Version2.1 2020-12-18T18:19:17Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 22-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCOc1ccc2ccccc2c1C[NH+](C)CC(=O)N[C@H]3c4c(c(n[nH]c4=O)C)[C@@H](O3)C C39462155 RHF 6-31G(d) (6D,7F) CCCOc1ccc2ccccc2c1C[NH+](C)CC(=O)N[C@H]3c4c(c(n[nH]c4=O)C)[C@@H](O3)C C01[X(C25H31N4O4)] 186 C1 557 CCCOc1ccc2c(c1C[NH+](CC(=O)N[C@@H]1O[C@H](c3c1c(=O)[nH]nc3C)C)C)cccc2 CCCOc1ccc2c(c1C[NH+](CC(=O)N[C@@H]1O[C@H](c3c1c(=O)[nH]nc3C)C)C)cccc2 CCCOc1ccc2ccccc2c1C[NH+](C)CC(=O)N[C@@H]3O[C@@H](C)C4=C3C(=O)NN=C4C InChIKey=ALKCBGOOMCOOHJ-IVCQMTBJSA-O InChI=1S/C25H30N4O4/c1-5-12-32-20-11-10-17-8-6-7-9-18(17)19(20)13-29(4)14-21(30)26-25-23-22(16(3)33-25)15(2)27-28-24(23)31/h6-11,16,25H,5,12-14H2,1-4H3,(H,26,30)(H,28,31)/p+1/t16-,25+/m0/s1 InChI=1/C25H30N4O4/c1-5-12-32-20-11-10-17-8-6-7-9-18(17)19(20)13-29(4)14-21(30)26-25-23-22(16(3)33-25)15(2)27-28-24(23)31/h6-11,16,25H,5,12-14H2,1-4H3,(H,26,30)(H,28,31)/p+1/t16-,25+/m0/s1/fC25H31N4O4/h26,28-29H/q+1 CCCOc1ccc2ccccc2c1C[NH+](C)CC(=O)N[C@H]3c4c(c(n[nH]c4=O)C)[C@@H](O3)C C01[X(C25H31N4O4)] 186 C01 557 CCCOc1ccc2c(c1C[NH+](CC(=O)N[C@@H]1O[C@H](c3c1c(=O)[nH]nc3C)C)C)cccc2 CCCO[C]1[CH]=[CH][C]2[C]([C]1C[NH](CC(=O)N[C@@H]1O[C@H](c3c1c(=O)[nH]nc3C)C)C)[CH]=[CH][CH]=[CH]2 CCCO[C]1C=C[C]2C=CC=C[C]2[C]1C[NH](C)CC(=O)N[C@@H]3O[C@@H](C)C4=C3C(=O)NN=C4C InChIKey=BZAJLIFNSAYBHV-IVCQMTBJSA-N InChI=1S/C25H31N4O4/c1-5-12-32-20-11-10-17-8-6-7-9-18(17)19(20)13-29(4)14-21(30)26-25-23-22(16(3)33-25)15(2)27-28-24(23)31/h6-11,16,25,29H,5,12-14H2,1-4H3,(H,26,30)(H,28,31)/t16-,25+/m0/s1 InChI=1/C25H31N4O4/c1-5-12-32-20-11-10-17-8-6-7-9-18(17)19(20)13-29(4)14-21(30)26-25-23-22(16(3)33-25)15(2)27-28-24(23)31/h6-11,16,25,29H,5,12-14H2,1-4H3,(H,26,30)(H,28,31)/t16-,25+/m0/s1/f/h26,28H 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1.00783 1.00783 1.00783 1.00783 8948.6052 33117.7939 39147.7362 0.99988 -0.01515 0.00156 0.01514 0.99985 0.00866 -0.00169 -0.00863 0.99996 1 0.00968 0.00262 0.00221 0.20168 0.05449 0.04610 17.83 20.94 34.64 48.80 57.39 70.00 88.10 101.18 106.89 121.76 128.89 147.33 179.26 186.17 210.52 225.16 240.08 243.21 260.06 282.59 339.25 351.18 363.44 366.44 371.49 382.95 397.89 403.32 428.69 481.49 487.42 515.25 553.83 558.13 586.32 640.74 648.71 659.96 692.52 720.10 732.72 747.10 768.35 804.37 833.62 846.37 847.31 861.61 874.20 916.84 920.85 951.07 968.55 1000.39 1053.91 1073.49 1118.76 1132.09 1145.30 1153.02 1197.32 1207.88 1215.05 1221.99 1241.61 1288.68 1325.61 1337.72 1357.18 1393.13 1403.83 1419.55 1421.11 1423.51 1435.27 1471.19 1533.42 1547.07 1562.98 1570.46 1588.34 1596.95 1603.65 1620.94 1624.95 1630.41 1671.32 1673.87 1688.00 1696.56 1709.61 1735.11 1748.32 1756.07 1779.38 1790.55 1802.23 1818.11 1845.44 1865.61 1872.21 1883.26 1889.81 1920.51 1938.23 1959.29 1986.55 2007.79 2020.51 2032.23 2056.78 2084.24 2085.56 2090.25 2105.12 2113.42 