Version2.1 2021-01-07T08:05:49Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 15-Dec-2020 # opt=maxstep=1 freq hf/6-31g(d) iop(6/10=2,6/11=2,6/12=2) DUDE Cc1cccn2c1[nH+]c3c(c2=O)C[C@@]4([C@@H]5N3CCc6c5cccc6)C(=O)NC(=O)N(C4=O)C C17027413 RHF 6-31G(d) (6D,7F) Cc1cccn2c1[nH+]c3c(c2=O)C[C@@]4([C@@H]5N3CCc6c5cccc6)C(=O)NC(=O)N(C4=O)C C01[X(C24H30N5O4)] 183 C1 555 O=C1NC(=O)[C@@]2(C(=O)N1C)Cc1c(N3[C@@H]2c2ccccc2CC3)[nH+]c2n(c1=O)cccc2C O=C1NC(=O)[C@@]2(C(=O)N1C)Cc1c(N3[C@@H]2c2ccccc2CC3)[nH+]c2n(c1=O)cccc2C CC1CCCN2C1[NH+]C3C(C[C@@]4([C@@H]5N3CCc6ccccc56)C(=O)NC(=O)N(C)C4=O)C2=O InChIKey=HAGRYJHILMZKBZ-TUDMEYJHSA-N InChI=1S/C24H29N5O4/c1-13-6-5-10-29-18(13)25-19-16(20(29)30)12-24(21(31)26-23(33)27(2)22(24)32)17-15-8-4-3-7-14(15)9-11-28(17)19/h3-4,7-8,13,16-19,25H,5-6,9-12H2,1-2H3,(H,26,31,33)/q+1/t13?,16?,17-,18?,19?,24-/m1/s1 InChI=1/C24H29N5O4/c1-13-6-5-10-29-18(13)25-19-16(20(29)30)12-24(21(31)26-23(33)27(2)22(24)32)17-15-8-4-3-7-14(15)9-11-28(17)19/h3-4,7-8,13,16-19,25H,5-6,9-12H2,1-2H3,(H,26,31,33)/q+1/t13?,16?,17-,18?,19?,24-/m1/s1/f/h26H Cc1cccn2c1[nH+]c3c(c2=O)C[C@@]4([C@@H]5N3CCc6c5cccc6)C(=O)NC(=O)N(C4=O)C C01[X(C24H30N5O4)] 183 C01 555 O=C1NC(=O)[C@@]2(C(=O)N1C)Cc1c(N3[C@@H]2c2ccccc2CC3)[nH+]c2n(c1=O)cccc2C C[C@H]1CCCN2[C@H]1[NH2][C@@H]1[C@@H](C2=O)C[C@@]2([C@@H]3[N@@]1CC[C]1[C]3[CH][CH][CH][CH]1)C(=O)NC(=O)N(C2=O)C C[C@H]1CCCN2[C@H]1[NH2][C@@H]3[C@H](C[C@@]4([C@H]5[C]6[CH][CH][CH][CH][C]6CCN35)C(=O)NC(=O)N(C)C4=O)C2=O InChIKey=QXNUKQGAABDHRF-ARCUHTLASA-N InChI=1S/C24H30N5O4/c1-13-6-5-10-29-18(13)25-19-16(20(29)30)12-24(21(31)26-23(33)27(2)22(24)32)17-15-8-4-3-7-14(15)9-11-28(17)19/h3-4,7-8,13,16-19H,5-6,9-12,25H2,1-2H3,(H,26,31,33)/t13-,16-,17+,18+,19-,24+/m0/s1 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40.16 59.05 64.01 75.48 92.10 109.86 115.46 125.70 155.73 165.87 194.77 222.52 231.84 240.66 248.74 263.03 321.62 339.51 364.99 383.98 391.45 417.82 422.79 458.50 466.56 490.39 522.37 546.54 559.06 581.20 620.52 624.41 641.88 674.26 678.22 703.47 719.34 724.57 732.50 761.25 802.33 818.79 847.88 860.74 884.45 951.21 995.10 1017.79 1026.13 1033.24 1056.26 1089.77 1099.36 1131.29 1166.91 1191.25 1207.45 1216.03 1220.69 1225.45 1252.42 1261.86 1288.72 1313.86 1333.39 1369.09 1383.26 1395.15 1425.34 1428.50 1474.60 1493.47 1500.76 1519.48 1543.70 1548.24 1550.16 1580.81 1602.07 1619.49 1626.67 1649.01 1663.25 1678.40 1681.16 1688.48 1710.46 1725.38 1736.58 1744.96 1770.29 1787.78 1797.89 1824.33 1832.93 1846.08 1861.17 1874.71 1892.72 1896.20 1915.28 1941.75 1943.17 1968.81 1983.41 1994.78 2011.44 2027.68 2058.86 2068.52 2072.52 2083.59 2101.73 2109.76 2123.53 2142.77 2166.51 2176.70 2189.23 2197.69 2199.52 