Version2.0 2019-11-11T15:58:31Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 05-Nov-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1ccc2c(c1)cc(c(=O)[nH]2)[C@H](c3nnnn3C4CCCC4)[NH+](Cc5ccco5)C[C@@H]6CCCO6 C06409028 RHF 6-31G(d) (6D,7F) Cc1ccc2c(c1)cc(c(=O)[nH]2)[C@H](c3nnnn3C4CCCC4)[NH+](Cc5ccco5)C[C@@H]6CCCO6 C01[X(C27H33N6O3)] 201 C1 606 Cc1ccc2c(c1)cc(c(=O)[nH]2)[C@H](c1nnnn1C1CCCC1)[NH+](Cc1ccco1)C[C@@H]1CCCO1 Cc1ccc2c(c1)cc(c(=O)[nH]2)[C@H](c1nnnn1C1CCCC1)[NH+](Cc1ccco1)C[C@@H]1CCCO1 Cc1ccc2NC(=O)C(=Cc2c1)[C@@H]([NH+](C[C@@H]3CCCO3)Cc4occc4)c5nnnn5C6CCCC6 InChIKey=CCXAAWDMLQDXLD-WIOPSUGQSA-O InChI=1S/C27H32N6O3/c1-18-10-11-24-19(14-18)15-23(27(34)28-24)25(26-29-30-31-33(26)20-6-2-3-7-20)32(16-21-8-4-12-35-21)17-22-9-5-13-36-22/h4,8,10-12,14-15,20,22,25H,2-3,5-7,9,13,16-17H2,1H3,(H,28,34)/p+1/t22-,25+/m0/s1 InChI=1/C27H32N6O3/c1-18-10-11-24-19(14-18)15-23(27(34)28-24)25(26-29-30-31-33(26)20-6-2-3-7-20)32(16-21-8-4-12-35-21)17-22-9-5-13-36-22/h4,8,10-12,14-15,20,22,25H,2-3,5-7,9,13,16-17H2,1H3,(H,28,34)/p+1/t22-,25+/m0/s1/fC27H33N6O3/h28,32H/q+1 Cc1ccc2c(c1)cc(c(=O)[nH]2)[C@H](c3nnnn3C4CCCC4)[NH+](Cc5ccco5)C[C@@H]6CCCO6 C01[X(C27H33N6O3)] 201 C01 606 Cc1ccc2c(c1)cc(c(=O)[nH]2)[C@H](c1nnnn1C1CCCC1)[NH+](Cc1ccco1)C[C@@H]1CCCO1 Cc1ccc2c(c1)cc(c(=O)[nH]2)[C@H]([C@@H]1NNNN1C1CCCC1)[NH](Cc1ccco1)C[C@@H]1CCCO1 Cc1ccc2NC(=O)C(=Cc2c1)[C@H]([C@@H]3NNNN3C4CCCC4)[NH](C[C@@H]5CCCO5)Cc6occc6 InChIKey=ZGVPGZOCYVXONG-HDYLNDSGSA-N InChI=1S/C27H37N6O3/c1-18-10-11-24-19(14-18)15-23(27(34)28-24)25(26-29-30-31-33(26)20-6-2-3-7-20)32(16-21-8-4-12-35-21)17-22-9-5-13-36-22/h4,8,10-12,14-15,20,22,25-26,29-32H,2-3,5-7,9,13,16-17H2,1H3,(H,28,34)/t22-,25+,26+/m0/s1 InChI=1/C27H37N6O3/c1-18-10-11-24-19(14-18)15-23(27(34)28-24)25(26-29-30-31-33(26)20-6-2-3-7-20)32(16-21-8-4-12-35-21)17-22-9-5-13-36-22/h4,8,10-12,14-15,20,22,25-26,29-32H,2-3,5-7,9,13,16-17H2,1H3,(H,28,34)/t22-,25+,26+/m0/s1/f/h28H 4067.4899349093 -1592.6930282 1-A 17643.3634 130 476 606 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.74934 -20.66370 -20.64463 -15.82042 -15.76817 -15.74099 -15.73266 -15.72906 -15.69222 -11.48068 -11.45731 -11.43733 -11.41987 -11.41455 -11.41325 -11.40784 -11.39731 -11.39708 -11.39364 -11.38589 -11.38450 -11.36537 -11.36387 -11.35580 -11.35481 -11.35239 -11.34879 -11.34774 -11.33626 -11.32471 -11.31607 -11.31532 -11.31485 -11.31261 -11.29978 -11.29625 -1.61070 -1.59234 -1.52010 -1.49422 -1.45881 -1.39905 -1.37087 -1.31096 -1.27668 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-0.00578 0.02118 0.00631 0.99976 1 0.00539 0.00410 0.00342 0.11241 0.08542 0.07118 22.18 29.90 34.66 39.59 49.38 59.24 60.71 82.40 83.44 87.49 94.47 113.00 122.84 149.33 169.06 176.84 199.29 213.12 241.41 250.27 276.02 293.99 337.80 365.41 384.23 385.63 411.06 413.62 423.91 477.11 532.19 557.12 567.07 595.17 639.65 651.24 659.55 699.18 731.24 746.67 754.12 821.20 831.97 867.93 894.26 900.35 933.21 941.14 974.01 995.56 1008.55 1037.69 1039.04 1066.77 1077.20 1122.30 1168.64 1173.52 1176.56 1183.37 1238.11 1261.77 1275.03 1289.90 1322.46 1337.24 1338.76 1352.90 1357.51 1372.99 1388.48 1392.85 1394.70 1398.75 1409.75 1427.19 1433.48 1437.66 1447.02 1459.35 1481.34 1482.94 1489.30 1500.73 1517.61 1535.99 1585.79 1594.25 