2121.89 2151.65 2160.73 2182.06 2189.20 2213.57 2241.89 2251.90 2260.42 2262.47 2279.84 2281.75 2291.98 2299.41 2313.38 2318.09 2334.79 2335.59 2341.21 2341.77 2351.25 2356.56 2357.74 2360.92 2365.19 2365.81 2379.32 2381.52 2392.43 2410.04 2431.08 2487.27 2557.78 2568.36 2595.42 2639.72 2683.73 2783.82 2812.22 4616.03 4623.47 4628.32 4639.40 4639.77 4664.65 4672.80 4701.44 4704.82 4710.47 4710.74 4726.22 4728.67 4731.79 4744.89 4759.46 4779.11 4790.66 4796.94 4835.42 4843.78 4849.78 4858.22 4861.53 4871.22 4878.84 4893.79 4930.02 5227.13 5539.32 5561.95 0.581601 0.611216 0.612160 0.517306 -1481.243868 -1481.214253 -1481.213309 -1481.308163 3.181419D-04 MUNgauss RevisionA2.0 retrievium 18-Dec-2020 DUDE CCCOc1ccc2ccccc2c1C[NH+](C)CC(=O)N[C@H]3c4c(c(n[nH]c4=O)C)[C@@H](O3)C C39462155 RHF 6-31G(d) (6D,10F) C1 451.234531 |X|Y|Z| 65.986743 31.010220 131.318321 64.530093 24 6 7 8 19 4 1 |36.858105| |12.462874|36.858105| |7.549429|12.553914|36.858105| |5.086213|8.026616|13.412530|73.516695| |3.876154|5.209566|7.901699|25.189681|36.858105| |3.600633|4.394151|6.687758|14.005400|13.440194|36.858105| |2.870757|3.353312|4.533473|9.309924|7.942746|14.046903|36.858105| |2.515082|2.962489|3.763252|8.160622|6.788365|7.859686|13.447393|36.858105| |2.128113|2.429764|2.952985|6.082887|4.510066|5.126532|7.715765|13.438023|36.858105| |1.918523|2.187262|2.569696|5.319835|3.765449|3.937174|5.134129|7.887510|14.025725|36.858105| |1.955569|2.268199|2.623734|5.603945|3.923613|3.780614|4.540372|6.854685|7.966365|13.494883|36.858105| |2.226108|2.658726|3.110595|7.005725|5.076951|4.499821|5.123119|7.863628|6.855063|7.892610|13.992229|36.858105| |2.600688|3.173169|3.937545|9.300242|7.833548|6.773334|7.831053|13.510561|7.777275|6.749999|7.859791|13.394541|36.858105| |3.147794|4.086368|5.234423|14.586376|13.857124|7.856892|6.833925|7.776559|5.078256|4.478506|5.080355|7.582198|13.302117|36.858105| |3.068170|4.051843|4.620082|12.432191|7.682431|5.022267|4.443423|4.972173|3.810741|3.656503|4.384544|6.385412|7.471536|12.696691|36.858105| |2.757274|3.530843|3.842648|9.443792|5.531629|4.068980|3.734868|4.190999|3.415931|3.384706|4.094947|5.617316|5.822852|7.572673|12.562033|53.358707| |2.460261|3.050919|3.377549|7.971222|4.996862|3.913676|3.794179|4.489120|3.753756|3.842952|4.851913|6.799387|6.371578|7.057212|9.181067|25.594900|0.500000| |3.011619|3.885062|4.207911|10.108581|5.522795|4.171384|3.688735|3.870873|3.156493|3.019858|3.425369|4.353474|4.854103|6.287407|7.561519|17.309094|0.261033|36.858105| |2.509051|3.129203|3.195928|7.265410|4.011568|3.140684|2.919551|3.223820|2.773795|2.823534|3.404340|4.330390|4.177376|4.975198|7.644603|17.477181|0.264742|7.748167|36.858105| |2.136458|2.564250|2.630329|5.710702|3.245293|2.694809|2.591555|2.894313|2.597299|2.715043|3.278454|3.933421|3.603725|3.919680|5.092617|10.677874|0.225086|6.141874|12.465208|36.858105| |2.025977|2.408206|2.537600|5.503394|3.256694|2.765098|2.733547|3.134161|2.861708|3.054562|3.759554|4.445047|3.903173|4.006296|4.842263|9.927641|0.256952|5.859682|8.122937|15.871430|73.516695| |1.980056|2.328808|2.325109|4.870283|2.702095|2.296055|2.202211|2.407230|2.197464|2.290870|2.691437|3.100301|2.883005|3.118851|3.898112|7.147220|0.143830|4.640920|7.819308|14.236288|14.987916|53.358707| |1.762510|2.027393|2.030716|4.152994|2.325757|2.035916|1.979494|2.155003|2.011184|2.109479|2.435026|2.701301|2.503992|2.629269|3.097475|5.420978|0.113794|3.766800|5.030216|7.847669|12.020110|17.933750|36.858105| |1.712312|1.967077|2.004960|4.118372|2.354843|2.080257|2.052546|2.265164|2.138075|2.271528|2.641656|2.893390|2.629348|2.693050|3.106347|5.467372|0.120647|3.765054|4.771918|7.693328|14.297477|12.749919|17.660131|0.500000| |1.768485|2.013866|1.991560|3.999644|2.202185|1.945412|1.872676|1.995687|1.856215|1.912824|2.152582|2.374902|2.271918|2.414980|2.779908|4.789230|0.097834|3.608443|4.194986|5.638418|8.922010|10.576617|12.682898|0.244675|36.858105| |1.608485|1.802340|1.768463|3.490100|1.917196|1.715983|1.657329|1.755589|1.649788|1.702153|1.895865|2.059042|1.969993|2.077560|2.358905|3.885060|0.079165|2.897766|3.350749|4.194851|6.784695|7.569124|8.185219|0.175075|14.324066|36.858105| |1.556244|1.719873|1.673837|3.247075|1.769371|1.600694|1.539911|1.609070|1.513696|1.546430|1.694872|1.829349|1.778169|1.880213|2.096565|3.378457|0.068223|2.594593|2.813183|3.315235|5.463335|5.525169|5.138897|0.121884|7.911790|13.134464|36.858105| |1.642951|1.812609|1.759069|3.394354|1.836975|1.664559|1.591082|1.647222|1.540379|1.558275|1.694708|1.836509|1.810957|1.929455|2.132745|3.450062|0.069156|2.744197|2.804987|3.232121|5.362745|5.157193|4.515611|0.110638|6.971832|8.105466|14.933962|53.358707| |1.818933|2.034451|1.984003|3.871407|2.090160|1.876525|1.783145|1.845842|1.708572|1.719571|1.876638|2.057895|2.044345|2.199348|2.440978|4.063494|0.081079|3.346429|3.273495|3.807874|6.300647|5.937723|5.051473|0.124689|8.213837|7.201681|8.422111|19.362783|53.358707| |1.882064|2.092102|2.034731|3.928494|2.107222|1.903573|1.798637|1.840802|1.698037|1.692281|1.827699|2.003461|2.019306|2.182783|2.386970|3.928200|0.077882|3.338571|3.065682|3.432542|5.757787|5.104943|4.115284|0.105125|5.878936|5.231858|6.105673|13.163176|26.000671|0.500000| |1.923259|2.196448|2.167049|4.337485|2.360581|2.083511|1.982295|2.081643|1.913398|1.938284|2.152056|2.393626|2.353127|2.541118|2.883695|5.036695|0.101046|4.122292|4.171715|5.202271|8.421996|8.298816|7.186547|0.171963|13.150026|7.849278|6.767772|10.677189|19.071070|0.261418|36.858105| |2.133335|2.480117|2.474609|5.041190|2.741019|2.387084|2.251353|2.360822|2.135595|2.142232|2.383004|2.698582|2.695004|2.956718|3.359442|6.144402|0.122066|5.428451|4.862967|5.910997|9.698865|8.270205|6.161507|0.159257|8.027667|5.361610|4.737937|