2211.08 2213.24 2224.45 2236.58 2241.59 2251.45 2258.50 2268.29 2284.63 2295.70 2299.10 2329.89 2336.07 2340.03 2342.69 2356.33 2360.26 2363.41 2366.34 2367.22 2377.60 2381.19 2402.73 2404.18 2413.13 2563.94 2610.15 2624.10 2799.88 2875.10 2883.37 2928.52 4560.74 4573.03 4600.40 4622.75 4628.46 4633.36 4638.62 4648.69 4649.70 4678.69 4686.29 4696.57 4706.46 4706.76 4719.47 4720.39 4751.91 4756.47 4797.03 4814.37 4815.23 4826.00 4831.16 4861.41 4886.14 4902.40 4919.07 5317.24 5420.93 5501.99 0.578144 0.604314 0.605258 0.522021 -1497.273521 -1497.247351 -1497.246407 -1497.329644 2.791783D-04 MUNgauss RevisionA2.0 retrievium 07-Jan-2021 DUDE Cc1cccn2c1[nH+]c3c(c2=O)C[C@@]4([C@@H]5N3CCc6c5cccc6)C(=O)NC(=O)N(C4=O)C C17027413 RHF 6-31G(d) (6D,10F) C1 452.229780 |X|Y|Z| 62.193517 95.761580 32.456505 57.820173 27 6 7 22 5 |36.858105| |12.436984|36.858105| |7.455741|12.467133|36.858105| |4.921456|7.673990|12.506229|36.858105| |4.316014|6.433910|7.599030|12.542621|36.858105| |4.962005|7.594405|6.664793|7.609978|12.850347|53.358707| |7.444340|12.387107|7.477818|6.473094|7.404136|18.125460|36.858105| |6.518117|7.438130|5.701181|4.766446|5.525967|10.923719|12.434107|53.358707| |7.563633|6.990678|5.206236|4.139674|4.433077|7.937930|8.953777|25.764621|0.500000| |4.406392|4.877496|4.045113|3.761402|4.610773|9.018827|7.523478|17.071227|0.253675|36.858105| |3.798436|4.519422|3.805846|3.862105|5.053839|10.628445|7.115415|10.293639|0.160963|12.451069|36.858105| |3.844944|5.041611|4.533884|5.075362|7.874957|18.788413|7.916014|9.249346|0.140506|7.557961|12.521964|36.858105| |3.156458|4.000609|3.864987|4.562546|7.080952|11.501631|5.419210|6.663758|0.108434|5.458194|7.976369|16.011439|73.516695| |2.937280|3.328722|2.974652|3.063929|3.896487|6.889329|4.548856|6.831039|0.117444|7.778153|12.421117|7.537321|12.204473|36.858105| |2.729085|2.915695|2.593345|2.568254|3.076861|5.207500|3.775060|6.065087|0.112419|6.910892|7.310059|4.855311|7.841824|12.008027|36.858105| |3.101258|3.178477|2.709988|2.583529|2.985108|5.170652|4.105276|6.856548|0.135436|7.817833|6.833943|4.438086|6.729446|7.336267|12.214770|36.858105| |3.053215|3.157521|2.647574|2.554550|2.931793|5.124450|4.066171|6.247578|0.123237|6.524427|6.722392|4.395104|6.661830|6.916763|9.201189|17.558068|0.500000| |4.011389|4.034580|3.311299|3.027092|3.471995|6.250117|5.438634|10.576571|0.217049|13.243868|7.699887|5.020790|7.121403|6.325722|7.403695|12.829870|0.254139|53.358707| |4.453931|4.174001|3.257157|2.904325|3.164805|5.603834|5.246196|8.898190|0.209988|7.538152|5.708223|4.176447|5.995821|4.602379|5.069972|8.080958|0.219128|17.738804|36.858105| |3.616205|3.258254|2.683314|2.396549|2.554422|4.247812|3.759