Version2.1 2021-01-07T07:50:24Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 20-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC(C)CNc1ccc[nH+]c1N2CCN(CC2)C(=O)c3ccc(cn3)C(=O)NCCCOC C13818497 RHF 6-31G(d) (6D,7F) CC(C)CNc1ccc[nH+]c1N2CCN(CC2)C(=O)c3ccc(cn3)C(=O)NCCCOC C01[X(C24H35N6O3)] 198 C1 565 COCCCNC(=O)c1ccc(nc1)C(=O)N1CCN(CC1)c1[nH+]cccc1NCC(C)C COCCCNC(=O)c1ccc(nc1)C(=O)N1CCN(CC1)c1[nH+]cccc1NCC(C)C COCCCNC(=O)c1ccc(nc1)C(=O)N2CCN(CC2)c3[nH+]cccc3NCC(C)C InChIKey=QIBPDZBSRIDDOF-UHFFFAOYSA-O InChI=1S/C24H34N6O3/c1-18(2)16-27-20-6-4-9-25-22(20)29-11-13-30(14-12-29)24(32)21-8-7-19(17-28-21)23(31)26-10-5-15-33-3/h4,6-9,17-18,27H,5,10-16H2,1-3H3,(H,26,31)/p+1 InChI=1/C24H34N6O3/c1-18(2)16-27-20-6-4-9-25-22(20)29-11-13-30(14-12-29)24(32)21-8-7-19(17-28-21)23(31)26-10-5-15-33-3/h4,6-9,17-18,27H,5,10-16H2,1-3H3,(H,26,31)/p+1/fC24H35N6O3/h25-26H/q+1 CC(C)CNc1ccc[nH+]c1N2CCN(CC2)C(=O)c3ccc(cn3)C(=O)NCCCOC C01[X(C24H35N6O3)] 198 C01 565 COCCCNC(=O)c1ccc(nc1)C(=O)N1CCN(CC1)c1[nH+]cccc1NCC(C)C COCCCNC(=O)[C]1[CH][CH][C]([N][CH]1)C(=O)N1CC[N@](CC1)[C]1[NH]C=[CH][CH][C]1NCC(C)C COCCCNC(=O)[C]1[CH][CH][C]([N][CH]1)C(=O)N2CCN(CC2)[C]3NC=C[CH][C]3NCC(C)C InChIKey=KDLCLLVMVGXNBM-UHFFFAOYSA-N InChI=1S/C24H35N6O3/c1-18(2)16-27-20-6-4-9-25-22(20)29-11-13-30(14-12-29)24(32)21-8-7-19(17-28-21)23(31)26-10-5-15-33-3/h4,6-9,17-18,25,27H,5,10-16H2,1-3H3,(H,26,31) InChI=1/C24H35N6O3/c1-18(2)16-27-20-6-4-9-25-22(20)29-11-13-30(14-12-29)24(32)21-8-7-19(17-28-21)23(31)26-10-5-15-33-3/h4,6-9,17-18,25,27H,5,10-16H2,1-3H3,(H,26,31)/f/h26H 3220.8195892128 -1480.3199738 1-A 28998.0983 122 443 565 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.62126 -20.60730 -20.59386 -15.82579 -15.73389 -15.70605 -15.68902 -15.66365 -15.65210 -11.50861 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50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 6 6 6 6 7 6 6 6 6 7 1 6 7 6 6 7 6 6 6 8 6 6 6 6 6 7 6 8 7 6 6 6 8 6 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 1 1 1 1 1 1 1 1 1 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 14.00307 1.00783 12.00000 14.00307 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 15.99491 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 12289.9873 44064.4957 47491.9331 0.99994 -0.00470 -0.01027 0.00431 0.99927 -0.03793 0.01044 0.03788 0.99923 1 0.00705 0.00197 0.00182 0.14685 0.04096 0.03800 12.46 15.39 30.18 38.65 53.30 58.51 65.44 73.16 82.91 90.27 102.41 123.46 127.51 156.59 177.71 183.54 188.34 220.01 235.49 254.78 287.27 314.17 332.70 336.07 338.76 348.03 368.67 388.78 395.73 418.48 424.97 459.22 474.44 514.40 524.39 586.31 597.62 634.67 643.25 662.27 681.80 690.93 694.93 723.19 730.84 753.37 756.04 784.54 814.41 833.14 896.02 905.34 921.91 972.88 993.45 1011.14 1062.89 1123.06 1141.87 1176.27 1183.44 1191.52 1210.59 1223.46 1271.85 1301.03 1315.69 1342.50 1355.54 1357.55 1396.77 1407.86 1429.57 1455.04 1464.66 1470.87 1500.61 1509.45 1513.17 1524.46 1548.47 1561.93 1587.76 1600.71 1610.59 1631.53 1635.73 1639.87 1648.79 1663.64 1688.48 1700.02 1729.25 