Version2.1 2020-12-18T01:37:46Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 06-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCOc1ccc(cc1)N2C(=O)c3cc4c(n3C[C@]2(C)C(=O)NC5CCCCCC5)ccs4 C21809663 RHF 6-31G(d) (6D,7F) CCOc1ccc(cc1)N2C(=O)c3cc4c(n3C[C@]2(C)C(=O)NC5CCCCCC5)ccs4 C01[X(C26H31N3O3S1)] 186 C1 561 CCOc1ccc(cc1)N1C(=O)c2cc3c(n2C[C@]1(C)C(=O)NC1CCCCCC1)ccs3 CCOc1ccc(cc1)N1C(=O)c2cc3c(n2C[C@]1(C)C(=O)NC1CCCCCC1)ccs3 CCOc1ccc(cc1)N2C(=O)c3cc4sccc4n3C[C@]2(C)C(=O)NC5CCCCCC5 InChIKey=QFVMLBHUYUDNFY-AREMUKBSSA-N InChI=1S/C26H31N3O3S/c1-3-32-20-12-10-19(11-13-20)29-24(30)22-16-23-21(14-15-33-23)28(22)17-26(29,2)25(31)27-18-8-6-4-5-7-9-18/h10-16,18H,3-9,17H2,1-2H3,(H,27,31)/t26-/m1/s1 InChI=1/C26H31N3O3S/c1-3-32-20-12-10-19(11-13-20)29-24(30)22-16-23-21(14-15-33-23)28(22)17-26(29,2)25(31)27-18-8-6-4-5-7-9-18/h10-16,18H,3-9,17H2,1-2H3,(H,27,31)/t26-/m1/s1/f/h27H CCOc1ccc(cc1)N2C(=O)c3cc4c(n3C[C@]2(C)C(=O)NC5CCCCCC5)ccs4 C01[X(C26H31N3O3S1)] 186 C01 561 CCOc1ccc(cc1)N1C(=O)c2cc3c(n2C[C@]1(C)C(=O)NC1CCCCCC1)ccs3 CCO[C]1[CH][CH][C]([CH][CH]1)N1C(=O)C2=[CH][C]3[C]([CH]=CS3)N2C[C@]1(C)C(=O)NC1CCCCCC1 CCO[C]1[CH][CH][C]([CH][CH]1)N2C(=O)C3=C[C]4SC=C[C]4N3C[C@]2(C)C(=O)NC5CCCCCC5 InChIKey=QFVMLBHUYUDNFY-AREMUKBSSA-N InChI=1S/C26H31N3O3S/c1-3-32-20-12-10-19(11-13-20)29-24(30)22-16-23-21(14-15-33-23)28(22)17-26(29,2)25(31)27-18-8-6-4-5-7-9-18/h10-16,18H,3-9,17H2,1-2H3,(H,27,31)/t26-/m1/s1 InChI=1/C26H31N3O3S/c1-3-32-20-12-10-19(11-13-20)29-24(30)22-16-23-21(14-15-33-23)28(22)17-26(29,2)25(31)27-18-8-6-4-5-7-9-18/h10-16,18H,3-9,17H2,1-2H3,(H,27,31)/t26-/m1/s1/f/h27H 3604.8563880596 -1788.0745523 1-A 19460.7321 124 437 561 |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| -91.96973 -20.58974 -20.53358 -20.52706 -15.62574 -15.60220 -15.58709 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1944.69 2003.58 2004.35 2035.68 2048.44 2053.84 2060.97 2070.51 2084.25 2094.81 2105.88 2132.30 2139.11 2149.44 2169.69 2188.75 2204.32 2209.86 2222.43 2223.91 2229.37 2252.37 2253.30 2267.12 2271.60 2284.20 2294.86 2343.82 2350.75 2352.75 2353.02 2359.52 2366.35 2366.75 2368.61 2380.26 2391.57 2392.52 2396.01 2413.28 2428.09 2442.81 2449.46 2511.01 2554.19 2620.20 2792.81 2803.41 4556.12 4584.40 4588.60 4598.13 4600.59 4608.17 4612.52 4626.51 4629.16 4646.82 4651.29 4660.36 4665.42 4665.82 4666.73 4672.74 4690.00 4704.95 4723.81 4743.99 4751.98 4771.22 4812.51 4853.42 4881.61 4899.82 4904.37 4923.31 4949.50 4982.30 5612.14 0.576740 0.605409 0.606353 0.513865 -1787.497813 -1787.469143 -1787.468199 -1787.560687 3.102063D-04 MUNgauss RevisionA2.0 retrievium 18-Dec-2020 DUDE CCOc1ccc(cc1)N2C(=O)c3cc4c(n3C[C@]2(C)C(=O)NC5CCCCCC5)ccs4 C21809663 RHF 6-31G(d) (6D,10F) C1 465.208614 |X|Y|Z| 109.788753 79.229204 33.614031 66.372460 27 6 7 16 23 3 1 |36.858105| |12.574519|36.858105| 