Version2.4 2021-05-27T02:41:18Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 18-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCCN1[C@H](C(=C(C1=O)[O-])C(=O)c2ccc3c(c2)C[C@H](O3)C)c4ccc(cc4)N(C)C C40096143 RHF 6-31G(d) (6D,7F) CCCCN1[C@H](C(=C(C1=O)[O-])C(=O)c2ccc3c(c2)C[C@H](O3)C)c4ccc(cc4)N(C)C C01[X(C26H29N2O4)] 177 C1 538 CCCCN1C(=O)C(=C([C@@H]1c1ccc(cc1)N(C)C)C(=O)c1ccc2c(c1)C[C@H](O2)C)[O-] CCCCN1C(=O)C(=C([C@@H]1c1ccc(cc1)N(C)C)C(=O)c1ccc2c(c1)C[C@H](O2)C)[O-] CCCCN1[C@@H](c2ccc(cc2)N(C)C)C(=C([O-])C1=O)C(=O)c3ccc4O[C@H](C)Cc4c3 InChIKey=KGFDSHVGVXMJQT-MWTRTKDXSA-M InChI=1S/C26H30N2O4/c1-5-6-13-28-23(17-7-10-20(11-8-17)27(3)4)22(25(30)26(28)31)24(29)18-9-12-21-19(15-18)14-16(2)32-21/h7-12,15-16,23,30H,5-6,13-14H2,1-4H3/p-1/t16-,23+/m1/s1 InChI=1/C26H30N2O4/c1-5-6-13-28-23(17-7-10-20(11-8-17)27(3)4)22(25(30)26(28)31)24(29)18-9-12-21-19(15-18)14-16(2)32-21/h7-12,15-16,23,30H,5-6,13-14H2,1-4H3/p-1/t16-,23+/m1/s1/fC26H29N2O4/h30h/q-1 CCCCN1[C@H](C(=C(C1=O)[O-])C(=O)c2ccc3c(c2)C[C@H](O3)C)c4ccc(cc4)N(C)C C01[X(C26H29N2O4)] 177 C01 538 CCCCN1C(=O)C(=C([C@@H]1c1ccc(cc1)N(C)C)C(=O)c1ccc2c(c1)C[C@H](O2)C)[O-] CCCCN1C(=O)[C]([C]([C](=O)[C]2[CH][CH][C]3[C]([CH]2)C[C@H](O3)C)[C@@H]1[C]1[CH][CH][C]([CH][CH]1)N(C)C)=O CCCCN1[C@@H]([C]2[CH][CH][C]([CH][CH]2)N(C)C)[C](C(=O)[C]3[CH][CH][C]4O[C@H](C)C[C]4[CH]3)C(=O)C1=O InChIKey=KTNCVTQBTHIVEB-MWTRTKDXSA-N InChI=1S/C26H29N2O4/c1-5-6-13-28-23(17-7-10-20(11-8-17)27(3)4)22(25(30)26(28)31)24(29)18-9-12-21-19(15-18)14-16(2)32-21/h7-12,15-16,23H,5-6,13-14H2,1-4H3/t16-,23+/m1/s1 InChI=1/C26H29N2O4/c1-5-6-13-28-23(17-7-10-20(11-8-17)27(3)4)22(25(30)26(28)31)24(29)18-9-12-21-19(15-18)14-16(2)32-21/h7-12,15-16,23H,5-6,13-14H2,1-4H3/t16-,23+/m1/s1 3212.1491296863 -1409.8385935 1-A 15971.6281 116 422 538 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11940.9183 20160.4197 23693.9094 0.99962 0.00436 0.02724 -0.00523 0.99947 0.03212 -0.02708 -0.03225 0.99911 1 0.00725 0.00430 0.00366 0.15114 0.08952 0.07617 19.55 27.66 33.03 42.86 56.16 59.23 84.19 87.07 90.52 102.97 115.15 140.59 164.93 179.29 204.43 220.64 242.01 262.74 309.25 321.44 330.49 362.18 375.81 378.37 396.09 410.20 426.68 447.81 457.30 484.64 495.30 509.72 544.66 604.51 618.49 648.26 664.28 673.71 682.19 696.52 703.88 729.31 773.46 843.80 877.34 885.43 908.59 931.85 951.58 979.67 1005.03 1044.18 1101.49 1136.39 1141.17 1155.50 1188.26 1215.10 1223.77 1252.18 1276.89 1279.74 1315.39 1321.18 1327.15 1347.28 1360.11 1379.53 1402.12 1411.31 1450.15 1466.00 1485.91 1503.36 1503.86 1532.74 1547.94 1566.66 1585.61 1590.49 1600.83 1630.47 1659.78 1679.09 1680.65 1723.08 1738.91 1745.66 1758.30 1762.93 1764.64 1795.18 1813.20 1824.04 1849.58 1850.61 1865.48 1876.89 1880.28 1896.97 1909.26 1935.28 1949.89 1961.23 1969.04 1993.53 2016.02 2031.79 2038.03 2058.33 2069.13 2087.59 2129.72 2137.24 2165.38 2173.99 2187.80 2195.23 2208.06 2247.86 2257.16 2261.02 2275.16 2280.23 2294.67 2310.12 2335.87 2346.58 2351.08 2352.24 2354.00 2359.30 2365.38 2366.67 2366.87 2370.54 2378.76 2382.86 2396.53 2402.34 2433.13 2550.19 2575.33 2594.95 2618.48 2619.03 2791.45 2817.16 4503.39 4517.46 4563.21 4574.11 4589.36 4591.61 4596.01 4600.95 4612.55 4614.26 4642.21 4646.50 4658.39 4667.22 4671.94 4678.80 4687.76 4701.18 4722.00 4726.01 4735.01 4761.94 4821.27 4833.28 4848.37 4861.22 4873.68 4875.29 4875.61 0.542144 0.571016 0.571960 0.478253 -1409.296450 -1409.267577 -1409.266633 -1409.360340 3.142948D-04