1740.82 1752.19 1760.64 1798.78 1816.00 1825.02 1828.54 1843.86 1853.25 1856.12 1865.36 1869.58 1870.05 1880.24 1934.70 1940.29 1946.87 1959.59 1987.98 1999.08 2016.30 2018.85 2036.41 2063.53 2068.70 2072.66 2074.85 2080.49 2095.23 2108.99 2130.90 2168.54 2170.04 2198.22 2216.54 2217.52 2232.09 2234.27 2240.31 2250.83 2266.72 2273.97 2295.73 2296.69 2325.60 2346.08 2351.60 2354.60 2357.28 2365.71 2367.32 2368.58 2371.36 2372.92 2379.36 2384.08 2386.17 2386.74 2399.63 2401.69 2403.10 2426.77 2458.68 2487.96 2541.11 2601.56 2611.95 2618.43 2790.55 2812.06 4548.41 4552.13 4561.85 4571.53 4582.23 4588.09 4588.84 4610.55 4614.54 4619.16 4622.69 4624.08 4636.57 4650.64 4669.36 4685.88 4699.26 4703.54 4708.40 4719.96 4729.28 4750.84 4765.13 4801.60 4836.77 4866.17 4886.72 4912.17 4920.14 4935.78 4938.20 4964.93 5483.56 5512.29 5575.06 0.630109 0.661612 0.662556 0.561027 -1479.689865 -1479.658362 -1479.657417 -1479.758947 3.405333D-04 MUNgauss RevisionA2.0 retrievium 07-Jan-2021 DUDE CC(C)CNc1ccc[nH+]c1N2CCN(CC2)C(=O)c3ccc(cn3)C(=O)NCCCOC C13818497 RHF 6-31G(d) (6D,10F) C1 455.277064 |X|Y|Z| 66.756169 51.436327 147.972123 79.795871 19 6 7 15 4 |36.858105| |12.441708|36.858105| |7.548905|12.439953|36.858105| |7.495445|12.438349|7.613509|36.858105| |6.312883|7.714689|5.012288|13.065248|53.358707| |4.411536|5.058060|3.844249|7.728329|18.891077|36.858105| |3.731361|4.307921|3.589787|6.539181|10.652911|13.807098|36.858105| |2.944444|3.274782|2.851303|4.418958|6.984791|7.833043|13.583206|36.858105| |2.696952|2.925668|2.520184|3.738049|6.232756|6.830445|8.020831|14.085177|36.858105| |2.935354|3.143982|2.612412|3.953374|7.197508|8.066190|7.110972|8.193602|14.064111|53.358707| |2.647394|2.783192|2.340222|3.345123|5.900355|5.841078|5.179063|5.920875|9.430995|25.940205|0.500000| |3.640885|3.926292|3.085786|5.080634|10.793916|13.392323|7.966266|6.874936|7.979873|19.465909|0.264919|36.858105| |3.688437|3.821896|2.958364|4.483969|9.254760|7.799788|5.197628|4.599912|5.260763|11.068283|0.212126|13.886018|53.358707| |4.074656|3.851028|2.945488|4.258520|8.369983|6.092454|4.351702|3.807560|4.133951|7.598860|0.149784|7.848479|17.478363|36.858105| |3.881092|3.589663|2.791599|3.640607|6.493149|4.379899|3.348363|2.977475|3.188001|5.511001|0.112836|5.148881|10.566406|12.539587|36.858105| |3.035375|2.924191|2.375672|3.001117|5.157432|3.707865|2.960350|2.752182|3.048936|5.292597|0.114902|4.568509|9.222580|7.858294|13.143362|53.358707| |2.870033|2.913392|2.384439|3.071608|5.324340|3.977374|3.167727|2.986567|3.388314|6.042922|0.134208|5.131907|10.598398|6.632387|7.889031|17.912160|36.858105| |2.933582|3.038516|2.472210|3.406913|6.201325|5.120500|3.973567|3.830962|4.617728|9.273416|0.218046|7.804237|17.677700|7.750178|6.631917|10.689079|12.501041|36.858105| |2.596967|2.473219|2.072410|2.490764|4.078096|2.935149|2.449944|2.320147|2.553629|4.242751|0.092935|3.471526|6.250856|5.237858|7.563825|18.956207|7.875983|5.335089|36.858105| |2.284852|2.219784|1.896273|2.238721|3.594814|2.620139|2.233963|2.148262|2.375950|3.884400|0.086084|3.081300|5.332