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|1.567448|1.769311|3.410999|2.211247|2.379016|2.846967|3.214769|2.838107|2.371826|5.660136|5.208897|7.918291|8.622016|13.470282|36.858105| |1.594204|1.806127|3.497003|2.282627|2.468457|2.995785|3.426227|2.978428|2.455662|6.279790|5.287301|7.475711|8.638166|8.426975|13.856468|36.858105| |1.791603|2.063430|4.048305|2.712059|2.966224|3.755551|4.503160|3.743252|2.955302|9.284926|7.703621|9.524854|13.885575|8.484379|8.606255|14.049959|53.358707| |1.887990|2.191757|4.316413|2.922077|3.188223|4.074234|5.023788|4.142315|3.213320|10.548317|6.633178|8.346141|7.794827|5.293004|5.261235|7.514514|18.032027|36.858105| |2.173776|2.564737|5.230401|3.682722|4.220715|5.909859|7.497562|5.327881|3.978907|17.476998|7.640131|9.424328|6.773542|4.598508|4.174129|5.117682|10.658173|12.339030|36.858105| |2.068017|2.377744|4.929653|3.369461|4.087958|5.656292|5.781458|4.156710|3.389484|10.321720|5.905747|8.029386|5.653285|4.242517|3.958175|4.722268|8.664940|7.569577|12.404760|36.858105| |2.262966|2.676254|5.410417|3.764287|4.153802|5.328315|6.445197|5.218593|4.084835|10.343550|5.031460|7.100087|4.478605|3.401674|3.203893|3.842628|6.932018|7.752532|12.303326|7.585538|36.858105| |2.178351|2.517187|5.107898|3.431776|3.856161|4.700983|5.016934|4.171356|3.533494|7.385693|3.980890|5.872212|3.675501|2.933702|2.830098|3.364825|5.698178|5.827775|7.977228|7.071309|15.861337|73.516695| |2.332142|2.801018|5.476474|3.792232|3.872207|4.646544|5.995076|5.696922|4.404867|8.924507|4.629124|6.807297|4.071517|3.170564|2.973826|3.487260|6.085707|6.386976|7.728708|5.080472|14.163658|15.126051|53.358707| |2.320869|2.746755|5.221811|3.449080|3.393827|3.756490|4.423112|4.532034|3.921836|6.019701|3.438215|5.354241|3.106743|2.557189|2.443346|2.804679|4.584760|4.413874|4.946139|3.832502|7.738253|12.114693|17.723382|36.858105| |2.522481|3.041532|5.536771|3.602396|3.311636|3.494354|4.162009|4.769332|4.325873|5.362326|3.204792|5.206534|2.839163|2.388145|2.246979|2.498114|4.010579|3.610301|3.958389|3.135546|5.220773|8.098564|10.720166|12.443607|36.858105| |2.399065|2.794191|4.924873|3.032569|2.770950|2.817293|3.171172|3.569395|3.472697|4.079768|2.548795|4.233240|2.314080|2.007350|1.914588|2.103653|3.266836|2.841895|3.037186|2.553208|3.817834|6.390550|6.757722|7.314362|12.421472|36.858105| |2.013963|2.287814|4.038237|2.465179|2.309175|2.384518|2.671801|2.913005|2.776391|3.585869|2.300181|3.801293|2.158427|1.899969|1.848589|2.042006|3.102242|2.682442|2.732219|2.323334|3.346926|5.679312|5.734212|5.834460|7.396371|12.410533|36.858105| |1.835164|2.051540|3.692338|2.249078|2.168586|2.261515|2.484876|2.600700|2.458975|3.397711|2.175309|3.551866|2.080447|1.835763|1.815234|2.030866|3.055329|2.669864|2.692375|2.341199|3.349151|5.947126|5.463881|5.586212|5.605428|7.314986|12.392257|36.858105| |1.880050|2.113325|3.904978|2.418763|2.391986|2.543741|2.785387|2.820059|2.612442|3.858236|2.406407|3.850941|2.305353|2.000941|1.985781|2.264394|3.455365|3.126708|3.195187|2.774924|4.216847|7.809165|6.766285|7.419434|5.891930|6.300973|7.289499|12.399774|36.858105| |1.962638|2.253146|4.226975|2.704424|2.702068|2.979547|3.397478|3.392170|2.991959|4.876727|2.951567|4.595249|2.824354|2.383850|2.358238|2.750748|4.325695|4.143180|4.179287|3.405006|5.919328|10.231514|10.529482|12.403344|7.347486|6.086589|6.252325|7.301581|12.411086|36.858105| |1.441562|1.612855|3.095530|1.984184|2.129427|2.513974|2.799023|2.492652|2.113896|4.829028|3.810536|5.681994|5.240944|5.316726|8