388|6.220147|0.148045|5.075166|4.048915|3.171854|4.802645|3.640721|4.296419|6.574690|0.170965|10.725004|12.464401|36.858105| |2.883174|2.713256|2.325905|2.138343|2.321184|3.790891|3.159728|5.184937|0.115178|4.567418|3.802950|2.951544|4.607081|3.748319|4.890555|7.634657|0.184773|9.454522|7.477088|12.563523|36.858105| |2.728053|2.680884|2.329227|2.192533|2.448983|4.034909|3.234614|5.328732|0.111730|5.164617|4.433857|3.292175|5.188063|4.745795|7.204180|12.474797|0.250945|10.681657|6.621901|7.482193|13.651285|36.858105| |2.285901|2.265536|2.023983|1.934350|2.156779|3.444059|2.669833|4.266087|0.087975|3.973969|3.615256|2.828975|4.631289|4.121511|6.227355|7.397689|0.171093|7.025268|4.466827|5.007354|7.953856|13.721559|36.858105| |2.066085|2.012781|1.814283|1.724592|1.886371|2.949941|2.299554|3.616395|0.075938|3.175237|2.889239|2.361887|3.901890|3.172549|4.289504|4.957695|0.123405|5.414031|3.709960|4.436070|6.854285|7.880820|13.762725|36.858105| |2.130609|2.026459|1.812927|1.698295|1.826813|2.851611|2.272627|3.570947|0.076983|3.021363|2.692908|2.227487|3.638435|2.818369|3.610164|4.412263|0.112505|5.231717|3.840079|5.034324|7.892866|6.820515|7.960910|13.784522|36.858105| |2.474512|2.306697|2.021658|1.864132|1.993318|3.159325|2.590668|4.127275|0.091442|3.456428|2.984031|2.432431|3.888435|2.995348|3.776096|5.039585|0.128523|6.327447|4.978793|7.631538|13.732703|7.922138|6.934596|7.983055|13.777539|36.858105| |2.316024|2.461266|2.208503|2.221063|2.607379|4.261693|3.056485|4.583175|0.087095|4.578564|5.193869|3.875325|6.599661|7.788084|12.460957|7.654431|0.214264|6.767257|4.027755|3.626070|4.245350|6.014688|6.086729|4.317162|3.507324|3.495560|36.858105| |2.291687|2.428521|2.148545|2.163925|2.504153|4.111874|2.987648|4.316622|0.083021|4.139332|4.833830|3.661201|6.169425|6.351911|7.988969|6.764791|0.228809|6.236482|4.030236|3.619842|4.142308|5.503518|5.357954|4.033022|3.398946|3.437633|16.015961|73.516695| |2.026966|2.149566|1.979839|2.007055|2.342551|3.681289|2.595740|3.872869|0.073899|3.676580|4.043563|3.291874|5.859333|5.806739|7.763802|5.219446|0.139224|5.232600|3.186974|2.980153|3.494200|4.679217|5.275925|4.025294|3.199633|3.052423|13.968073|15.173433|53.358707| |1.949501|2.060196|1.934781|1.956579|2.282373|3.505312|2.458194|3.740630|0.071401|3.492899|3.658121|3.093489|5.585478|5.075685|6.537058|4.516412|0.113358|4.852569|2.908170|2.762356|3.229469|4.217640|4.868426|3.862240|3.065530|2.882565|7.710116|9.588129|18.786333|36.858105| |1.743681|1.837191|1.746592|1.774536|2.046211|3.071098|2.147121|3.216087|0.061829|2.885211|3.013565|2.655590|4.870269|3.940517|4.649964|3.535710|0.091048|3.977486|2.465818|2.376824|2.744426|3.415715|3.966586|