299|4.116694|5.323621|11.567055|7.063753|4.790685|15.891502|73.516695| |2.532877|2.332947|1.975421|2.315180|3.702457|2.632530|2.238074|2.115274|2.288147|3.696245|0.079620|3.002920|5.118339|4.587868|6.295339|10.418202|4.998331|3.995267|12.613432|14.493340|36.858105| |2.257406|2.083743|1.802440|2.035476|3.160904|2.233056|1.937431|1.838068|1.966548|3.099520|0.066321|2.482544|4.073305|3.479042|4.507577|7.072515|3.908409|3.173839|7.675936|12.017276|13.746424|36.858105| |2.124932|1.934728|1.694968|1.881395|2.872146|2.026985|1.785454|1.697245|1.798327|2.784679|0.059104|2.212136|3.520716|3.024790|3.702747|5.374348|3.108730|2.667760|5.084832|8.137135|8.028624|13.792470|36.858105| |2.195883|1.968569|1.720829|1.927740|2.946614|2.087431|1.845473|1.754692|1.854002|2.859991|0.060452|2.268997|3.567869|3.153233|3.714438|5.122572|2.950157|2.636539|4.517394|6.937671|7.032326|7.981078|13.730283|36.858105| |2.450056|2.181151|1.873821|2.166851|3.384478|2.412628|2.105958|1.996836|2.124114|3.325789|0.070432|2.660901|4.243800|3.935878|4.596267|6.153605|3.391466|3.086993|5.221603|7.473993|8.403925|7.037106|8.017286|13.730826|36.858105| |2.658155|2.397193|2.020087|2.405285|3.868490|2.767979|2.357716|2.226571|2.402083|3.871682|0.082846|3.147273|5.267296|5.060628|6.365698|8.918587|4.431513|3.897890|7.815040|9.863935|14.412623|7.992054|6.889628|7.988274|14.427274|53.358707| |1.990203|1.779529|1.582853|1.736411|2.601240|1.844114|1.659504|1.583889|1.657050|2.507368|0.052621|1.968823|3.009842|2.604621|2.936742|3.966647|2.397747|2.200326|3.329417|5.327695|4.521353|5.071370|7.661911|12.660078|7.470892|6.872267|36.858105| |1.886417|1.691209|1.519452|1.633014|2.416400|1.701561|1.538175|1.464935|1.523137|2.289515|0.047840|1.798765|2.734425|2.326025|2.634511|3.560256|2.193722|2.000658|2.975280|4.869832|3.875213|4.551825|6.752367|8.112446|5.329427|5.522176|15.881351|73.516695| |1.915337|1.713286|1.530499|1.690973|2.527747|1.811600|1.647529|1.583889|1.656511|2.484936|0.052138|1.930409|2.902460|2.507009|2.715388|3.632587|2.232957|2.106777|2.956285|4.743009|3.828904|3.980220|5.228028|7.843393|6.498513|6.116166|14.099480|15.068327|53.358707| |1.725333|1.550016|1.404742|1.527024|2.248895|1.613622|1.487317|1.435289|1.490414|2.204120|0.046034|1.699235|2.511596|2.125362|2.262345|3.018992|1.907827|1.818879|2.414466|3.957309|2.970678|3.110252|3.898414|5.019570|4.351271|4.556583|7.796721|12.206230|17.815715|36.858105| |1.684672|1.515007|1.378466|1.506961|2.212176|1.600566|1.490620|1.446723|1.498397|2.194927|0.045723|1.678248|2.442738|2.059576|2.129278|2.815148|1.801931|1.754639|2.198873|3.600176|2.625924|2.644589|3.130752|3.929947|3.761232|4.097672|5.132392|7.996655|10.617460|12.499845|36.858105| |1.515877|1.372057|1.263673|1.361854|1.975765|1.429777|1.344821|1.308943|1.348036|1.953970|0.040571|1.486496|2.141401|1.775133|1.825580|2.418725|1.575960|1.539635|1.876408|3.115325|2.183645|2.219320|2.577012|3.058790|2.906536|3.310724|3.846297|6.486870|6.818264|7.530089|12.533423|36.858105| |1.474317|1.338743|1.237708|1.338515|1.935754|1.409841|1.337780|