1597.73 1598.07 1601.23 1612.76 1621.96 1629.02 1651.51 1671.36 1697.84 1729.69 1734.25 1745.15 1761.23 1767.81 1805.96 1815.29 1821.60 1835.16 1841.17 1843.97 1867.06 1880.59 1890.48 1909.93 1917.48 1931.50 1952.69 1955.61 1977.30 1984.08 1988.96 2011.32 2015.14 2018.81 2031.69 2044.66 2067.90 2071.64 2081.15 2098.50 2104.25 2133.54 2135.86 2145.73 2151.41 2159.16 2175.88 2190.43 2198.17 2220.99 2231.63 2236.71 2238.44 2253.94 2262.94 2277.29 2284.04 2311.20 2322.39 2342.44 2348.83 2351.43 2351.70 2357.80 2360.64 2360.85 2370.47 2373.26 2374.51 2379.89 2393.96 2402.77 2428.46 2447.79 2490.24 2555.24 2596.23 2616.34 2643.42 2766.25 4616.74 4622.20 4623.97 4636.57 4640.35 4655.50 4662.89 4666.22 4674.96 4705.66 4714.79 4724.99 4730.89 4736.18 4736.85 4737.59 4739.92 4742.34 4745.35 4753.81 4759.37 4766.49 4832.96 4840.76 4844.09 4847.49 4871.72 4896.84 4943.89 4975.01 5028.40 5240.82 5513.77 0.629519 0.659584 0.660528 0.562961 -1592.063509 -1592.033444 -1592.032500 -1592.130067 3.272413D-04 MUNgauss RevisionA1.9 retrievium 11-Nov-2019 DUDE Cc1ccc2c(c1)cc(c(=O)[nH]2)[C@H](c3nnnn3C4CCCC4)[NH+](Cc5ccco5)C[C@@H]6CCCO6 C06409028 RHF 6-31G(d) (6D,10F) C1 489.261376 |X|Y|Z| 92.255090 75.737396 58.276551 74.119335 34 6 7 8 26 6 2 |36.858105| |12.614293|36.858105| |7.528546|13.525889|36.858105| |5.004084|7.819922|13.891760|36.858105| |4.412239|6.784819|7.979785|13.642516|36.858105| |4.984969|7.864505|6.910233|7.899935|13.696195|36.858105| |7.548554|13.895492|8.013423|6.855331|7.881184|13.546707|36.858105| |3.793633|5.078856|4.543358|5.140065|7.879336|13.256203|7.626084|36.858105| |3.053596|3.912922|3.790594|4.525886|6.772672|7.787274|5.100527|14.134733|36.858105| |2.895220|3.740136|3.942186|5.139768|7.789536|6.673249|4.471230|7.816220|12.937065|36.858105| |2.456356|3.043907|3.237672|4.089173|5.399444|4.692598|3.485894|5.365647|8.054709|15.795089|73.516695| |3.344101|4.550232|5.204705|7.864296|13.811354|7.995464|5.191782|7.012786|7.959067|13.985354|15.131490|53.358707| |3.043962|3.992864|4.789729|7.276700|9.242570|5.796519|4.259701|5.127971|5.798025|9.549129|14.096567|25.953779|0.500000| |2.539495|3.062528|2.929194|3.328795|4.403168|4.972457|3.826064|7.673449|12.581601|7.358777|11.603614|6.840051|0.115684|36.858105| |2.589367|3.066570|2.838828|3.114089|4.012830|4.806275|3.897642|7.512421|9.055337|5.553716|8.645042|5.791367|0.098967|17.628248|0.500000| |2.198728|2.596729|2.548628|2.905111|3.663987|3.852324|3.091176|5.122462|7.350358|6.168284|11.693758|5.899672|0.106354|12.611641|0.252775|36.858105| |1.932050|2.235476|2.208645|2.489817|3.023875|3.119377|2.594265|3.918895|5.178206|4.735314|9.575727|4.821992|0.090469|7.769821|0.175772|14.718769|53.358707| |1.779837|2.036632|2.029732|2.277095|2.694990|2.729960|2.316675|3.279630|4.110908|3.981944|8.172810|4.267428|0.082293|5.362260|0.131955|9.066139|19.450951|53.358707| |1.868832|2.149082|2.146370|2.415633|2.865808|2.892892|2.445296|3.449008|4.281228|4.188566|8.421622|4.533888|0.087248|5.271116|0.132954|8.939308|12.223705|20.751183|53.358707| |2.146692|2.520121|2.495836|2.839164|3.500109|3.601676|2.944756|4.502392|5.881047|5.439979|10.369957|5.585198|0.103251|7.420892|0.181831|14.355697|12.183875|12.413658|19.504944|53.358707| |2.331415|2.751795|2.724