MUNgauss RevisionA2.1 retrievium 27-May-2021 DUDE CCCCN1[C@H](C(=C(C1=O)[O-])C(=O)c2ccc3c(c2)C[C@H](O3)C)c4ccc(cc4)N(C)C C40096143 RHF 6-31G(d) (6D,10F) C1 433.212733 |X|Y|Z| 95.038374 66.475274 50.201158
68.195799 21 6 7 8 19 1 1
|36.858105| |12.461971|36.858105| |7.469782|12.456020|36.858105| |4.866614|7.484696|12.444454|36.858105| |3.784082|4.966142|7.667127|13.221436|53.358707| |3.269299|4.019563|5.632170|7.456515|17.773347|36.858105| |3.560708|4.268913|6.066725|6.843463|12.497774|17.511282|0.500000| |2.742158|3.199500|4.248553|5.111217|11.138229|12.517261|0.241053|36.858105| |2.741644|3.200040|4.243452|5.114313|11.111637|7.906879|0.167266|13.467455|36.858105| |3.338999|4.121112|5.841000|7.793595|19.166929|8.078402|0.172923|8.087794|12.364803|36.858105| |3.384871|4.136695|5.518382|6.763069|11.438148|5.429924|0.128211|5.409111|7.721311|15.843088|73.516695| |2.425947|2.751482|3.475993|3.983688|7.494672|5.281856|0.122419|7.882910|15.759397|7.969990|11.726423|73.516695| |2.341287|2.638943|3.309159|3.758467|6.976631|7.278430|0.175685|13.326550|7.560216|5.080875|6.943840|10.976953|36.858105| |2.068258|2.297401|2.798692|3.135754|5.558262|5.105685|0.125768|8.080323|6.418701|4.307746|6.233075|11.040038|15.683331|73.516695| |2.294516|2.545130|3.113295|3.409662|5.836886|6.220334|0.175010|7.502750|4.930703|3.934097|5.623222|7.427264|12.507598|14.594136|36.858105| |2.499766|2.717024|3.332491|3.452063|5.657568|5.842508|0.192942|6.079862|4.310077|3.704274|5.391482|6.493250|7.459983|9.784295|13.723917|36.858105| |2.317468|2.464554|2.891570|2.928796|4.512506|4.321372|0.141078|4.246986|3.284076|2.956607|4.469704|5.126040|4.959794|7.300917|7.829033|13.672606|36.858105| |2.031254|2.169897|2.486095|2.578364|3.937122|3.693330|0.112902|3.692025|2.915755|2.612971|3.998461|4.644481|4.448454|6.921135|6.899825|8.058313|13.856945|36.858105| |1.911820|2.073478|2.383201|2.551126|3.979160|3.764652|0.108452|3.930607|3.073998|2.679195|4.075746|4.934279|5.040869|8.100692|7.945511|6.931156|7.895385|13.768305|36.858105| |2.007244|2.211876|2.604711|2.862080|4.671118|4.603660|0.126419|5.189298|3.839995|3.181471|4.719860|6.085001|7.593484|11.840224|13.648017|7.949327|6.801832|7.970974|13.844051|36.858105| |1.685076|1.812450|2.030523|2.164428|3.284479|2.957017|0.084011|3.046644|2.512430|2.238104|3.487227|4.129288|3.701811|6.297325|4.929654|4.501873|5.209066|8.158467|12.625511|7.216532|36.858105| |1.692570|1.797112|1.984161|2.070274|3.061983|2.712692|0.079425|2.693170|2.251354|2.062680|3.245931|3.684633|3.118570|5.186521|4.087839|4.157788|5.319877