1.308677|1.344470|1.932690|0.040044|1.460533|2.080226|1.714675|1.732507|2.286242|1.504059|1.489020|1.749610|2.906059|2.000052|1.995715|2.256841|2.647671|2.608515|3.045040|3.146566|5.239251|5.403216|5.113975|8.082955|13.679054|73.516695| |1.347754|1.231108|1.148224|1.229054|1.763258|1.284209|1.226613|1.202331|1.230417|1.756457|0.036317|1.323198|1.873344|1.526296|1.540033|2.037032|1.355073|1.342933|1.553702|2.602704|1.750631|1.756278|1.964599|2.243953|2.198157|2.620801|2.619978|4.485044|4.271578|3.914696|5.221062|8.135133|24.279649|36.858105| |17.537488|8.781449|6.837882|6.780074|7.568996|4.172033|3.709044|2.943773|2.653282|3.840941|0.070488|3.412058|4.555287|3.713051|3.426002|3.720229|2.579428|2.684619|2.372614|3.727681|2.348514|2.100977|2.007029|2.103469|2.350990|3.411836|1.934105|3.252036|2.569219|1.714693|1.694765|1.530980|2.667961|1.373902|0.500000| |17.569029|8.805703|6.920767|5.473157|6.499518|3.575994|3.094520|2.531116|2.353935|3.476107|0.065162|3.087552|4.354379|3.532864|3.556955|3.869886|2.667751|2.647356|2.492879|3.928190|2.460739|2.237801|2.121857|2.175392|2.381355|3.470145|1.987197|3.389629|2.579653|1.716338|1.662689|1.503324|2.584758|1.333504|0.301879|0.500000| |17.566559|8.717524|5.472365|6.779227|9.524946|4.820655|3.857919|3.061351|2.873074|4.390813|0.081226|4.120549|5.928766|5.144162|4.903029|4.904301|3.303805|3.357976|3.013372|4.601297|2.944979|2.566046|2.393758|2.488593|2.833861|4.259034|2.215361|3.691552|2.888798|1.882607|1.829555|1.625846|2.798502|1.426859|0.301750|0.302165|0.500000| |8.885511|17.478432|8.931412|8.934110|9.752683|4.815336|3.971753|3.104505|2.854253|4.264610|0.078059|3.939410|5.446556|3.935050|3.834870|4.286380|3.187388|3.235404|2.643765|4.237316|2.447431|2.190701|2.006207|2.010015|2.212710|3.350352|1.799811|3.051819|2.332952|1.543879|1.494962|1.352062|2.331536|1.205885|0.173296|0.213282|0.211308|0.500000| |6.813504|8.766663|17.535442|6.874908|6.242501|3.670554|3.568616|2.849981|2.480659|3.435464|0.062669|2.930664|3.754291|2.778260|2.586981|3.006087|2.199485|2.307642|1.941402|3.156732|1.871702|1.709144|1.622906|1.663740|1.814902|2.636368|1.543775|2.630273|2.049968|1.390132|1.375291|1.264935|2.215213|1.158056|0.202045|0.169368|0.139201|0.173613|0.500000| |5.478394|8.741977|17.553552|6.933769|6.374357|3.754603|3.600004|2.887587|2.536604|3.534488|0.064527|3.021281|3.889882|2.751762|2.602966|3.086717|2.326980|2.427211|1.981165|3.260844|1.866108|1.707896|1.598549|1.612131|1.748351|2.574508|1.482211|2.532851|1.951092|1.318522|1.293954|1.189927|2.074350|1.085706|0.139466|0.141310|0.122196|0.213851|0.301083|0.500000| |6.928762|8.800522|17.576652|5.517837|5.618851|3.251063|3.011659|2.470692|2.232683|3.172782|0.058961|2.724529|3.653609|2.716804|2.659568|3.099353|2.261715|2.290996|2.015861|3.289651|1.938361|1.790403|1.691670|1.709273|1.840736|2.680026|1.580007|2.717698|2.067602|1.398956|1.365565|1.255748|2.177848|1.138942|0.170362|0.208886|0.141163|0.213634|0.302130|0.302094|0.500000| |5.481436|8.835468|7.180646|17.487055|12.318773|6.944058|6.589555|4.543652|3.760903|5.237529