7.377924|11.501181|0.213753|15.739996|73.516695| |1.406308|1.533957|1.488753|2.854371|1.557349|1.423069|1.374274|1.431242|1.357127|1.388019|1.510136|1.612472|1.566159|1.644436|1.815519|2.847259|0.057579|2.159274|2.345391|2.685527|4.477701|4.359181|3.876035|0.095414|5.016433|7.341563|12.669037|10.863588|7.133744|0.121471|4.412287|6.133779|36.858105| |1.508789|1.688103|1.663582|3.290198|1.824091|1.635681|1.593253|1.704452|1.616277|1.688338|1.896443|2.042562|1.918550|1.998779|2.280124|3.682452|0.075845|2.627626|3.229741|4.062812|6.598086|7.470839|8.134469|0.176895|8.229001|12.585563|7.056349|6.813796|6.257046|0.102932|5.137333|7.233383|5.831143|36.858105| |1.484143|1.652471|1.612551|3.166643|1.741506|1.561433|1.514081|1.610277|1.524191|1.585859|1.774264|1.913084|1.807963|1.895277|2.168700|3.430700|0.069631|2.438707|3.026429|3.623150|5.771822|6.562901|6.117856|0.135428|6.206721|8.836260|6.291494|6.184666|5.535403|0.093509|4.354362|6.317783|5.832793|17.576561|0.500000| |1.607114|1.823612|1.811932|3.647737|2.038050|1.804652|1.761707|1.910727|1.804240|1.901468|2.179253|2.374308|2.191774|2.281437|2.660590|4.389494|0.091311|3.010154|4.021638|5.448195|8.572808|11.113886|13.665154|0.258108|8.382870|8.289927|5.113947|5.643555|5.720884|0.096455|5.176638|7.783128|4.159614|13.392076|0.260486|73.516695| |1.362907|1.510436|1.502795|2.951925|1.656362|1.507780|1.486169|1.594652|1.535215|1.615919|1.801803|1.900842|1.771721|1.811046|2.019838|3.204577|0.067239|2.286821|2.702127|3.344403|5.759679|5.601561|5.731454|0.149142|5.624891|7.443299|5.569357|5.679003|5.142853|0.087983|4.044234|5.954857|5.273608|12.506510|0.246276|14.024627|36.858105| |17.549716|8.763723|6.823000|8.289331|3.727284|3.576064|2.877168|2.499356|2.126763|1.909060|1.930104|2.179754|2.547269|3.030163|2.904040|3.481846|0.064167|2.716133|2.329958|1.993162|3.382897|2.512034|1.647866|0.044672|1.639133|1.498403|1.445715|2.062365|2.266118|0.047571|1.761948|3.448915|1.314597|1.418706|0.038818|2.690559|1.289653|0.500000| |17.580036|8.809757|5.500480|7.474930|3.293639|3.028515|2.492799|2.237895|1.922856|1.758927|1.805260|2.044022|2.336161|2.792939|2.809257|3.505254|0.063795|2.798676|2.410892|2.065033|3.447714|2.646263|1.734827|0.046442|1.752462|1.605987|1.563331|2.247050|2.471181|0.052207|1.902378|3.712158|1.419176|1.505180|0.041390|2.832156|1.355130|0.302235|0.500000| |17.548097|8.761486|6.822797|8.294323|3.696782|3.567330|2.860577|2.473765|2.106095|1.887666|1.904482|2.147717|2.512673|2.988020|2.852186|3.573058|0.065887|2.935660|2.367256|2.053772|3.498749|2.591680|1.714793|0.046503|1.735372|1.578716|1.537767|2.225498|2.470145|0.052619|1.905056|3.768234|1.389515|1.471495|0.040044|2.770543|1.335772|0.301362|0.302184|0.500000| |8.830230|17.539201|8.938328|13.085275|4.882190|4.036394|3.156293|2.851219|2.354179|2.142733|2.242875|2.636202|3.100995|3.997777|4.113478|5.162348|0.089643|4.408