|8.444430|8.079391|5.121460|12.340505|36.858105| |1.719918|1.835741|2.007275|2.105520|3.070877|2.708235|0.079203|2.614177|2.191263|2.042454|3.220479|3.559237|2.943454|4.833226|3.771794|3.834203|4.767936|6.840180|6.596575|4.590934|8.819323|17.527877|0.500000| |1.859205|1.958412|2.183884|2.237103|3.315569|2.974029|0.090117|2.928805|2.415910|2.216275|3.466139|3.914841|3.381958|5.469678|4.630977|5.215731|7.849948|14.014774|8.337144|5.339343|8.024001|13.359879|0.260619|73.516695| |1.514124|1.586799|1.729409|1.784019|2.610757|2.245631|0.065403|2.253481|1.939977|1.787138|2.856518|3.231478|2.573427|4.397902|3.191600|3.261289|4.012249|5.448299|5.210120|3.811252|7.360814|12.572427|0.247002|14.153280|36.858105| |2.911876|3.592883|4.506948|6.098977|10.550854|12.451290|0.250228|7.394631|5.390853|5.486401|7.463381|7.269666|5.871783|7.924168|5.646018|5.028899|4.084929|3.756814|3.974930|4.769074|3.193430|2.905323|0.082991|5.466490|2.361606|36.858105| |2.869030|3.460589|4.089368|5.000291|7.374450|7.497681|0.206249|5.158976|3.967607|4.059024|5.909269|5.696752|4.652227|6.549019|5.148898|4.983481|4.430211|4.153428|4.231005|4.653052|3.445614|3.257683|0.096293|6.149991|2.589777|13.805744|36.858105| |2.496720|2.956041|3.284324|3.925221|5.523957|4.969806|0.133657|3.914067|3.207834|3.264055|4.965767|4.818527|3.719220|5.580499|4.096647|3.880721|3.687656|3.713679|3.891006|4.079285|3.406373|3.242324|0.099575|5.808669|2.594559|7.859897|13.660488|36.858105| |2.257917|2.677851|2.944708|3.609781|5.139748|4.378316|0.110749|3.671669|3.128570|3.165142|4.888344|4.789071|3.495859|5.444067|3.631101|3.283930|3.069754|3.148465|3.441263|3.714978|3.120319|2.873465|0.087026|4.988430|2.361865|6.752749|7.904459|13.781202|36.858105| |2.284276|2.747910|3.102993|3.993654|5.977323|4.988707|0.116813|4.292953|3.720791|3.742721|5.697383|5.640581|3.947654|6.177276|3.800330|3.300123|2.947510|2.963175|3.298120|3.776676|2.926471|2.619594|0.076737|4.597510|2.181877|7.886608|6.936028|7.989773|13.621840|36.858105| |2.549360|3.122998|3.730661|5.091255|8.463013|7.477145|0.155595|6.093992|5.053131|5.063709|7.216028|7.183586|5.114980|7.572291|4.597139|3.902195|3.291190|3.179521|3.507956|4.229238|2.960948|2.635191|0.075434|4.772114|2.184559|13.635680|8.025520|6.905005|7.887526|13.849782|36.858105| |1.986863|2.306118|2.456228|2.904010|4.038714|3.298360|0.085513|2.902067|2.562235|2.586406|4.119811|4.049043|2.829608|4.572823|2.946168|2.702116|2.605727|2.733270|2.981720|3.104687|2.856830|2.667799|0.081946|4.501655|2.249617|4.486683|5.092317|7.696609|13.359472|7.854542|5.150960|53.358707| |1.962292|2.246522|2.329702|2.664911|3.590037|2.892289|0.077727|2.522029|2.242607|2.293454|3.702145|3.563633|2.459823|3.975243|2.614456|2.488835|2.471817|2.591072|2.730802|2.737433|2.665518|2.599639|0.081562|4.395656|2.220668|3.742738|4.471856|6.607671|7.808337|5.173718|3.946958|17.968715|36.858105| |1.757426|2.002273|2.147180|2.494226|3.561949|2.935095|0.076051|2.719228|2.408641|2.354889|3.763673|3.885336|2.755880|4.582854|2.