|0.090362|4.719922|5.546716|3.673744|3.202255|3.745848|2.902701|3.235083|2.308585|3.756784|2.123160|1.885194|1.739004|1.766701|1.965084|2.963067|1.597540|2.683546|2.117379|1.412851|1.394325|1.267819|2.218392|1.151603|0.140435|0.123161|0.138294|0.211685|0.176882|0.216443|0.144485|0.500000| |6.945489|8.869491|6.838904|17.557987|12.494981|6.881537|6.661521|4.514362|3.688872|5.112315|0.088271|4.611801|5.409495|3.913055|3.292216|3.718996|2.747885|3.069962|2.306816|3.686392|2.185527|1.927896|1.805851|1.873195|2.110175|3.141031|1.705569|2.845690|2.285173|1.525113|1.519946|1.377191|2.422574|1.252393|0.205882|0.141367|0.171317|0.174725|0.202313|0.167516|0.140272|0.301547|0.500000| |6.148485|7.389337|4.747857|9.175541|25.962940|9.593872|5.904718|4.345110|4.133851|6.795825|0.118805|7.557039|10.583426|6.834804|5.662322|5.978525|4.598421|5.146354|3.368814|5.242798|2.983153|2.530743|2.260421|2.286116|2.618472|4.149965|1.991512|3.295889|2.599698|1.687473|1.641360|1.461371|2.526158|1.292628|0.140275|0.135665|0.199064|0.224060|0.115594|0.124180|0.113396|0.203217|0.181559|0.500000| |3.892615|4.636384|4.031803|7.349428|9.638904|8.969978|17.776089|8.929374|5.712413|6.914214|0.111415|5.649262|5.693489|3.706552|2.984119|3.574282|2.766727|3.309099|2.214290|3.605083|2.052182|1.801301|1.675410|1.732340|1.956535|2.937476|1.574160|2.611043|2.128524|1.423088|1.428950|1.297719|2.299547|1.191520|0.110254|0.089254|0.106884|0.113891|0.114659|0.113430|0.091407|0.217089|0.229627|0.147401|0.500000| |2.651336|2.940125|2.658954|3.849931|5.655720|5.605451|8.838971|17.771196|9.038871|7.846368|0.128660|4.957210|4.973824|3.150428|2.554730|3.245325|2.563970|3.170829|2.054704|3.414566|1.895219|1.668800|1.554628|1.608147|1.812025|2.711105|1.467383|2.423527|2.005950|1.347596|1.365017|1.244353|2.222441|1.154797|0.074695|0.064170|0.075143|0.076920|0.074993|0.075485|0.064308|0.112253|0.112186|0.099409|0.215135|0.500000| |2.344278|2.513695|2.213183|3.093930|4.963261|4.941437|5.632583|8.841321|17.796967|12.544760|0.230788|5.756030|5.883043|3.526659|2.826611|3.786256|3.091760|4.104833|2.389156|4.014091|2.149685|1.864665|1.712070|1.762806|2.004976|3.060303|1.584462|2.591170|2.165741|1.438726|1.451350|1.310897|2.331835|1.203732|0.064321|0.057800|0.068998|0.068523|0.060728|0.062083|0.055187|0.087015|0.085324|0.093936|0.123975|0.210780|0.500000| |3.463407|3.241307|2.581864|3.592094|6.591780|5.136015|3.983383|3.678859|4.117410|7.467024|0.155220|6.713352|12.283820|17.533067|8.905801|9.607867|5.796604|6.952197|5.180294|7.254064|4.754456|3.539224|3.124197|3.349533|4.342335|7.661739|2.756401|4.292333|3.681334|2.270013|2.221861|1.893677|3.264946|1.621451|0.091019|0.084836|0.117323|0.090213|0.068974|0.067310|0.066550|0.087802|0.095412|0.139893|0.094336|0.085622|0.100241|0.500000| |5.072604|4.587775|3.373211|5.136202|10.487073|6.890046|4.797072|3.959421|4.049171|6.996818|0.129884|7.387189|12.345453|17.661701|8.860852|7.710287|4.969617|5.640884|4.200512|6.065937|3.914790|3.106151|2.790999|2.951950|3.631751|5.970104|2.504136|4.006551|3.308417|2.085954|2.039430|1