11.508606|11.782367|3.013289|6.209725|3.899277|0.034395|0.034128|0.034955|0.036546|0.039493|0.047124|0.055749|0.058055|0.066167|0.056236|0.066504|0.062638|0.095573|0.074152|0.070078|0.078680|0.091098|0.091030|0.124456|0.214862|0.500000| |1.536965|3.032431|1.822140|1.745271|1.840692|2.059739|2.196158|2.040023|2.486916|4.065851|0.078161|3.349090|4.128136|5.393416|4.137274|3.353855|7.006046|8.918836|5.667204|4.967763|5.653525|8.956301|17.718274|7.198643|10.890259|15.908236|15.203853|5.971375|10.723699|4.827536|0.041145|0.040464|0.042953|0.044696|0.048582|0.057682|0.064966|0.070297|0.095847|0.080968|0.119857|0.100418|0.120441|0.100802|0.081053|0.095881|0.145371|0.216981|0.124187|0.107794|0.124375|0.500000| |1.741937|3.447074|2.128198|2.084884|2.259599|2.555108|2.645509|2.378610|2.947651|5.184429|0.104563|4.439901|6.728122|8.817458|5.538116|4.047154|7.138400|5.849408|4.216455|3.499026|3.524233|4.319822|5.948952|3.819376|6.853238|8.292152|9.317281|17.518406|16.437093|6.144186|0.045794|0.045806|0.049365|0.052989|0.060056|0.065112|0.075654|0.079386|0.114542|0.106729|0.193621|0.173301|0.141364|0.144905|0.095145|0.105495|0.144001|0.215440|0.105483|0.082312|0.083161|0.200634|0.500000| |1.832783|3.627550|2.295578|2.306810|2.588976|2.973189|2.961986|2.562395|3.283593|6.024254|0.131030|4.804568|7.443668|8.830263|6.721749|4.601860|5.484060|4.511998|3.663940|3.074191|2.982197|3.382859|4.220192|3.005823|5.704707|6.365829|7.355977|17.506385|16.591220|7.502125|0.047501|0.048632|0.052093|0.058248|0.069733|0.068158|0.085355|0.084344|0.113898|0.116507|0.178785|0.240887|0.157536|0.209815|0.110294|0.110214|0.123517|0.145210|0.097141|0.075149|0.072178|0.125772|0.302037|0.500000| |1.521375|2.978401|1.839264|1.827355|2.004696|2.261907|2.293307|2.039716|2.583565|4.389925|0.090834|3.326031|4.317475|5.898450|5.223986|3.689674|4.928860|5.158975|4.199121|3.771196|3.922113|4.661111|5.541625|4.190304|7.696659|8.182281|11.229273|9.800327|35.736528|5.617130|0.040029|0.040673|0.042779|0.046784|0.054213|0.055548|0.069617|0.068848|0.086487|0.081000|0.111920|0.119583|0.154756|0.147579|0.093071|0.094537|0.108500|0.127788|0.102778|0.089372|0.094217|0.161432|0.233370|0.222220|0.500000| 1448.135802 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