364|3.385576|2.772481|4.578675|3.441712|2.194782|0.058729|2.210618|1.963345|1.880292|2.724815|3.094933|0.065458|2.454742|4.987068|1.661540|1.813965|0.049219|3.473705|1.609136|0.172598|0.212340|0.210279|0.500000| |8.826514|17.546860|8.940542|13.069876|4.953972|4.049759|3.179019|2.890867|2.383327|2.174295|2.285146|2.696239|3.166967|4.100814|4.273855|4.900058|0.085479|3.756687|3.279951|2.629434|4.329328|3.262471|2.060142|0.055185|2.022151|1.815627|1.719726|2.441751|2.720817|0.056460|2.170384|4.312096|1.538217|1.718219|0.047005|3.320683|1.530742|0.210236|0.212249|0.172547|0.302820|0.500000| |6.848438|8.836602|17.573003|16.488812|7.148140|6.825939|4.685762|3.793797|2.998891|2.583347|2.599395|3.037045|3.842624|4.874191|4.191535|4.626113|0.084942|3.541531|2.876403|2.395332|4.138846|2.897094|1.870730|0.051509|1.819945|1.630928|1.542696|2.189825|2.442129|0.050837|1.951953|3.906563|1.384199|1.550858|0.041886|3.001858|1.411476|0.202628|0.140306|0.168034|0.174095|0.213304|0.500000| |6.865670|8.846177|17.571022|16.480868|6.921017|6.751579|4.608227|3.700666|2.938438|2.528389|2.534925|2.948215|3.720828|4.694933|4.033299|4.840656|0.088952|4.071065|2.944551|2.500693|4.352996|3.019259|1.969363|0.054342|1.953708|1.735497|1.655704|2.387827|2.702898|0.057142|2.151569|4.388736|1.472212|1.619935|0.043423|3.112606|1.472027|0.168458|0.140535|0.203227|0.213279|0.174210|0.300466|0.500000| |4.023312|4.700425|7.486959|12.615129|8.793546|17.787295|9.046964|5.617079|4.165277|3.294893|3.133142|3.591432|4.905393|5.615686|4.101296|4.704418|0.091436|3.657805|2.776302|2.408471|4.348399|2.852356|1.876455|0.052914|1.817587|1.616987|1.524715|2.168682|2.434227|0.050773|1.957649|3.960468|1.362978|1.535192|0.040888|2.978141|1.417468|0.112611|0.091394|0.113637|0.116621|0.115537|0.224139|0.232263|0.500000| |2.667330|2.994825|3.930609|7.499112|5.645236|9.054614|17.717777|8.855376|7.104966|4.721857|3.959454|4.167465|5.600361|4.931720|3.552556|4.219674|0.087859|3.108566|2.512403|2.278254|4.275834|2.682223|1.798141|0.051835|1.713972|1.531180|1.433517|2.017585|2.245484|0.046379|1.812833|3.623979|1.288378|1.473189|0.038953|2.869536|1.385113|0.075120|0.064604|0.074921|0.078158|0.078393|0.115075|0.114242|0.218884|0.500000| |2.045769|2.287723|2.773241|5.496549|3.943005|4.723956|7.108273|8.855585|17.715158|8.999495|5.644643|4.942591|5.581421|4.142150|3.206746|3.964475|0.087229|2.773383|2.418889|2.282420|4.427656|2.677949|1.821787|0.053589|1.701727|1.525501|1.412723|1.962326|2.165600|0.044149|1.760568|3.471406|1.274528|1.491300|0.039177|2.927020|1.424282|0.057186|0.051298|0.056753|0.061280|0.061831|0.079134|0.077923|0.112448|0.216687|0.500000| |1.739066|1.951815|2.257133|4.561200|3.118682|3.287403|4.154655|5.611988|8.990816|17.738543|8.827867|5.638818|4.889569|3.575739|3.045062|3.919190|0.089926|2.611416|2.480230|2.431880|4.854376|2.848800|1.959372|0.058762|1.783051|1.602