880382|2.583104|2.511679|2.715923|3.065325|3.172140|3.056599|2.773994|0.084924|4.519343|2.357604|3.807959|4.128569|5.541318|7.891975|6.208906|4.400749|17.879082|7.945087|36.858105| |17.527757|8.756375|5.448791|4.040077|4.359007|2.815978|0.083876|2.397223|2.397891|2.867184|5.210817|3.826001|2.082559|3.309064|2.052343|2.216322|2.087135|1.858363|1.754613|1.826716|1.567248|1.581700|0.044851|3.062933|1.425627|2.592529|2.589329|2.315497|2.114171|2.120736|2.317276|2.575019|1.890309|1.673554|0.500000| |17.529341|8.773745|6.767594|4.493313|4.978475|3.313355|0.103926|2.770081|2.698674|3.185102|5.562303|4.229275|2.399349|3.742368|2.402990|2.683188|2.519689|2.178678|2.015886|2.093938|1.769236|1.796418|0.050673|3.552857|1.604301|2.941341|2.966369|2.559282|2.269451|2.262763|2.521426|2.712300|1.981451|1.767657|0.301438|0.500000| |17.536960|8.780539|6.778813|4.502718|4.988524|3.123850|0.093332|2.707956|2.776798|3.386376|6.280666|4.433346|2.309883|3.662502|2.229780|2.417945|2.221500|1.944580|1.838157|1.942290|1.619633|1.616959|0.045274|3.156899|1.454714|2.719124|2.620935|2.281143|2.090042|2.143847|2.409402|2.511416|1.805627|1.652474|0.301396|0.301788|0.500000| |8.862557|17.494529|8.844210|6.871049|6.296597|3.952671|0.117309|3.076438|2.984012|3.719111|6.433209|4.549589|2.579673|3.979454|2.541292|2.713024|2.502993|2.225153|2.121689|2.239232|1.864879|1.862811|0.053443|3.594502|1.637437|3.746634|3.768903|3.266439|2.912779|2.913724|3.238031|3.414890|2.483367|2.138764|0.212552|0.210701|0.173019|0.500000| |8.866131|17.507075|8.860396|6.896738|6.312934|3.642300|0.102709|2.991607|3.088900|4.046756|7.612505|4.803443|2.469545|3.883637|2.339687|2.440895|2.211409|1.978561|1.918192|2.057253|1.692813|1.665804|0.047246|3.187984|1.480063|3.317711|3.128212|2.741549|2.560716|2.672440|3.010482|3.038934|2.162015|1.943998|0.212625|0.172993|0.210904|0.303811|0.500000| |6.840698|8.838835|17.545153|8.910301|9.561227|5.073491|0.147449|4.194541|4.460175|6.286493|11.400314|6.647578|3.260915|4.990398|2.986028|3.175001|2.729541|2.345627|2.259035|2.486456|1.928750|1.873341|0.052102|3.664419|1.648336|3.927715|3.485726|2.854155|2.615890|2.798480|3.366021|3.013006|2.087712|1.973318|0.139929|0.168328|0.203033|0.173427|0.211696|0.500000| |6.855679|8.850355|17.503191|8.842953|9.494874|6.031558|0.204929|4.437363|4.158280|5.226411|8.267031|6.016027|3.527854|5.198019|3.444809|3.860364|3.348530|2.793789|2.615059|2.829940|2.196381|2.168835|0.060822|4.326979|1.875442|4.700841|4.449368|3.461446|2.993429|3.077253|3.690780|3.376850|2.371922|2.177201|0.140098|0.203251|0.168913|0.211462|0.173659|0.302940|0.500000| |4.525714|6.853594|8.822984|17.557557|12.584617|7.093370|0.185495|4.667465|4.364863|5.813597|8.944780|6.166138|3.602480|5.329233|3.406902|3.447688|2.995464|2.674343|2.645597|2.927086|2.257565|2.173748|0.062300|4.149377|1.857649|7.000867|6.116279|4.767256|4.269863|4.580785|5.675037|4.560609|3.091995|2.779287|0.108375|0.119241|0.111186|0.206414|0.171426|0.174041|0.210816|0.500000| |4.539023|6.861238|8