.062723|13.274704|9.976410|5.691595|4.058776|3.901491|3.335999|5.424105|4.167296|2.570211|2.278329|1.964460|1.948294|1.974368|2.199877|2.625383|36.858105| |1.339277|1.485823|2.832415|1.793738|1.913262|2.217795|2.430716|2.200012|1.900056|4.046968|3.276404|5.114046|4.370243|4.914850|7.723265|8.358572|7.154580|4.143591|3.234070|3.176496|2.720955|4.482306|3.459724|2.187550|1.985775|1.741483|1.732316|1.746931|1.912282|2.225823|14.169971|36.858105| |1.373361|1.525434|2.906586|1.841679|1.961678|2.270373|2.486775|2.257655|1.952173|4.110303|3.538696|5.721865|4.828574|6.411462|10.968836|7.413316|6.852658|3.741120|3.084967|3.027636|2.540178|4.129687|3.256034|2.048206|1.901313|1.663811|1.632598|1.617518|1.749495|2.025262|7.312127|10.919676|388.023441| |17.577845|8.863825|12.952812|4.876584|4.002596|3.130847|2.859690|3.137901|4.018881|3.203553|2.145790|3.956421|1.846111|1.674035|1.521390|1.558888|2.382415|1.860586|2.150982|2.067005|2.273246|3.955650|3.165140|2.347477|2.520628|2.427863|2.033245|1.872349|1.928308|1.989862|1.418190|1.314126|9.506715|0.500000| |17.579360|8.865372|12.948299|4.886669|4.023173|3.144551|2.864115|3.140124|4.019789|3.209940|2.212584|4.194891|1.890868|1.734534|1.557324|1.571196|2.392567|1.829521|2.103014|2.029118|2.147208|3.678281|2.967087|2.135568|2.280466|2.150343|1.834859|1.688581|1.739325|1.824931|1.418512|1.324640|9.727525|0.300957|0.500000| |17.553814|8.875637|10.250118|4.238035|3.386690|2.772882|2.646792|3.003381|3.843064|3.013214|2.064694|3.869835|1.782191|1.633531|1.479788|1.501899|2.279915|1.760612|1.993240|1.884277|2.078298|3.550536|2.950182|2.180156|2.404775|2.331943|1.974020|1.785686|1.802312|1.865675|1.365483|1.273842|9.287460|0.300397|0.300417|0.500000| |8.848450|17.540985|16.530712|7.073577|4.769962|3.798175|3.742485|4.600798|6.780424|4.023980|2.637779|4.873242|2.204531|1.958112|1.757874|1.812417|2.824168|2.239058|2.607339|2.374193|2.799938|4.676028|4.096078|3.036276|3.481452|3.242742|2.581320|2.274401|2.319931|2.455575|1.626239|1.490674|10.782049|0.212138|0.173417|0.212618|0.500000| |8.846211|17.546594|16.533877|7.109085|4.807431|3.824266|3.753623|4.609079|6.787266|4.037642|2.765545|5.342567|2.282370|2.057266|1.814235|1.832106|2.841593|2.185875|2.523754|2.317818|2.574418|4.236550|3.692281|2.614939|2.918623|2.656341|2.207435|1.965793|2.010512|2.164107|1.626932|1.506252|11.108806|0.173386|0.212182|0.212486|0.300931|0.500000| |4.115097|4.864719|13.487590|8.961637|17.741994|8.909653|5.628841|4.981502|5.665695|5.618243|3.570276|6.484283|2.873444|2.489762|2.188371|2.259341|3.614168|2.819883|3.628423|3.718277|3.581382|6.175195|4.478673|2.969426|2.872554|2.484224|2.101461|2.000794|2.204120|2.437169|1.977735|1.793086|13.061610|0.115160|0.116131|0.093202|0.119798|0.120953|0.500000| |2.814014|3.332993|7.633942|5.658986|9.004418|17.772996|8.895389|5.675913|4.963283|9.540647|5.581111|9.196949|4.264598|3.450568|2.963333|3.127224|5.302998|4.144949|6.061051|6.815127|5.135272|8.456704|5.718995|3.414661|3.079677|2.536254|2.198490|2.128810|2.418308|2.816901|2.625870|2.313512|16.803013|0.077470|0.077977|0.068381|0.088271|0.089055|0.216241|0.500000| |2.980740|3.903753|7.460790|5.660247|4.980374|