3.380015|2.729358|2.529370|5.413004|7.591297|11.616620|16.070904|73.516695| |2.145762|2.261513|2.131131|2.129077|2.501859|3.862724|2.725413|4.321159|0.082055|4.141078|4.081891|3.404739|6.033157|5.610358|7.611347|5.114540|0.119020|5.675305|3.226885|3.046767|3.552590|4.696271|5.196842|4.019897|3.235378|3.104355|6.711071|8.416103|11.060478|13.747135|14.948970|53.358707| |2.531236|2.672241|2.467864|2.429912|2.891564|4.643963|3.333397|5.548930|0.103971|5.834601|5.405217|4.159897|7.010066|7.581004|12.448364|7.387257|0.154492|8.029228|4.133711|3.755434|4.340421|6.027164|5.894230|4.263401|3.526958|3.556559|7.434696|9.230363|9.352047|7.802753|9.610811|18.928040|36.858105| |2.740835|2.864403|2.674512|2.579509|3.053533|4.857645|3.550755|6.281175|0.118115|6.455703|5.222735|4.181294|6.888240|6.219300|8.034901|6.465840|0.134217|8.498179|4.255216|3.875197|4.304759|5.510453|5.089761|3.929062|3.416559|3.537079|5.196467|7.214103|6.534987|5.420851|7.539320|11.641345|15.929178|73.516695| |1.989637|2.079934|2.006378|1.997487|2.314205|3.452350|2.436916|3.866605|0.074231|3.484195|3.320232|2.936962|5.267207|4.146806|4.959700|3.869920|0.091782|4.687027|2.755255|2.659407|3.038225|3.741042|4.126652|3.490811|2.902715|2.759318|4.420799|6.166176|7.017833|7.763890|12.302758|17.614459|7.861176|12.751123|36.858105| |17.600148|8.870570|6.781150|4.588184|3.809774|5.586291|5.481407|6.510067|0.147736|3.527870|3.159451|3.254169|4.918200|2.532752|2.365372|2.646701|0.072973|4.460786|3.630091|3.098005|2.524247|2.380490|2.034701|1.866279|1.932702|2.221195|2.053359|3.632775|2.478120|1.755745|2.821641|2.604496|2.213696|4.226916|1.791746|0.500000| |17.534923|8.702449|5.433203|4.082361|3.791348|6.215672|6.882326|8.501949|0.213013|4.522085|3.895626|3.729572|5.410989|3.009443|2.852818|3.363538|0.093632|5.970311|5.320125|4.230812|3.219506|2.973328|2.446439|2.211173|2.306188|2.731538|2.435445|4.343245|2.861234|1.995747|3.158955|2.969187|2.585961|4.909841|1.996896|0.303748|0.500000| |17.522351|8.686942|6.772776|4.487062|4.066221|6.217234|6.458198|9.341899|0.239359|4.523819|3.679215|3.666730|5.414624|2.909943|2.759456|3.136144|0.083287|5.629359|4.432634|3.720757|2.979691|2.803521|2.352067|2.133597|2.207629|2.567775|2.308319|3.996511|2.771762|1.986375|3.157923|3.020695|2.630405|5.190407|2.083696|0.304452|0.299191|0.500000| |6.977501|8.897591|17.578606|8.821942|5.518369|6.663209|5.484615|6.085009|0.120072|3.346773|3.156904|3.625514|5.675670|2.553342|2.276683|2.393216|0.065329|3.907022|2.894766|2.457558|2.130786|2.106035|1.847181|1.678521|1.691047|1.882113|1.975125|3.439923|2.430075|1.746645|2.828157|2.597128|2.177783|4.172896|1.811315|0.207653|0.141294|0.174576|0.500000| |4.647661