.870538|17.596344|12.660466|5.646183|0.139764|4.384885|4.715907|7.378842|13.383739|6.852085|3.319107|5.105312|2.961645|2.936516|2.530517|2.274437|2.278151|2.550448|1.968956|1.876227|0.052999|3.555882|1.636247|4.975131|4.118231|3.450152|3.326567|3.760561|4.632457|3.747135|2.519125|2.379010|0.108580|0.111269|0.120021|0.170405|0.207471|0.214292|0.173847|0.302415|0.500000| |2.800989|3.024708|3.832702|3.826338|6.327882|6.371390|0.229253|6.506629|4.727712|4.142312|5.985198|6.993113|6.931131|9.099042|8.957263|17.725327|8.930077|5.704640|4.982944|5.657697|3.591878|3.411939|0.089105|7.451369|2.797780|4.889138|4.669971|3.573215|3.046497|3.109132|3.748988|3.419855|2.330317|2.365923|0.067746|0.084209|0.075899|0.082256|0.074494|0.102853|0.127039|0.102877|0.088896|0.500000| |2.392315|2.486711|2.873586|2.809912|4.193776|3.838010|0.128155|3.670791|2.960853|2.748712|4.231404|4.662233|4.042840|6.102035|5.585738|8.816888|17.724409|8.912336|5.623989|4.915722|4.264998|4.682117|0.119391|12.459405|3.759917|3.580091|3.929490|3.319613|2.761390|2.631009|2.907224|3.242916|2.309277|2.274640|0.059893|0.073543|0.063568|0.070167|0.061393|0.075384|0.093873|0.079640|0.067495|0.213423|0.500000| |1.877475|2.078548|2.427707|2.712623|4.436873|4.214543|0.110245|4.913998|3.795568|3.099155|4.639267|6.174465|7.137054|12.724624|8.932800|5.661258|4.916419|5.647062|8.891015|17.728531|6.435717|4.426660|0.112628|7.650191|3.466241|4.486430|4.211007|3.856821|3.729348|3.922053|4.309481|4.311618|2.724661|3.346721|0.047749|0.053774|0.050670|0.058337|0.054445|0.064808|0.071686|0.076847|0.068483|0.124626|0.106920|0.500000| |1.641473|1.780252|1.980924|2.142420|3.234048|2.886231|0.080345|2.941854|2.448731|2.199204|3.437334|4.025329|3.500377|5.990897|4.420732|3.913963|4.291356|5.997683|8.717154|6.354299|17.567180|8.707135|0.225844|10.451040|6.017591|3.230923|3.502853|3.622043|3.414917|3.158660|3.090397|4.348778|2.945519|3.549973|0.042606|0.047530|0.043696|0.051166|0.046490|0.052038|0.058871|0.062639|0.054537|0.089170|0.100067|0.174602|0.500000| |1.572723|1.679499|1.877705|1.989665|3.025380|2.672454|0.075372|2.828437|2.383266|2.102748|3.305098|3.994836|3.469692|6.154602|4.413017|4.006156|4.496231|6.393089|8.827203|6.200070|17.508842|8.705027|0.175593|11.427754|7.174222|2.812765|2.943381|2.888655|2.710345|2.604659|2.652394|3.419814|2.342373|2.707923|0.040706|0.045729|0.042312|0.047622|0.043816|0.050109|0.056061|0.056954|0.050732|0.091153|0.105230|0.164329|0.301815|0.500000| |1.479835|1.543629|1.690551|1.735867|2.558724|2.193541|0.063808|2.244156|1.942756|1.771728|2.836675|3.266005|2.594919|4.503423|3.199855|3.268892|3.982368|5.271113|5.061630|3.792585|6.736966|8.867441|0.173838|12.715299|17.562194|2.260066|2.425359|2.385081|2.189346|2.062719|2.093456|2.817396|2.021103|2.165784|0.038613|0.043529|0.039762|0.043888|0.040055|0.045149|0.050889|0.049689|0.044315|0.078203|0.103772|0.096075|0.147123|0.209906|0.500000| |1.509901|1.569575|1.694982|1.729618|2.499095|2.127827|0.062596|2.104382|1.825228|1.703947|2.