376|3.086271|3.776200|3.886273|3.204146|4.643553|5.523076|5.209179|9.122766|5.813795|0.107080|5.771343|0.154151|7.410432|7.238813|7.462026|10.693096|17.626605|36.858105| |2.125687|2.421920|2.360038|2.573211|3.002390|3.151760|2.765540|3.636507|3.977751|3.680578|6.446066|4.380898|0.082490|4.283629|0.123775|5.202476|5.797321|6.326666|8.742146|10.349862|12.287504|36.858105| |1.939450|2.186612|2.181407|2.383294|2.688888|2.711881|2.413928|2.974777|3.238528|3.203890|5.788977|3.954164|0.077189|3.351576|0.093204|4.029832|4.806560|5.479587|7.417819|7.578631|7.773870|12.425379|36.858105| |2.103081|2.413226|2.469100|2.756382|3.092513|3.001785|2.629637|3.180870|3.469856|3.629587|6.540699|4.617094|0.091709|3.363078|0.090566|3.914447|4.561899|5.006385|6.557539|7.145217|7.794112|7.936468|12.446020|36.858105| |2.254595|2.665714|2.750664|3.189466|3.763923|3.584839|2.975334|3.923707|4.583445|5.012249|9.269904|5.995854|0.117417|4.362481|0.111707|5.299502|5.810247|6.230203|8.476150|10.366029|12.301411|7.687938|7.916262|12.416608|36.858105| |2.308822|2.718426|2.610780|2.922373|3.691094|4.059495|3.295752|5.588145|7.478964|5.598893|9.583067|5.652352|0.099899|12.518042|0.255744|7.868775|9.828019|6.542515|5.816763|6.961455|4.034677|3.270678|2.704926|2.693686|3.332648|53.358707| |2.082119|2.403374|2.311514|2.556730|3.135191|3.405354|2.857835|4.482735|5.678042|4.565806|8.227196|4.768165|0.086664|9.405421|0.223415|8.024188|11.983631|7.493150|6.249185|7.070820|3.927320|3.292933|2.721481|2.638128|3.210505|25.614825|0.500000| |2.428353|2.810182|2.614733|2.825177|3.485805|4.030606|3.446308|5.420809|5.955181|4.435798|7.183329|4.955674|0.087546|7.545549|0.207738|5.084292|6.412534|4.842026|4.462111|5.206492|3.292157|2.811494|2.346473|2.331529|2.768099|17.208307|0.259088|36.858105| |2.357612|2.655294|2.412315|2.534832|3.055993|3.625431|3.260730|4.812090|4.885922|3.644786|5.921042|4.208241|0.075013|6.319143|0.214029|4.640718|5.842618|4.609836|4.323286|5.004057|3.237981|2.900715|2.373303|2.294166|2.647063|10.479743|0.205033|12.802326|36.858105| |2.506997|2.758001|2.431879|2.480973|2.932617|3.582069|3.407097|4.570136|4.227273|3.209532|5.122754|3.875890|0.069200|4.904537|0.170596|3.780057|4.672824|3.897019|3.779037|4.363024|2.983115|2.760231|2.264051|2.185377|2.457726|7.042951|0.136804|7.318338|14.210709|36.858105| |2.188104|2.355456|2.102530|2.136508|2.470914|2.922661|2.816627|3.584314|3.425177|2.720126|4.467225|3.302264|0.060103|4.053907|0.139655|3.427980|4.377787|3.775553|3.657558|4.094493|2.802934|2.713339|2.228474|2.096109|2.302366|5.691033|0.118995|5.148936|8.580092|13.219136|36.858105| |1.981821|2.156338|1.970152|2.038435|2.367364|2.723345|2.548638|3.368249|3.413248|2.747711|4.634827|3.257864|0.059777|4.305206|0.145666|3.805972|5.074135|4.325486|4.065810|4.448860|2.916987|2.824252|2.315238|2.146769|2.375964|6.296119|0.141926|5.360303|8.772591|8.591628|14.238213|36.858105| |2.049365|2.278219|2.105659|2.219879|2.629329|3.006953|2.718498|3.845787|4.086163|3.219578|5.461341|3.698577|0.067368|5.551949|0.183876|4.680307|6.334210|5.040971|4.585648|5.090025|3.188865|2.946366|2.409962|2.268310|2.586671|9.089231|0.216668|7.936301|14.139689|8.627939|8.624443|14.122196|73.516695| |2.187521|2.582948|2.570309|2.945226|3.654387|