|7.056327|8.885756|17.548966|8.857898|8.984774|5.835191|5.665401|0.103049|3.407578|3.613117|4.636818|7.487171|2.886325|2.426221|2.456964|0.068826|3.849672|2.785507|2.304088|2.051395|2.093749|1.850927|1.656927|1.636105|1.795748|2.141733|3.769639|2.626983|1.859403|3.008570|2.712023|2.255519|4.181323|1.855851|0.124693|0.110854|0.112433|0.212728|0.500000| |3.567257|4.968455|5.539568|8.832162|17.685091|12.528934|5.669447|5.999436|0.101437|3.995024|4.667111|7.367119|13.830754|3.789918|2.941749|2.787659|0.077231|4.235909|2.849555|2.332774|2.155749|2.295450|2.051158|1.796850|1.728241|1.865891|2.564821|4.412470|3.167421|2.254417|3.621277|3.299842|2.743169|5.021571|2.235275|0.089899|0.090049|0.092783|0.123656|0.219592|0.500000| |2.676658|3.042355|2.727646|2.870379|3.600302|6.177460|4.019629|5.609604|0.099100|5.657509|8.913023|6.575750|11.593350|17.653028|8.655964|5.947473|0.174919|6.778743|4.012394|3.253634|3.359032|4.163785|3.749341|2.952841|2.622903|2.752910|8.053056|12.947070|8.206535|4.881162|6.930725|6.618592|5.770464|8.382591|3.658403|0.065219|0.076614|0.072413|0.065940|0.076950|0.101159|0.500000| |2.771489|3.167707|2.953683|3.097163|4.032395|6.705328|4.206787|6.358125|0.108337|6.647755|8.898527|7.353441|13.632715|17.626472|8.662180|5.577081|0.140686|7.042567|3.848743|3.166092|3.266230|4.030728|3.662691|2.901725|2.576314|2.694346|6.195986|8.837444|7.348168|5.228600|7.345765|8.242898|7.727513|11.771718|4.633586|0.067008|0.076988|0.077332|0.070268|0.079601|0.109904|0.305441|0.500000| |5.858410|5.095135|3.767033|3.211671|3.390926|5.996558|6.144304|10.376334|0.283682|6.991138|5.228303|4.155639|5.893713|4.027527|4.145127|5.725967|0.155426|12.228072|17.587755|8.967264|5.556239|4.893189|3.609542|3.123003|3.274496|4.147064|3.355085|5.949296|3.747536|2.563162|3.932340|3.876727|3.564559|6.725880|2.505447|0.126159|0.209054|0.160604|0.092975|0.085305|0.082918|0.098445|0.097183|0.500000| |4.103446|3.998100|3.097721|2.842888|3.104346|5.541138|5.036642|7.481307|0.162680|6.367472|5.769728|4.201024|6.060291|4.654769|4.945527|7.525821|0.252515|12.216916|17.477390|8.767940|6.326252|5.949972|4.211100|3.505316|3.576452|4.477184|4.189408|7.903668|4.409586|2.860684|4.326664|4.171076|3.817198|6.660600|2.581629|0.095246|0.137390|0.108092|0.076934|0.077547|0.079349|0.118516|0.104986|0.303973|0.500000| |3.780249|3.278365|2.740594|2.395107|2.515078|4.095042|3.653411|6.238078|0.155799|4.759081|3.663283|2.986396|4.548790|3.280834|3.782848|5.296741|0.132292|9.185757|8.918358|17.545933|8.976160|5.964864|4.371474|4.036575|4.668272|6.837702|3.161657|5.483623|3.659113|2.566881|3.973748|3.920400|3.517846|6.740161|2.595370|0.090099|0.120988|0.112650|0.070242|0.063284