738913|3.035058|2.354142|3.987910|2.883704|3.033563|3.774810|4.830358|4.328846|3.299503|5.417341|8.852913|0.213807|12.830634|17.563571|2.227451|2.466885|2.473410|2.230774|2.046123|2.047116|2.905785|2.146291|2.203585|0.039640|0.044664|0.040189|0.045131|0.040552|0.044783|0.051222|0.050129|0.044053|0.073783|0.102760|0.082980|0.129824|0.142898|0.300805|0.500000| |1.423818|1.497174|1.622320|1.686205|2.460394|2.096223|0.060210|2.107118|1.832225|1.691666|2.717329|3.069076|2.392395|4.137676|2.888341|2.869155|3.375997|4.407461|4.528329|3.477214|6.641188|8.858178|0.212563|10.142128|17.535353|2.231799|2.434766|2.491985|2.316326|2.136390|2.105658|3.063812|2.224236|2.406963|0.037409|0.041632|0.038011|0.042980|0.039048|0.042974|0.048408|0.048877|0.043292|0.069166|0.087466|0.091237|0.169900|0.186673|0.300124|0.300518|0.500000| |3.073232|3.623771|4.289614|4.830858|6.906607|6.963632|0.229342|4.839575|3.728700|3.824464|5.627232|5.396534|4.439597|6.219477|5.212972|5.634516|5.190427|4.601549|4.348169|4.559318|3.481870|3.430580|0.101199|6.780121|2.711460|8.955441|17.697431|8.933798|5.645830|4.983244|5.676850|5.632201|3.894279|3.481766|0.076352|0.090864|0.077232|0.110199|0.088167|0.100468|0.137749|0.159922|0.107973|0.148849|0.131173|0.109538|0.095214|0.082307|0.070470|0.072729|0.069521|0.500000| |2.399557|2.773479|2.992785|3.406007|4.662146|4.076834|0.115009|3.315535|2.767640|2.815878|4.371722|4.237632|3.223704|4.927328|3.652590|3.601219|3.613932|3.709601|3.759930|3.716353|3.410105|3.397062|0.108081|6.044887|2.719445|5.632888|8.934188|17.727311|8.899130|5.652319|4.969943|9.487417|7.317102|5.200110|0.062520|0.069134|0.060542|0.086084|0.071027|0.072477|0.088705|0.113205|0.083849|0.091849|0.092478|0.096279|0.100753|0.079620|0.068252|0.073065|0.072583|0.217682|0.500000| |2.086703|2.482942|2.753189|3.481994|5.148290|4.074810|0.096495|3.721151|3.391171|3.396880|5.336107|5.324896|3.474387|5.674273|3.273623|2.843466|2.565017|2.601948|2.910639|3.308288|2.656899|2.370019|0.069053|4.106920|2.015085|5.623284|4.984159|5.674508|8.913105|17.707223|8.950766|9.917476|4.781846|6.363201|0.054331|0.056947|0.054870|0.072456|0.068316|0.070270|0.074748|0.107510|0.094671|0.074896|0.064168|0.098012|0.080286|0.066935|0.053172|0.052461|0.055415|0.108028|0.124193|0.500000| |2.475622|3.019844|3.641186|5.004364|8.816066|6.972988|0.140682|6.532619|5.972003|5.854620|8.288441|8.519968|5.246703|8.082149|4.307095|3.607779|3.000618|2.880192|3.186989|3.905647|2.710593|2.395455|0.067504|4.341560|2.022438|8.914729|5.688851|4.969391|5.627825|8.968167|17.726699|5.700108|3.305558|3.774423|0.062423|0.067185|0.066139|0.084622|0.082537|0.094419|0.097489|0.143292|0.132967|0.098294|0.074096|0.113540|0.077966|0.069020|0.054501|0.052578|0.054291|0.124604|0.107825|0.216304|0.500000| |2.142397|2.478227|2.527249|2.891811|3.778570|2.987529|0.080954|2.537482|2.270829|2.376561|3.854414|3.581972|2.419484|3.870599|2.553439|2.475648|2.446695|2.503810|2.580669|2.600694|2.468968|2.439713|0.075870|4.229227|2.091931|3.848391|4.