.767432|3.050827|1.530990|0.128864|0.116400|0.188596|0.125013|0.089061|0.085428|0.085229|0.116157|0.132899|0.222498|0.115883|0.091199|0.094373|0.300472|0.500000| |3.817321|3.356052|2.659400|3.315579|5.621248|3.763420|2.994821|2.681753|2.830858|4.711145|0.096404|4.217346|7.674100|8.958825|17.745762|12.409182|5.691669|4.957940|7.136172|8.803803|7.354590|5.113198|4.308849|4.478258|5.818444|11.261423|3.440320|5.396309|4.277285|2.559904|2.384526|2.013643|3.368013|1.668321|0.095318|0.099217|0.134978|0.097326|0.069351|0.067978|0.071350|0.080437|0.085602|0.129627|0.075669|0.065027|0.070663|0.217758|0.213183|0.500000| |4.405112|4.130207|3.129572|4.008930|7.059486|4.429950|3.355009|2.909263|3.035642|5.130842|0.102303|4.884969|9.509606|8.885173|17.498660|12.458971|7.144312|5.840838|6.119964|8.409019|5.129364|4.035206|3.357202|3.287628|3.846500|6.694591|2.674315|4.373586|3.341416|2.084566|1.957523|1.701840|2.871227|1.448413|0.103110|0.113414|0.155843|0.128369|0.078556|0.080788|0.083402|0.097622|0.097205|0.184242|0.084526|0.069655|0.074320|0.174234|0.215614|0.301431|0.500000| |2.472550|2.512084|2.113363|2.634595|4.395851|3.331240|2.772646|2.687272|3.073675|5.292188|0.120995|4.190006|7.676266|4.962199|5.708843|12.526525|17.692629|8.886319|7.688966|14.948983|4.801708|3.907999|3.078688|2.863785|3.211933|5.595087|2.336611|3.816684|2.957306|1.864024|1.754266|1.540111|2.608560|1.325494|0.062546|0.064686|0.077466|0.075799|0.054510|0.057721|0.056085|0.070244|0.066406|0.102131|0.067974|0.065236|0.080296|0.129987|0.109148|0.127613|0.145314|0.500000| |3.040226|3.160867|2.572309|3.265979|5.588590|4.000389|3.166614|2.916331|3.209931|5.558278|0.117789|4.861802|9.498855|5.810426|7.085906|12.387186|17.524326|8.877710|6.267549|10.403306|4.329878|3.575014|2.884155|2.709690|3.037695|5.203972|2.239019|3.700752|2.821629|1.791171|1.688411|1.489639|2.526285|1.287846|0.074351|0.079112|0.096249|0.099293|0.064750|0.070216|0.068036|0.086605|0.079182|0.139885|0.077954|0.069876|0.080619|0.133713|0.130604|0.144267|0.213486|0.301671|0.500000| |2.736444|2.928984|2.428737|3.325490|5.874194|4.986210|4.028485|3.989107|4.891725|9.545862|0.224392|7.285529|12.427937|5.632100|4.975512|7.722310|8.896956|17.576317|4.292866|7.290175|3.318807|2.756402|2.349959|2.305584|2.631664|4.360902|1.961968|3.208594|2.564311|1.650039|1.597217|1.417113|2.445533|1.250083|0.069738|0.068873|0.084594|0.087210|0.062777|0.067526|0.062260|0.090860|0.082658|0.133673|0.093018|0.091998|0.122341|0.141842|0.126847|0.109170|0.131587|0.211784|0.218137|0.500000| |2.644275|2.683047|2.226452|3.003779|5.295362|4.462281|3.658262|3.686615|4.603265|9.078525|0.242198|6.627733|12.215122|6.880982|5.764942|9.584287|8.914522|17.467090|5.281571|8.509790|4.075563|3.205771|2.718645|2.723518|3.231773|5.561510|2.270071|3.627997|2.994243|1.891449|1.835736|1.602613|2.763597|1.396414|0.068657|0.066630|0.083647|0.077651|0.058636|0.060507|0.057549|0.079093|0.077490|0.116246|0.084943|0.085913|0.118428|0.203184|0.141169|0.129146|0.133654|0.218647|0.174439|0.298696|0.500000| |2.139813|2.006974|1.749009|1.