777|1.462121|1.999353|2.188257|0.043927|1.796586|3.489086|1.322047|1.597880|0.041726|3.175565|1.546520|0.048206|0.044577|0.047704|0.053185|0.053886|0.063245|0.062068|0.079136|0.111882|0.215816|0.500000| |1.787415|2.054095|2.321005|4.880177|3.276389|3.128034|3.614493|4.943065|5.670971|8.844473|17.724626|9.027647|5.610266|4.123779|3.835031|5.064661|0.122700|3.101563|3.261394|3.253857|6.703932|3.686335|2.482471|0.075603|2.162265|1.917118|1.702094|2.293803|2.518790|0.049669|2.122906|4.116655|1.522998|1.945548|0.050454|3.997790|1.867261|0.048965|0.046306|0.048306|0.056742|0.057820|0.063756|0.062258|0.074121|0.090164|0.124282|0.213810|0.500000| |2.192362|2.635771|2.988578|6.770215|4.604550|3.888606|4.138610|5.589333|4.944273|5.644530|9.094415|17.723489|8.745685|6.868026|7.165396|8.982938|0.230760|4.619506|5.284087|4.751958|9.534706|4.929285|3.065077|0.091150|2.617068|2.250715|1.967469|2.663357|2.984822|0.058619|2.589887|5.168260|1.724761|2.256464|0.058619|4.767418|2.078329|0.059237|0.056569|0.058275|0.073425|0.075378|0.080110|0.077680|0.088815|0.095718|0.107374|0.124636|0.220644|0.500000| |3.544027|4.933219|5.352778|14.809549|7.375463|4.774018|3.998814|4.163067|3.259830|3.083968|3.543393|4.739926|5.554670|8.901244|17.689871|12.384685|0.180767|6.970232|6.990069|4.563681|7.343575|5.042208|2.938793|0.079822|2.699847|2.314322|2.080952|2.896058|3.304540|0.066363|2.826662|5.813118|1.808477|2.222345|0.059462|4.546416|1.950700|0.091964|0.090339|0.089036|0.139235|0.151279|0.131319|0.122990|0.113599|0.090980|0.078743|0.073138|0.087998|0.143140|0.500000| |2.717709|3.449974|3.823754|9.323330|5.801264|4.245859|3.978007|4.636447|3.737797|3.745536|4.697418|6.912879|6.923691|8.880680|17.636288|12.428205|0.221825|5.592060|7.311260|5.041574|8.525345|5.309830|3.085368|0.086225|2.692202|2.312407|2.035019|2.773530|3.123375|0.061614|2.704318|5.441554|1.777848|2.289460|0.060765|4.813572|2.037813|0.072780|0.070128|0.069932|0.095650|0.103333|0.100699|0.093394|0.098100|0.090533|0.086787|0.087057|0.117029|0.241963|0.301744|0.500000| |3.049844|3.892110|4.504146|10.893251|6.476525|4.986193|4.393195|4.541181|3.594390|3.333036|3.679361|4.658461|5.550451|7.079736|6.903698|12.336636|0.228216|17.693955|5.650698|4.851836|8.918683|5.159805|3.242891|0.092381|3.129880|2.573307|2.341636|3.383031|4.070972|0.084167|3.562373|8.113980|1.977648|2.349055|0.060550|4.711814|2.094158|0.076939|0.077050|0.084195|0.119778|0.101325|0.105006|0.126020|0.118769|0.101090|0.087511|0.079072|0.090011|0.128875|0.169624|0.142420|0.500000| |3.502634|4.722437|4.852948|11.627654|5.551451|4.112840|3.480003|3.497927|2.850130|2.691671|2.992376|3.731432|4.245660|5.727019|7.018871|12.328948|0.181855|17.658249|6.882446|5.153944|8.245434|5.754116|3.428484|0.092193|3.374385|2.772219|2.529042|3.667768|4.434820|0.091505|3.880152|8.802285|2.121800|2.504531|0.065727|5.012518|2.162566|0.085488|0.090