669215|6.732516|7.232544|4.983407|3.954051|12.475594|17.598104|5.712193|0.057588|0.059925|0.054138|0.077584|0.066146|0.062044|0.071164|0.095381|0.075852|0.065413|0.064278|0.070934|0.074049|0.060547|0.053219|0.056708|0.057534|0.114257|0.209514|0.125165|0.091782|0.500000| |1.795439|2.034494|2.086579|2.362558|3.174427|2.509589|0.067319|2.236146|2.024635|2.068345|3.384817|3.262885|2.190296|3.598574|2.301598|2.189816|2.180061|2.291261|2.418258|2.419083|2.404515|2.347364|0.073080|3.936381|2.051442|3.133054|3.578589|4.821770|5.706077|4.300987|3.355951|12.538429|17.550823|7.244654|0.048443|0.050118|0.046149|0.062025|0.054962|0.052510|0.058546|0.074808|0.063044|0.057264|0.056950|0.067619|0.073931|0.059645|0.052056|0.055220|0.057704|0.088550|0.143945|0.117416|0.080925|0.301404|0.500000| |1.918816|2.165188|2.254674|2.526678|3.433819|2.823222|0.077437|2.477603|2.174369|2.195439|3.527449|3.459687|2.463102|3.973824|2.694099|2.594414|2.642591|2.823748|2.952535|2.868920|2.934841|2.925574|0.094441|4.879122|2.476041|3.594428|4.449684|6.527120|6.633486|4.501197|3.627874|12.154179|17.425449|7.014370|0.051249|0.054471|0.049058|0.066327|0.057222|0.056249|0.064817|0.080678|0.065486|0.066629|0.068658|0.078253|0.090729|0.070561|0.061596|0.066741|0.069015|0.111684|0.228770|0.113081|0.084654|0.299996|0.301180|0.500000| |1.719896|1.937791|2.086949|2.382725|3.428922|2.887903|0.076201|2.699279|2.351913|2.266365|3.602535|3.798022|2.808930|4.670774|3.038814|2.729746|2.712806|3.021165|3.457717|3.462957|3.561148|3.218697|0.100676|5.090148|2.695333|3.691046|4.129116|5.496536|6.776246|5.250402|4.039684|12.204106|7.005003|17.426010|0.045397|0.048511|0.044953|0.057393|0.051763|0.053380|0.059608|0.073293|0.062344|0.068234|0.067775|0.100896|0.119105|0.085908|0.067717|0.069357|0.077146|0.099237|0.151040|0.140278|0.096203|0.142531|0.172768|0.204911|0.500000| |1.633467|1.845921|1.950205|2.237291|3.149102|2.533909|0.066176|2.366609|2.140166|2.108693|3.424224|3.497467|2.389076|4.025912|2.476720|2.254104|2.209806|2.380335|2.645507|2.704878|2.686265|2.480644|0.075747|4.033914|2.164219|3.165723|3.394176|4.358503|5.723341|4.817686|3.609317|12.461811|7.264621|17.547980|0.043569|0.045495|0.042739|0.054743|0.050140|0.050056|0.054615|0.068742|0.060023|0.057950|0.056344|0.079096|0.085866|0.067308|0.055345|0.056646|0.061972|0.081965|0.118137|0.143380|0.089078|0.146763|0.221899|0.175096|0.299757|0.500000| |1.741720|1.990933|2.162419|2.542778|3.713368|3.060263|0.077508|2.910053|2.591528|2.493782|3.970805|4.204642|2.967379|5.004905|3.018529|2.632879|2.505314|2.697001|3.112202|3.337141|3.062136|2.693204|0.080396|4.408816|2.293575|3.956947|4.035324|5.052824|7.309883|6.952435|4.845892|12.415418|5.713029|17.626837|0.045848|0.048432|0.045841|0.058365|0.053997|0.055704|0.060510|0.077538|0.067841|0.066982|0.062423|0.101065|0.098611|0.076428|0.059355|0.058968|0.064921|0.093403|0.124658|0.217262|0.118412|0.127507|0.147052|0.142199|0.300880|0.301641|0.500000|
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