953169|3.011309|2.127053|1.852619|1.761646|1.884745|2.959315|0.063403|2.359354|3.856862|3.168181|4.075866|6.608765|3.874502|3.067208|7.156186|13.105019|8.921105|17.774495|8.866297|5.648468|5.043033|7.765418|4.112371|6.932387|4.521815|2.715282|2.333199|2.003946|3.221240|1.615376|0.055005|0.059266|0.066758|0.059220|0.045814|0.046378|0.048434|0.050758|0.051041|0.067401|0.047953|0.044553|0.049810|0.087725|0.078690|0.121520|0.105551|0.111033|0.100755|0.075459|0.084871|0.500000| |1.949559|1.784500|1.583876|1.725301|2.596709|1.830617|1.629060|1.552392|1.636245|2.505036|0.053002|1.976868|3.098317|2.600715|3.116450|4.499202|2.716189|2.349407|4.119326|6.950195|5.668185|8.877185|17.751776|8.939572|5.682772|6.756175|7.156974|13.287855|6.592235|3.844482|3.019439|2.546662|3.919712|1.940485|0.051288|0.054570|0.060140|0.051435|0.042164|0.041623|0.044175|0.044592|0.046070|0.056578|0.042748|0.039769|0.043462|0.073896|0.067542|0.098034|0.080745|0.075511|0.071262|0.058518|0.066155|0.211177|0.500000| |2.467982|2.175967|1.875273|2.179264|3.387673|2.429609|2.141981|2.034881|2.152470|3.334889|0.070114|2.652510|4.124367|3.856452|4.200032|5.386686|3.080877|2.925695|4.262202|6.248838|5.916571|5.038068|5.665654|8.875378|17.721276|12.754392|6.826505|8.665397|9.636294|4.713305|4.294592|3.205144|5.171916|2.402620|0.066950|0.066115|0.079127|0.060382|0.050983|0.048402|0.050950|0.054620|0.059803|0.071489|0.055429|0.051463|0.056447|0.121330|0.101749|0.145553|0.098219|0.080388|0.077025|0.069695|0.085757|0.109085|0.124269|0.500000| |1.927994|1.733868|1.541483|1.731835|2.612802|1.893611|1.722495|1.666915|1.756833|2.643507|0.055824|2.039031|3.065253|2.656717|2.831590|3.820182|2.343132|2.234916|3.101232|4.950995|4.004832|3.986657|4.977831|7.442793|7.126017|6.654548|9.432830|10.938812|26.063878|9.061922|7.371933|4.696477|6.998511|3.083352|0.052878|0.052434|0.059596|0.048088|0.042189|0.040192|0.042208|0.044255|0.047845|0.054660|0.045132|0.042992|0.047012|0.081333|0.070881|0.090589|0.069897|0.063439|0.059633|0.055207|0.065748|0.091792|0.123065|0.232016|0.500000| |1.746147|1.558809|1.418909|1.520257|2.220716|1.578315|1.454293|1.394208|1.437393|2.121170|0.044023|1.646337|2.430751|2.056290|2.204150|2.907580|1.841119|1.747689|2.310324|3.783592|2.824926|2.989745|3.748919|4.675472|3.999279|4.266527|7.254763|13.150608|12.593228|17.626178|8.817330|6.812403|8.339030|3.763390|0.048217|0.048687|0.052701|0.043120|0.039007|0.036882|0.039486|0.039026|0.042171|0.046339|0.038866|0.036405|0.038399|0.060165|0.056588|0.069466|0.057148|0.049732|0.048508|0.044182|0.049955|0.073212|0.104935|0.118187|0.181337|0.500000| |1.592852|1.446308|1.316452|1.427139|2.099181|1.512673|1.398787|1.357114|1.414032|2.086924|0.043781|1.598468|2.361278|1.969454|2.101433|2.854231|1.822738|1.730786|2.306947|3.849888|2.804761|3.000330|3.756078|4.560213|3.856042|4.173482|6.748126|11.472810|12.373889|17.534635|8.807730|6.873672|8.381617|3.785687|0.043816|0.044061|0.048042|0.040193|0.036110|0.034508|0.036440|0.036913|0.039467|0.043854|0.037157|0.035478|0.038110|0.058259|0.053294|0.065131