3.729400|3.018738|4.650084|6.220548|5.805162|10.952142|5.895407|0.108348|7.427533|0.154477|6.117243|8.452413|6.032143|5.274661|5.959680|3.523577|2.844436|2.468554|2.525312|3.140651|17.077054|0.259867|7.618152|5.001766|3.795250|3.185577|3.453920|8.078668|36.858105| |1.881237|2.158012|2.148340|2.405204|2.842265|2.885539|2.454358|3.422589|4.182510|4.020193|7.784009|4.433327|0.084831|4.985214|0.116265|4.672679|7.307844|5.557507|4.653348|4.879245|2.906010|2.461885|2.184090|2.194704|2.636238|10.293031|0.212965|5.896589|4.325307|3.336728|2.934817|3.277206|7.573199|12.537133|36.858105| |1.772077|2.017884|2.001987|2.228731|2.620936|2.674666|2.292358|3.192278|3.905309|3.715771|7.321067|4.077755|0.078330|4.920770|0.116891|5.034293|8.759155|6.557261|5.185897|5.230266|3.014398|2.586150|2.289555|2.257761|2.700082|9.613592|0.234474|5.280514|4.227248|3.258226|2.969731|3.431700|7.952189|8.933369|17.530198|0.500000| |1.755405|2.003210|2.037240|2.293820|2.636048|2.580038|2.218297|2.909824|3.470112|3.597379|7.187900|4.149470|0.082469|3.793334|0.089985|3.700790|5.665700|4.720472|4.052143|4.143978|2.550449|2.177594|1.991487|2.032841|2.417645|6.671287|0.133923|4.141330|3.242372|2.663866|2.382520|2.596685|5.647087|7.506638|12.467699|0.245735|36.858105| |1.595083|1.784824|1.797519|1.978662|2.225232|2.212361|1.958349|2.464181|2.814640|2.830441|5.449523|3.379394|0.067170|3.086544|0.076709|3.001307|4.592667|3.959201|3.422611|3.451804|2.167380|1.907955|1.753766|1.768034|2.047374|5.351354|0.111263|3.625396|2.973900|2.486239|2.267433|2.480316|5.287576|5.121072|8.069298|0.190045|12.455843|36.858105| |1.680187|1.871694|1.852205|2.011900|2.275746|2.323450|2.076339|2.620843|2.930737|2.818802|5.214592|3.373301|0.065653|3.251017|0.082574|3.012534|4.500201|3.785750|3.308251|3.412262|2.158480|1.911449|1.729054|1.731844|1.996428|5.916141|0.122114|4.361001|3.511340|2.889451|2.597110|2.837386|6.153722|5.327591|8.149211|0.181975|7.992454|12.457032|36.858105| |1.854646|2.094440|2.052322|2.244784|2.609963|2.714518|2.378188|3.184074|3.652470|3.377800|6.185184|3.897600|0.074141|4.248836|0.106065|3.786919|5.657469|4.491805|3.879590|4.092347|2.530778|2.205076|1.953009|1.949019|2.283463|8.690376|0.178888|6.323710|4.650036|3.579181|3.124304|3.468787|8.026573|7.918076|13.545076|0.258755|8.152971|8.080965|13.371201|73.516695| |17.556547|8.848515|6.702410|4.595195|3.962842|4.283577|5.888119|3.355774|2.780737|2.678042|4.096525|4.205493|0.079527|2.340149|0.065652|2.034786|2.466586|2.271332|2.362454|2.683495|2.106367|1.920820|1.767068|1.910386|2.051317|2.964074|0.054643|2.305930|2.216093|2.341161|2.045807|1.861816|3.432790|2.097165|1.822901|0.047432|1.718713|1.572181|1.657648|3.218871|0.500000| |17.589499|8.843766|5.551344|4.152137|3.940996|4.712496|7.219959|3.797213|3.013144|2.763833|4.184082|4.192288|0.077097|2.561205|0.074038|2.200824|2.634372|2.419297|2.533321|2.911321|2.313428|2.136886|1.926509|2.053327|2.190695|3.179105|0.058756|2.502557|2.484409|2.709272|2.364050|2.103093|3.817417|2.171616|1.875973|0.049280|1.731317|1.584132|1.684659|3.319862|0.301907|0.500000| |17.557592|8.849304|6.710265|4.599050|3.964218|4.282422|5.885006|3.354951|2.778717|2.679317|4.101852|4.208350|0.079663|2.340857|0.066273|2.072687|2.486596|2.320469|2.455347|2