|0.063109|0.080765|0.081867|0.229424|0.175196|0.500000| |3.433223|3.054113|2.508673|2.249010|2.355893|3.864103|3.404997|5.275730|0.123844|4.124008|3.520092|2.849339|4.364344|3.173194|3.623819|5.152192|0.146019|7.765326|8.874728|17.557368|8.867856|5.778691|4.274463|3.986892|4.667486|6.931871|3.231993|5.935760|3.662597|2.470571|3.840943|3.610292|3.155045|5.677917|2.335769|0.083768|0.114038|0.095612|0.064859|0.060993|0.060347|0.081375|0.077040|0.206929|0.222413|0.303421|0.500000| |2.154407|2.178116|1.971007|1.914172|2.161348|3.426239|2.582899|4.070820|0.081833|3.840334|3.649464|2.879065|4.816568|4.443887|6.999450|6.751768|0.159436|6.327142|3.889429|4.061936|5.637641|8.861653|17.775384|9.052862|5.692840|4.989330|7.598854|10.791234|9.715300|6.564344|9.034026|9.047157|6.899770|9.582005|4.880937|0.053456|0.063242|0.061331|0.049811|0.050837|0.057688|0.113684|0.111346|0.089470|0.104157|0.100562|0.098332|0.500000| |1.858407|1.823159|1.664774|1.596030|1.743955|2.688441|2.064718|3.200055|0.066542|2.772233|2.578518|2.156063|3.620427|2.871912|3.771826|4.049307|0.103010|4.515833|3.084211|3.548353|4.943419|5.628950|8.936452|17.730871|8.909429|5.660303|3.952101|6.543444|5.341005|3.866210|6.245853|5.289286|3.867619|6.282620|3.472294|0.047042|0.054732|0.053232|0.042962|0.042655|0.046485|0.075401|0.074404|0.073988|0.082103|0.091707|0.090707|0.219639|0.500000| |1.944146|1.841358|1.662825|1.559128|1.661730|2.558311|2.030037|3.143949|0.067805|2.593511|2.338881|1.980289|3.262841|2.434451|3.010578|3.533350|0.092018|4.328595|3.219559|4.113284|5.628901|4.925750|5.651838|8.910771|17.730703|8.921191|2.968717|5.160720|3.785578|2.698313|4.382136|3.827909|2.984603|5.187008|2.595183|0.049572|0.058166|0.055958|0.043450|0.041838|0.043813|0.063629|0.062671|0.078762|0.084241|0.109756|0.110363|0.125019|0.214031|0.500000| |2.472738|2.256111|1.976052|1.804793|1.899097|2.981792|2.471993|3.885125|0.087566|3.116503|2.695870|2.250048|3.595788|2.641267|3.181290|4.118816|0.108130|5.511722|4.573921|7.147056|8.940683|5.641687|4.982496|5.668081|8.942195|17.699667|2.953369|5.232159|3.554543|2.482256|3.936278|3.621871|3.014338|5.424304|2.417525|0.062319|0.076365|0.071366|0.051647|0.048470|0.049270|0.067960|0.066632|0.111441|0.114719|0.193697|0.202423|0.108117|0.124347|0.215659|0.500000| |1.864716|1.973368|1.823446|1.857833|2.144514|3.325983|2.344483|3.421976|0.065781|3.137845|3.478005|2.925520|5.262183|4.691798|5.668433|4.287801|0.119665|4.463301|2.834084|2.683172|3.114933|3.988738|4.533235|3.677447|2.963672|2.795788|9.420103|13.863002|25.915952|9.455460|14.071533|8.033931|5.051649|6.820760|4.270060|0.046959|0.053791|0.051732|0.046044|0.050067|0.059751|0.142238|0.122023|0.068802