5.678731|8.961958|17.723446|8.957530|9.846245|6.008423|10.591330|4.348785|3.484864|2.950620|3.098799|5.284058|4.290211|5.080636|3.812154|4.979977|6.934511|8.035816|4.668449|5.164779|3.768256|3.116592|2.720500|2.897105|3.542901|2.587822|2.281397|16.644811|0.077599|0.077682|0.076694|0.113545|0.113822|0.108028|0.124535|0.500000| |4.666106|7.393820|12.458840|8.860773|5.637285|4.962304|5.643563|8.961907|17.766543|5.685045|3.685786|6.951568|2.905968|2.509471|2.187954|2.252137|3.613666|2.865962|3.380142|2.889959|3.519846|5.486550|5.349686|3.673092|4.312444|3.585674|2.847972|2.460057|2.540310|2.855299|1.963674|1.780523|13.012174|0.114752|0.114666|0.117800|0.225879|0.225230|0.124177|0.107779|0.217876|0.500000| |1.747437|1.989651|3.846936|2.512334|2.690780|3.207404|3.624960|3.231558|2.704135|6.086752|6.520035|11.793172|8.785788|17.818616|8.471711|5.766999|7.923819|4.173506|3.871243|3.643821|2.984549|4.636751|3.844262|2.327524|2.218896|1.885986|1.777853|1.705472|1.837870|2.155014|4.174488|4.078190|39.278713|0.046389|0.048776|0.045663|0.053932|0.057800|0.068172|0.091134|0.092540|0.068976|0.500000| |1.894260|2.212704|4.278165|2.885799|3.034553|3.753019|4.785673|4.257223|3.277027|9.384244|5.963422|7.908792|6.580250|4.759931|4.707543|6.299304|12.497633|17.583467|8.754360|5.507191|7.272633|9.455458|9.903717|4.941154|4.101576|3.153439|3.010449|2.946786|3.407222|4.690690|5.085832|3.840113|24.774734|0.051660|0.050584|0.049451|0.063579|0.061614|0.073937|0.101651|0.129456|0.082869|0.107563|0.500000| |1.757764|2.009941|3.944729|2.614027|2.861414|3.549397|4.105410|3.459849|2.807568|7.648265|4.914630|6.677297|5.757199|4.420032|4.727666|6.944044|12.525351|17.621778|8.842321|7.154383|7.025125|10.697863|7.632266|4.200443|3.340655|2.712770|2.615507|2.687944|3.214830|4.215916|6.134506|4.292452|25.721163|0.048537|0.047324|0.045647|0.057159|0.055215|0.071951|0.102562|0.097996|0.070324|0.099213|0.301825|0.500000| |1.992224|2.276012|4.700231|3.183074|3.859370|5.277067|5.319978|3.878737|3.190376|9.611045|6.498771|8.859173|6.590250|5.013348|4.557280|5.222551|9.390459|6.707283|8.805984|17.594518|5.506787|8.985218|5.650932|3.227081|2.758537|2.282603|2.094483|2.092332|2.419540|2.909622|4.134164|3.428727|24.076866|0.054846|0.054935|0.050525|0.062285|0.062430|0.098781|0.181522|0.099622|0.076075|0.118714|0.137423|0.170701|0.500000| |2.235127|2.565783|5.458538|3.744465|4.793769|6.731276|6.020699|4.260915|3.600696|9.047885|5.081080|7.416458|4.530357|3.570533|3.286665|3.740499|6.466820|5.510140|8.775589|17.661675|7.055831|12.896931|6.554648|3.796589|3.129646|2.573841|2.300204|2.315555|2.746273|3.283099|3.197404|2.698728|18.565933|0.062639|0.060976|0.055899|0.070751|0.068398|0.123365|0.247875|0.104018|0.083850|0.088802|0.123413|0.146327|0.300129|0.500000| |1.886876|2.136363|4.353695|2.889965|3.401180|4.364403|4.447545|3.457647|2.907420|7.545850|4.615600|6.524974|4.774213|3.796382|3.774114|4.670268|7.930598|7.128843|8.799370|17.615822|6.833789|12.805871|6.363152|3.694807|2.961169|2.462564|2.288614|2.361756|2.842480|3.462474|4.122656|3.297318|21.346567|0.052755|0.051315|0.048131|0.059695|0.057644|0.088114|0.140413|0.090399|0.070582|0.090284|0.145