.801127|2.266292|2.093800|1.936748|2.113139|2.223464|2.876094|0.053502|2.186575|2.139215|2.264627|2.016598|1.841461|3.363282|2.007619|1.740735|0.045917|1.633843|1.487042|1.553055|3.031555|0.302205|0.301958|0.500000| |7.023597|8.876599|17.711094|9.027890|5.673318|4.970821|5.686735|3.615935|3.136778|3.297551|5.005643|5.726632|0.113185|2.519309|0.067982|2.241619|2.689387|2.500435|2.637205|3.010859|2.405948|2.124189|1.998549|2.258855|2.464632|3.109649|0.056958|2.290108|2.129115|2.151205|1.888973|1.776204|3.349117|2.272486|1.940395|0.050417|1.864865|1.662648|1.704484|3.310517|0.191094|0.140631|0.191474|0.500000| |4.088050|5.589422|8.945088|17.720798|8.865809|5.624302|4.943154|4.172971|3.937448|4.723831|7.091975|9.708933|0.216552|3.008471|0.077255|2.714995|3.224822|2.989209|3.165708|3.647566|2.891027|2.421054|2.297097|2.689233|3.095850|3.656240|0.066088|2.556935|2.286803|2.215711|1.935970|1.869758|3.621836|2.781408|2.309776|0.059553|2.253494|1.941180|1.943061|3.801090|0.108347|0.095687|0.108460|0.217401|0.500000| |6.964707|8.970346|5.664328|4.941741|5.630934|8.894820|17.700861|7.013721|4.692673|3.900686|5.569856|5.734152|0.098039|3.762154|0.111343|3.015334|3.466157|3.088341|3.242982|3.887168|3.082329|2.735593|2.353252|2.496509|2.779436|4.459607|0.079763|3.554208|3.512223|3.847423|3.148254|2.761984|5.135495|2.906768|2.397448|0.062656|2.137271|1.912718|2.055321|4.200824|0.151784|0.220515|0.151682|0.124440|0.107338|0.500000| |3.723645|4.676814|3.960532|4.175745|5.635087|8.831350|7.035163|17.687361|9.068691|5.567977|7.608517|6.835995|0.110439|7.137928|0.231713|4.780955|5.100695|4.276289|4.458051|5.712375|4.296913|3.573509|2.866795|2.957413|3.507195|7.421484|0.125239|5.817839|5.709919|5.808293|4.342361|3.899863|7.745336|4.244411|3.257996|0.085620|2.723731|2.367035|2.568979|5.569499|0.091054|0.108439|0.091126|0.090118|0.096241|0.213346|0.500000| |2.667352|3.218385|3.124525|3.538917|4.504369|4.859200|3.886920|6.064664|6.967411|5.984187|9.449410|6.703974|0.117396|6.657881|0.184300|7.137331|6.666125|6.290574|7.950897|12.713528|17.657370|8.754992|5.828477|6.172798|8.716337|5.925505|0.113059|3.635370|3.580515|3.346726|3.057600|3.095778|6.025519|3.687495|2.951583|0.083148|2.561737|2.177402|2.205140|4.639877|0.065974|0.073770|0.071374|0.074996|0.089280|0.103666|0.153599|0.500000| |2.278285|2.576841|2.465806|2.635793|3.051499|3.287211|2.955963|3.741372|3.866826|3.485675|5.876028|4.283198|0.079802|4.018480|0.120686|4.462617|4.968249|5.159892|6.549627|7.891184|8.837701|17.550802|8.830669|6.752080|6.187948|4.198488|0.084994|2.748490|2.889504|2.835931|2.794189|2.828214|5.127689|2.657572|2.295193|0.066089|2.030780|1.795943|1.820464|3.724415|0.056518|0.064154|0.062690|0.061520|0.067969|0.082322|0.104584|0.231367|0.500000| |1.975909|2.225178|2.151049|2.325784|2.705281|2.872738|2.546097|3.374575|3.713622|3.358373|5.964076|3.942773|0.074308|4.263793|0.126241|5.337038|6.239333|6.997363|9.487293|10.162967|8.659324|17.607840|8.652803|5.675196|5.722722|4.556937|0.096685|2.876042|3.036658|2.867675|2.896528|3.093823|5.679123|2.858715|2.523597|0.074999|2.204378|1.949746|1.961251|4.035852|0.049988|0.055649|0.053728|0.054013|0.060833|0.071006|0.094447|0.187881|0.302627|0.500000| |1.862027|2.064035|2.045951|2.194771|2.428