|0.081275|0.067319|0.068764|0.162615|0.102321|0.072927|0.067306|0.500000| |1.794959|1.875274|1.816323|1.821756|2.091983|3.083002|2.168172|3.355049|0.064760|2.953756|2.891420|2.604634|4.736973|3.580008|4.162311|3.321119|0.081455|3.997910|2.429621|2.366622|2.701073|3.266835|3.689790|3.233430|2.685094|2.508848|4.019237|5.753056|6.747241|7.709618|14.907734|12.498010|5.765520|9.142553|17.732504|0.045328|0.050104|0.051862|0.045926|0.047401|0.056795|0.091525|0.109627|0.061670|0.064228|0.063940|0.058759|0.122343|0.092267|0.067835|0.061552|0.119830|0.500000| |2.048721|2.167432|2.125047|2.131630|2.496775|3.665120|2.539897|4.031166|0.076227|3.575372|3.411238|3.122569|5.693556|4.185977|4.605232|3.612936|0.086347|4.583312|2.683733|2.537078|2.802278|3.362673|3.524832|3.008687|2.589921|2.523557|3.958085|5.646208|6.012437|6.052499|9.777494|12.365409|7.022905|12.720617|17.646265|0.051224|0.056396|0.059824|0.053005|0.054458|0.066908|0.101289|0.137140|0.069003|0.069629|0.069457|0.061969|0.111167|0.081939|0.064752|0.062377|0.103477|0.299595|0.500000| |2.006855|2.060753|1.981749|1.939893|2.212311|3.304654|2.387956|3.855767|0.075520|3.423986|3.125731|2.743516|4.810116|3.725070|4.580794|3.855058|0.089940|4.756581|2.814224|2.793280|3.240595|3.930547|4.402339|3.824697|3.183517|2.992504|4.005137|5.733871|6.036061|6.018952|9.631384|12.388747|7.087134|12.919087|17.656573|0.050212|0.056098|0.058987|0.049953|0.049995|0.058678|0.090671|0.111428|0.071122|0.071991|0.076905|0.067632|0.139533|0.105682|0.079096|0.072568|0.104022|0.299211|0.300719|0.500000| |8.972934|17.543721|9.005577|7.237419|5.861208|9.150571|9.165987|7.618755|0.147537|4.172453|4.154308|4.669082|6.766832|3.118064|2.715946|2.945161|0.083576|4.875727|3.807576|3.009916|2.527292|2.497487|2.129728|1.901901|1.915073|2.168494|2.357498|4.211531|2.803171|1.951736|3.111631|2.863747|2.449087|4.560043|1.925372|0.219848|0.211189|0.173459|0.215199|0.221513|0.135891|0.081615|0.081620|0.125556|0.106279|0.082449|0.080429|0.057070|0.048072|0.048567|0.059113|0.053076|0.048720|0.055390|0.052700|0.500000| |6.668919|8.758861|17.474726|8.806662|6.900798|8.276264|6.678236|8.265146|0.154057|4.223246|3.776598|4.407412|6.754098|3.009064|2.659126|2.761628|0.073230|4.647476|3.257365|2.722356|2.380312|2.390186|2.082743|1.867123|1.862624|2.071974|2.230104|3.797301|2.741617|1.997406|3.203590|3.042599|2.599796|5.131546|2.132677|0.163371|0.137674|0.197087|0.304029|0.173333|0.139525|0.075156|0.084510|0.103908|0.083719|0.078604|0.069561|0.056350|0.047600|0.047424|0.056110|0.051190|0.053222|0.063331|0.058865|0.174183|0.500000| |4.055587|5.538270|8.802360|17.580903|8.979801|7.613944|4.816385|5.350066|0.097084|3.227016|3.284927|4