735|0.093617|0.157601|0.126124|0.108954|0.127394|0.103471|0.082252|0.070763|0.065314|0.075646|0.109181|0.212902|0.144324|0.299918|0.500000| |2.666953|3.299434|3.461787|7.703659|4.237650|3.439921|3.150303|3.328994|2.838111|2.775284|3.140978|3.820069|4.020160|4.742362|5.541459|12.283871|0.222997|17.657250|7.302049|6.984677|11.910343|7.287631|4.443532|0.123527|4.381366|3.369744|2.988374|4.357820|5.532409|0.111954|5.281491|13.724709|2.420896|2.962134|0.074982|6.025294|2.549900|0.066933|0.070116|0.073024|0.104430|0.088673|0.082664|0.094994|0.085852|0.075919|0.070120|0.067966|0.081116|0.113830|0.143535|0.126400|0.298991|0.297663|0.500000| |2.699069|3.397380|3.320423|7.390142|3.833593|3.004722|2.724674|2.902968|2.494018|2.491778|2.904404|3.590056|3.619285|4.429025|6.476759|12.339079|0.184590|7.464033|17.637956|8.690833|10.624321|9.796486|4.757338|0.119134|4.257889|3.431646|2.935538|4.035101|4.737393|0.091151|4.373389|9.044626|2.436837|3.224366|0.085548|6.899066|2.644052|0.068559|0.073048|0.070224|0.104970|0.099673|0.081668|0.084454|0.075471|0.065764|0.061476|0.061424|0.077014|0.115519|0.190681|0.163658|0.147342|0.215763|0.198130|0.500000| |2.405637|2.970942|3.033187|6.813758|3.815593|3.015905|2.837037|3.171638|2.757623|2.847212|3.490934|4.444739|4.137934|4.805877|7.514459|12.324848|0.211928|5.654485|17.604672|8.904636|11.759023|8.972386|4.451399|0.118016|3.634952|3.034456|2.555979|3.409589|3.854569|0.073621|3.482008|6.869301|2.183747|3.045277|0.080725|6.783535|2.582908|0.063044|0.064369|0.062376|0.086786|0.088615|0.077797|0.076472|0.073938|0.067990|0.066575|0.069610|0.094233|0.157089|0.190818|0.239772|0.126655|0.146645|0.144682|0.300732|0.500000| |2.047936|2.409690|2.352862|4.882148|2.642915|2.234476|2.114140|2.275452|2.063184|2.125998|2.466315|2.846792|2.706533|2.992064|3.784604|6.630640|0.126146|4.399918|7.458190|9.420242|10.830985|26.007429|9.113568|0.181155|6.998563|5.423451|4.092078|5.201694|5.883966|0.103815|5.740955|9.944888|3.261775|5.303242|0.138634|12.840284|3.854714|0.052813|0.056424|0.054310|0.073109|0.069594|0.059702|0.061853|0.057156|0.052648|0.051637|0.054013|0.068398|0.091338|0.104093|0.104850|0.099008|0.117726|0.136733|0.221581|0.180666|0.500000| |1.324384|1.441534|1.410736|2.705816|1.489597|1.369749|1.332808|1.393773|1.332027|1.369535|1.487828|1.574327|1.518892|1.577953|1.728638|2.701334|0.055262|2.033384|2.203709|2.545949|4.332133|4.072353|3.685884|0.093868|4.548599|6.431224|8.871182|8.465714|6.112823|0.106261|3.942222|5.613097|17.564214|5.656157|0.150883|7.146135|5.898779|0.034547|0.036974|0.036412|0.043106|0.040116|0.036597|0.038829|0.036393|0.034816|0.034803|0.036419|0.041914|0.046678|0.047451|0.047249|0.052230|0.054958|0.063114|0.062577|0.057374|0.082722|0.500000| |1.390731|1.505217|1.454391|2.763509|1.500857|1.378182|1.326987|1.371527|1.299328|1.320772|1.425972|1.521028|1.490464|1.569079|1.718399|2.