353|2.468084|2.253200|2.662720|2.815123|2.758912|4.919015|3.486005|0.068267|2.894562|0.081964|3.345268|4.074622|4.562186|5.795663|5.871177|5.616128|8.707844|17.585501|8.672679|5.635557|3.256870|0.066970|2.127042|2.179483|2.114570|2.107743|2.170775|3.941289|2.184839|1.958067|0.056845|1.794508|1.601844|1.586937|3.159827|0.047118|0.051605|0.052090|0.052557|0.058766|0.061570|0.072403|0.130143|0.219690|0.195325|0.500000| |1.779330|1.998925|2.006420|2.201625|2.476811|2.474536|2.196894|2.728027|3.031580|3.041388|5.677400|3.703432|0.073165|3.218973|0.088054|4.016852|5.022751|6.068728|8.389725|7.553788|6.604783|8.814324|17.560993|8.825264|6.901200|3.628142|0.075721|2.284921|2.295927|2.160523|2.139317|2.260443|4.211345|2.467016|2.220520|0.065511|2.037070|1.795408|1.751541|3.500154|0.045485|0.049053|0.049139|0.051330|0.059524|0.059480|0.072926|0.136509|0.174506|0.217523|0.301900|0.500000| |2.272995|2.602079|2.651419|2.917474|3.223235|3.151948|2.812855|3.248999|3.399144|3.503224|6.061384|4.631498|0.091245|3.192170|0.087574|3.520912|4.066745|4.303797|5.387526|6.081009|6.614734|6.901478|8.820975|17.523584|8.781577|3.482393|0.068799|2.266931|2.246469|2.178530|2.082188|2.095536|3.895204|2.383269|2.062915|0.058303|1.910282|1.672664|1.653935|3.302862|0.056727|0.061519|0.064195|0.067419|0.078363|0.074040|0.084278|0.166339|0.192040|0.138764|0.215382|0.173712|0.500000| |1.944869|2.210915|2.296468|2.564290|2.805645|2.666861|2.361226|2.771003|3.020794|3.247809|5.994468|4.212202|0.086117|2.922539|0.077875|3.383285|4.098075|4.554014|5.757800|5.901682|5.623674|5.643971|8.669829|17.587916|8.717371|3.296372|0.066121|2.107323|2.057483|1.957372|1.882125|1.932370|3.628875|2.325863|2.054499|0.058681|1.938167|1.692621|1.641515|3.243021|0.049560|0.052422|0.054559|0.059227|0.070965|0.062006|0.071437|0.129622|0.137221|0.124989|0.197746|0.215055|0.302460|0.500000| |2.051426|2.405065|2.503874|2.915063|3.401006|3.189935|2.657746|3.502775|4.213796|4.783291|9.681910|5.583183|0.112887|4.168496|0.103768|5.360461|6.249379|7.081784|9.788910|10.364161|8.816217|6.186687|6.731508|8.820073|17.600000|4.515396|0.090170|2.700999|2.546303|2.325642|2.188199|2.294310|4.487771|3.230307|2.757363|0.079359|2.565257|2.153054|2.061387|4.166368|0.052556|0.055319|0.055975|0.062967|0.080119|0.069115|0.087217|0.178524|0.135869|0.142849|0.136942|0.191631|0.174147|0.219584|0.500000| |2.483925|3.008675|3.185432|3.822407|4.557016|4.121853|3.333281|4.317216|4.994412|5.905694|10.480897|7.475228|0.148045|4.336386|0.109079|4.850304|5.286155|5.366048|6.705763|8.350109|8.672271|5.719101|5.666171|8.654548|17.586141|4.525215|0.086449|2.794857|2.620313|2.444816|2.246377|2.283496|4.441748|3.201172|2.636681|0.073338|2.445248|2.056100|2.007470|4.071703|0.062546|0.066009|0.068060|0.078476|0.103699|0.084032|0.102983|0.223918|0.142850|0.124989|0.124898|0.138744|0.217020|0.195767|0.303196|0.500000| |2.769379|3.267903|3.000960|3.236477|4.065278|4.869778|4.112887|6.596842|6.654127|4.840858|7.406263|5.587880|0.096463|6.955213|0.188445|4.575676|5.527474|4.331791|4.121518|4.886869|3.227814|2.728034|2.294797|2.327262|2.765646|12.294648|0.181284|17.657985|8.945745|6.770008|4.595572|4.430201|10.233961|6.780711|5.012174|0.121109|3.826985|3.323165|3.915169|9.368836|0.073085|0