.205754|7.127388|2.729329|2.320968|2.304951|0.062905|3.608692|2.527453|2.141538|1.939025|1.990067|1.781984|1.601947|1.575396|1.712812|2.029006|3.496557|2.537362|1.837988|2.994294|2.718380|2.242036|4.242197|1.903838|0.108869|0.094727|0.106970|0.212054|0.303494|0.208069|0.071398|0.078086|0.076639|0.068425|0.059874|0.055954|0.049209|0.041484|0.040428|0.046155|0.048147|0.048521|0.056809|0.051351|0.145942|0.210571|0.500000| |3.935645|5.366309|6.623034|8.870511|17.542099|12.365215|6.135950|7.356444|0.120407|4.603220|4.784373|7.033569|12.056897|3.880819|3.104946|2.952992|0.078573|4.669131|3.031708|2.494535|2.300687|2.445051|2.173974|1.902000|1.832422|1.985069|2.595058|4.339711|3.224106|2.358821|3.767698|3.582860|3.034899|5.830946|2.480601|0.096691|0.095831|0.108583|0.138323|0.174484|0.304182|0.097169|0.116572|0.089287|0.080779|0.069064|0.063188|0.060837|0.049019|0.046333|0.052353|0.059823|0.061850|0.075782|0.065789|0.129873|0.195371|0.223511|0.500000| |6.668388|8.929497|5.548475|5.054143|5.620656|12.518796|17.651589|12.571778|0.217912|7.238241|7.465113|7.121394|8.861096|4.685619|3.943486|4.477616|0.129768|7.942745|6.147024|4.152474|3.412659|3.468246|2.811742|2.409725|2.391216|2.756717|3.255600|5.828204|3.671035|2.490233|3.849269|3.688944|3.313105|6.073554|2.376868|0.141206|0.199134|0.154269|0.124977|0.137820|0.133075|0.118403|0.113990|0.198730|0.177234|0.107584|0.106396|0.074943|0.059671|0.059021|0.072990|0.068024|0.059126|0.067597|0.064678|0.233372|0.136899|0.109514|0.131016|0.500000| |3.829873|4.191297|3.755615|3.538813|4.379668|7.746074|5.842091|12.524333|0.200249|17.716954|8.931892|6.640108|9.450102|7.521663|7.007696|6.829856|0.150054|12.772305|5.686702|4.401185|4.225610|4.909481|3.986535|3.188622|2.978051|3.309144|4.503035|6.884904|5.166047|3.796096|5.543377|6.511320|7.066134|15.993238|4.105636|0.087678|0.105640|0.113219|0.087073|0.087326|0.106082|0.147479|0.205687|0.147912|0.134286|0.119391|0.099758|0.109611|0.078310|0.071340|0.082373|0.088563|0.093513|0.120347|0.112051|0.099485|0.113420|0.087042|0.129583|0.147460|0.500000| |3.855130|4.519913|3.630166|3.657555|4.516495|9.313855|6.904393|8.850752|0.150588|8.849953|17.542614|8.947394|11.198444|8.829014|6.332648|6.709431|0.212703|9.842377|6.262728|4.267635|3.899899|4.422405|3.551220|2.868125|2.711232|3.044299|5.047561|9.124013|5.206922|3.333829|4.951604|4.849452|4.511522|7.575169|2.911418|0.089568|0.114318|0.100105|0.085373|0.098985|0.118468|0.224252|0.175650|0.156637|0.197921|0.103516|0.106186|0.097804|0.070738|0.065454|0.076929|0.093995|0.071964|0.081361|0.076978|0.121040|0.096683|0.085719|0.113576|0.239761|0.175419|0.500000| 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