671911|0.053775|2.052921|2.168798|2.430440|4.069542|3.846253|3.293468|0.082469|4.206107|5.497731|8.970955|10.494416|6.809061|0.122448|4.002110|5.722238|17.632732|4.419558|0.123665|6.074261|4.077500|0.036048|0.039118|0.038323|0.045376|0.041743|0.037538|0.040122|0.036881|0.034679|0.034048|0.034973|0.039753|0.044861|0.047812|0.046471|0.052587|0.056520|0.063613|0.063045|0.056019|0.080409|0.301201|0.500000| |1.394164|1.520208|1.467638|2.812484|1.529836|1.393613|1.343704|1.400299|1.326569|1.358493|1.482295|1.585570|1.536917|1.617810|1.799036|2.796272|0.056230|2.090758|2.334760|2.643416|4.344497|4.347726|3.774637|0.091250|4.619737|6.658837|8.869502|8.237022|6.029008|0.104444|3.948633|5.635437|17.552113|6.041993|0.189326|7.563423|5.244354|0.036285|0.039226|0.038052|0.045588|0.042651|0.038024|0.040065|0.037071|0.034956|0.034572|0.035932|0.041606|0.047321|0.050025|0.049287|0.052949|0.057460|0.064336|0.067717|0.061148|0.092376|0.301695|0.300486|0.500000| |1.299968|1.428757|1.414977|2.752336|1.537414|1.408369|1.385632|1.474748|1.421560|1.487334|1.640616|1.724334|1.623265|1.662524|1.837567|2.879757|0.059977|2.084270|2.393493|2.869257|4.938951|4.690819|4.510212|0.117327|4.784918|6.572599|5.767244|5.766941|4.956125|0.085794|3.680443|5.411421|6.238827|8.799527|0.213081|10.086949|17.581531|0.034171|0.036035|0.035486|0.042287|0.040122|0.036958|0.038627|0.037011|0.036053|0.036865|0.039673|0.047009|0.051855|0.049674|0.051235|0.053391|0.055312|0.064236|0.065936|0.063557|0.092095|0.215204|0.130185|0.171924|0.500000| |1.316545|1.457643|1.453373|2.855866|1.609509|1.467331|1.452616|1.565992|1.515664|1.606217|1.797564|1.884909|1.740839|1.767832|1.972772|3.086363|0.064976|2.161022|2.608416|3.188461|5.509087|5.255181|5.051935|0.134523|4.560319|5.489706|4.302595|4.633306|4.302749|0.075487|3.417841|5.234993|4.200646|8.904088|0.213327|12.871130|17.594901|0.034780|0.036341|0.035722|0.042834|0.041246|0.038145|0.039382|0.038253|0.037636|0.039032|0.042857|0.052199|0.057484|0.052793|0.055983|0.055173|0.056801|0.065874|0.070207|0.070764|0.100798|0.127770|0.094431|0.120845|0.301390|0.500000| |1.367459|1.517806|1.523796|3.002868|1.699107|1.552953|1.539936|1.659849|1.605754|1.696865|1.891675|1.983333|1.839979|1.863984|2.059546|3.298452|0.070264|2.367242|2.729582|3.446633|6.157477|5.582613|5.888522|0.168144|5.750439|6.865426|5.232020|5.633278|5.276559|0.090657|4.221415|6.272617|4.700909|8.814228|0.173361|12.505271|17.569889|0.035941|0.037571|0.037383|0.044916|0.042490|0.039715|0.041669|0.040445|0.039896|0.041356|0.045195|0.054594|0.060007|0.054690|0.057473|0.060706|0.061319|0.074004|0.073118|0.071719|0.102847|0.147872|0.104946|0.122333|0.300315|0.300902|0.500000| 1480.026554 -10084.734202 4000.252132 -200.466346 -4804.921862 3323.096333 -1481.825529 2.001216 408A400000000005 44BA8A240272CC8F 443C31033266D2EB 4205F6C7CEBFFFFE C043000000000000 43D35506E1DA79E0