.079160|0.068000|0.071896|0.079779|0.117338|0.194624|0.101580|0.075177|0.075743|0.057961|0.061352|0.063701|0.058439|0.073980|0.079434|0.500000| |2.209613|2.514298|2.372067|2.552466|3.055061|3.402312|2.982352|4.250844|4.653860|3.808446|6.415963|4.370993|0.079429|5.582159|0.148901|4.269264|5.766080|4.457490|4.021707|4.502353|2.845375|2.472395|2.113562|2.099676|2.462315|12.510377|0.222447|17.672177|8.937824|5.882883|4.519321|4.832801|12.292216|7.458737|6.818215|0.161464|4.644383|4.239877|5.554164|15.643039|0.059180|0.062978|0.055488|0.058599|0.065258|0.084776|0.123022|0.085049|0.066757|0.070576|0.053560|0.057823|0.056507|0.053454|0.067805|0.068965|0.301000|0.500000| |2.827688|3.086988|2.648980|2.648617|3.108581|3.910573|3.873088|4.832540|4.169226|3.187849|4.979369|3.972207|0.070524|4.433176|0.148208|3.397732|4.140056|3.508064|3.455490|4.010527|2.827102|2.604189|2.162615|2.122420|2.375301|6.166101|0.115098|6.302203|8.816869|17.786507|8.442890|5.851697|10.444594|3.514135|3.049229|0.081003|2.505247|2.334597|2.698065|5.804880|0.073221|0.086465|0.069760|0.064748|0.064839|0.126301|0.176378|0.089433|0.075354|0.073574|0.056404|0.056843|0.059526|0.052933|0.061927|0.066707|0.186460|0.144093|0.500000| |2.135172|2.251160|1.997187|2.001027|2.273758|2.677711|2.651591|3.170359|2.976371|2.422452|3.983326|3.002328|0.055071|3.385210|0.113695|2.948791|3.771506|3.347847|3.288466|3.640501|2.557185|2.535438|2.108039|1.976941|2.129578|4.632899|0.096235|4.037594|5.847929|8.442652|17.812224|8.834333|10.447153|2.709861|2.520224|0.070791|2.102339|2.017319|2.284378|4.748106|0.055440|0.064736|0.055012|0.050249|0.050459|0.083187|0.105719|0.077161|0.073607|0.074934|0.056175|0.055984|0.055017|0.049491|0.055995|0.057740|0.104489|0.101204|0.193263|0.500000| |1.796797|1.940896|1.792080|1.855858|2.130216|2.402170|2.254517|2.903409|2.985277|2.480957|4.264601|2.955253|0.054910|3.730153|0.121561|3.512020|4.847132|4.275748|3.987297|4.216685|2.754641|2.736410|2.270558|2.073093|2.262943|5.394829|0.125046|4.295104|6.035025|5.811486|8.613646|17.843211|16.476625|3.096247|3.030725|0.090319|2.445401|2.366666|2.664255|5.642965|0.047029|0.052699|0.046826|0.045260|0.047748|0.067156|0.090845|0.079233|0.075444|0.084869|0.059543|0.062278|0.055854|0.052151|0.061236|0.059736|0.100445|0.111935|0.123042|0.195025|0.500000| |2.359436|2.813625|2.809333|3.232521|4.022424|4.080438|3.286488|4.926714|6.221724|5.930994|10.352910|6.377983|0.116137|6.290602|0.138159|4.896406|6.381452|4.902477|4.479738|5.111525|3.207187|2.610460|2.287077|2.376846|2.921007|12.315162|0.184069|7.482155|4.752149|3.752209|3.062347|3.195601|7.237404|17.630184|8.824124|0.174154|6.722396|4.828816|5.211953|12.856373|0.063388|0.064693|0.059414|0.068595|0.084258|0.086866|0.122400|0.095462|0.069051|0.071802|0.056785|0.062747|0.063330|0.061052|0.082078|0.084829|0.215130|0.207753|0.100277|0.073124|0.078769|0.500000| |2.164329|2.578565|2.620498|3.075604|3.844148|3.756784|2.981690|4.594213|6.537394|6.966288|15.251892|6.608735|0.123830|7.425475|0.147227|7.020537|9.617486|6.916658|6.070582|6.866682|3.948829|3.075351|2.699530|2.807182|3.608176|12.320143|0.209688|5.649256|4.172254|3.320149|2.863217|3.093638|6.949401|17.734998|8.923006|0.213043|6.930608|4.580778|4.374740|10.189585|0.057363|