|0.054011|0.049997|0.047561|0.043874|0.050089|0.074030|0.106390|0.111237|0.201086|0.303541|0.500000| |1.648219|1.494235|1.356189|1.500802|2.217429|1.621168|1.513271|1.480714|1.544888|2.263232|0.047452|1.714889|2.491904|2.091479|2.140895|2.863494|1.839564|1.803660|2.240380|3.682600|2.658231|2.643412|3.078005|3.843999|3.784785|4.173181|4.731389|7.156079|9.632452|8.829636|17.519048|8.961164|13.198725|4.901099|0.046026|0.044855|0.049810|0.040980|0.037576|0.035497|0.037128|0.038672|0.042048|0.045629|0.040093|0.038805|0.041785|0.063463|0.057027|0.066058|0.054188|0.050006|0.047483|0.045573|0.052981|0.064773|0.081466|0.120780|0.216798|0.173062|0.209852|0.500000| |1.814653|1.614913|1.465619|1.605383|2.354046|1.696591|1.578792|1.523940|1.569734|2.298182|0.047573|1.767511|2.563751|2.186384|2.240479|2.905993|1.851979|1.815923|2.235175|3.612955|2.664439|2.628144|3.065645|3.895418|3.894502|4.242575|4.882348|7.514215|9.674140|8.860548|17.554692|8.928878|13.105558|4.879579|0.051059|0.049641|0.054882|0.043982|0.040779|0.038011|0.040282|0.041007|0.045223|0.048287|0.042127|0.039896|0.042016|0.065605|0.060843|0.070275|0.057154|0.049577|0.048275|0.045760|0.052607|0.064067|0.080683|0.128639|0.190569|0.212001|0.173194|0.302578|0.500000| |1.523393|1.372592|1.269368|1.351777|1.948272|1.399354|1.315532|1.273267|1.303804|1.887934|0.039015|1.444457|2.080579|1.725081|1.784023|2.346459|1.529658|1.488492|1.814842|3.010538|2.108638|2.158240|2.511498|2.948152|2.770486|3.170566|3.735412|6.550118|6.295798|6.851010|8.832126|17.478176|16.553011|7.284930|0.042773|0.042251|0.045210|0.037555|0.035313|0.033126|0.035205|0.034929|0.037974|0.040063|0.035422|0.033648|0.035101|0.050616|0.048016|0.054771|0.046594|0.041390|0.040446|0.038130|0.042705|0.054385|0.069628|0.083978|0.115615|0.202900|0.170078|0.174189|0.212857|0.500000| |1.421169|1.296464|1.196470|1.287766|1.869132|1.356394|1.277009|1.247800|1.289628|1.868877|0.038961|1.415728|2.042569|1.678119|1.733775|2.325990|1.523843|1.482595|1.819710|3.054178|2.108439|2.170354|2.523507|2.931711|2.734095|3.145077|3.676546|6.327880|6.301593|6.865452|8.826957|17.477326|16.557071|7.288384|0.039685|0.039191|0.042258|0.035646|0.033174|0.031427|0.033047|0.033458|0.036037|0.038520|0.034187|0.032986|0.034969|0.049634|0.046089|0.052745|0.044977|0.041675|0.040007|0.038042|0.042930|0.054906|0.070292|0.081762|0.121035|0.168578|0.205763|0.212983|0.173858|0.301455|0.500000| |1.321935|1.210994|1.132260|1.214860|1.739357|1.272179|1.222314|1.202390|1.228406|1.743732|0.036004|1.307861|1.838614|1.491739|1.490359|1.967741|1.316618|1.314937|1.489605|2.495979|1.662269|1.651940|1.824151|2.073429|2.064015|2.492211|2.364207|4.015642|3.812390|3.335955|4.369046|5.865855|16.891337|17.625701|0.037597|0.036200|0.038765|0.032839|0.031831|0.029773|0.031112|0.031662|0.034524|0.035260|0.033027|0.032192|0.033459|0.044096|0.041675|0.044609|0.038942|0.035741|0.034753|0.034088|0.038037|0.042310|0.049732|0.062875|0.077864|0.088696|0.089088|0.119011|0.118468|0.147605|0.147664|0.500000| 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