0.059061|0.055734|0.064401|0.081936|0.078305|0.112180|0.112154|0.078267|0.084690|0.065351|0.075489|0.072471|0.072026|0.105727|0.102521|0.147208|0.147461|0.086306|0.068848|0.078544|0.300499|0.500000| |1.855830|2.132860|2.192352|2.490127|2.850414|2.741683|2.346268|3.027408|3.575892|3.817593|7.519399|4.507660|0.090354|3.692623|0.087294|3.477591|5.048173|4.249029|3.775749|3.948732|2.494091|2.112972|1.939719|2.011499|2.397419|6.297627|0.119420|4.047142|3.117398|2.607400|2.294178|2.442510|5.245672|7.211026|8.810062|0.174412|17.530723|8.800482|6.810539|12.174758|0.050790|0.050465|0.047752|0.055719|0.068326|0.062072|0.077442|0.070530|0.055208|0.058613|0.048645|0.054595|0.052953|0.053358|0.070049|0.068647|0.109147|0.124347|0.069508|0.056561|0.063241|0.209275|0.187125|0.500000| |1.681868|1.919421|1.970217|2.233421|2.553239|2.461002|2.110810|2.755097|3.321236|3.555770|7.428123|4.087695|0.082728|3.626906|0.085639|3.748256|5.895257|5.091601|4.317954|4.293166|2.617596|2.230157|2.068014|2.115908|2.525840|5.986079|0.122939|3.595575|2.924212|2.437436|2.216078|2.424036|5.186415|6.336723|8.718702|0.220252|17.606395|8.656609|5.696610|10.360537|0.045588|0.045894|0.043845|0.050307|0.061624|0.056206|0.071126|0.071618|0.057087|0.062646|0.051495|0.059445|0.054623|0.056517|0.076020|0.070474|0.092780|0.107197|0.063647|0.054747|0.064241|0.152111|0.186678|0.300974|0.500000| |1.533815|1.706683|1.731236|1.899935|2.102432|2.068273|1.848321|2.254642|2.533623|2.590530|4.962285|3.171719|0.063836|2.695716|0.067556|2.617645|3.917256|3.462390|3.055217|3.081176|1.973530|1.747097|1.623581|1.648346|1.892414|4.492807|0.091685|3.113104|2.597814|2.227468|2.036510|2.192649|4.567107|4.196333|5.733220|0.138111|8.683391|17.603692|8.719399|10.391934|0.042286|0.042138|0.039792|0.044838|0.052218|0.049944|0.059957|0.055132|0.045901|0.049268|0.041407|0.046097|0.043505|0.044138|0.055214|0.053147|0.081641|0.099252|0.058950|0.050943|0.058252|0.115276|0.107632|0.217300|0.194230|0.500000| |1.493828|1.661814|1.669590|1.830035|2.051506|2.046671|1.821144|2.286661|2.610578|2.611717|5.068290|3.109935|0.061937|2.920004|0.073382|2.934395|4.624240|4.073652|3.463752|3.411871|2.125904|1.894544|1.749144|1.744425|2.004640|4.958693|0.107249|3.312961|2.822654|2.369372|2.209805|2.455560|5.185633|4.480285|6.866419|0.190812|8.825144|17.568986|8.803624|11.763112|0.040753|0.041326|0.038915|0.043028|0.049926|0.049647|0.061493|0.058600|0.049258|0.054284|0.044444|0.050180|0.045584|0.046524|0.058961|0.055241|0.083038|0.105534|0.061177|0.054808|0.066260|0.112761|0.115001|0.174004|0.217532|0.301956|0.500000| |1.726994|1.918081|1.899577|2.052502|2.299576|2.343349|2.113174|2.595757|2.841319|2.747287|4.989492|3.363930|0.065573|3.037834|0.077662|2.752345|3.979611|3.383010|3.024104|3.158336|2.039277|1.806203|1.639119|1.655715|1.900937|5.378866|0.106595|4.154865|3.329848|2.811376|2.490437|2.647194|5.630649|4.802832|6.304151|0.139267|6.545345|8.738636|17.582149|16.592483|0.047727|0.048014|0.044115|0.048690|0.055062|0.057989|0.070531|0.058444|0.048201|0.051036|0.041962|0.045802|0.044271|0.043652|0.054102|0.053656|0.108634|0.146213|0.074598|0.061381|0.068386|0.141463|0.110499|0.180773|0.134068|0.220189|0.174646|0.500000| 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