272|0.223935|0.300679|0.304944|0.500000| |2.381081|2.904331|5.608957|3.944386|3.911955|4.716549|6.639715|6.788237|4.860867|10.163516|5.316310|7.803776|4.511627|3.459884|3.165614|3.648737|6.470263|6.479238|7.412772|4.720363|9.462588|10.919146|26.103401|8.970410|7.629337|4.744550|4.035230|3.662271|4.220398|6.096678|3.118323|2.607285|17.805851|0.064892|0.061928|0.061743|0.086443|0.079792|0.090623|0.115194|0.216987|0.121431|0.085817|0.221349|0.146448|0.112639|0.122077|0.117092|0.500000| |2.438369|2.862493|5.537353|3.619225|3.619029|3.916412|4.341939|4.329705|3.923748|5.639192|3.210065|5.058682|2.876878|2.388658|2.277613|2.590962|4.201639|3.951799|4.668829|3.860552|7.400205|13.508855|12.620256|17.591694|8.902064|6.569392|5.073820|5.117016|7.029598|8.945090|2.385663|2.047572|13.684252|0.069704|0.062069|0.062992|0.088052|0.073986|0.089162|0.099513|0.116848|0.100472|0.060872|0.115828|0.106661|0.089159|0.111062|0.103799|0.185353|0.500000| |2.936536|3.676983|6.702341|4.461792|3.920221|4.027652|4.827959|5.945218|5.603302|5.763883|3.395486|5.623943|2.895672|2.426123|2.236603|2.448509|3.968801|3.497199|4.026795|3.211096|5.149052|7.910225|9.883324|8.958401|17.542567|8.868489|5.465875|4.356201|4.594731|5.454629|2.198571|1.929536|13.359777|0.081042|0.072741|0.076915|0.119919|0.097009|0.092129|0.095036|0.173102|0.155950|0.063299|0.107265|0.088199|0.078911|0.090978|0.082114|0.206029|0.220332|0.500000| |2.364243|2.847736|5.122647|3.341335|3.069073|3.290950|4.044450|4.719629|4.122970|5.427096|3.341524|5.433415|2.992459|2.523711|2.373786|2.632861|4.214130|3.751393|3.910769|3.033058|4.827150|7.217795|9.948908|8.864605|17.469132|8.905502|6.959375|5.106108|5.084258|6.559997|2.390706|2.084893|14.238634|0.064603|0.059972|0.063184|0.089105|0.077997|0.073813|0.080938|0.153295|0.116361|0.065019|0.123631|0.094652|0.075471|0.081995|0.079413|0.226992|0.174604|0.303276|0.500000| |2.468691|2.832294|5.032957|3.045600|2.807271|2.806353|3.054582|3.358485|3.354878|3.869217|2.404836|4.000959|2.181632|1.897700|1.812991|1.990461|3.082381|2.675394|2.918838|2.522583|3.712492|6.493493|6.214536|6.730216|8.792370|17.511458|8.771729|6.950390|6.444003|5.641636|1.867011|1.658714|11.255085|0.070765|0.061133|0.066285|0.091661|0.073145|0.070910|0.070649|0.094734|0.094811|0.049631|0.080338|0.071881|0.062286|0.071922|0.067963|0.116572|0.195337|0.208946|0.173646|0.500000| |2.540259|2.969303|5.061764|3.060409|2.715174|2.702578|3.032370|3.526551|3.553587|3.831296|2.441728|4.138988|2.199658|1.928384|1.824373|1.973922|3.046512|2.584505|2.761098|2.341672|3.323022|5.510112|5.712943|5.461529|8.975659|17.536882|8.891419|5.480213|4.657776|4.582017|1.835415|1.645098|11.319011|0.070738|0.062575|0.069636|0.097684|0.078966|0.067631|0.066995|0.104349|0.106235|0.050884|0.079304|0.067819|0.059070|0.065749|0.062153|0.116839|0.139985|0.224639|0.213690|0.304895|0.500000| |1.951423|2.185793|3.794544|2.272024|2.111973|2.148734|2.374073|2.601063|2.535375|3.160213|2.063809|3.458568|1.941309|1.732783|1.686182|1.840225|2.761590|2.334913|2.375398|2.058340|2.823871|4.833641|4.661799|4.426093|5.518094|8.853761|17.536068|8.912215|5.462747|4.632920|1.763866|1.587750|10.708413|0.054737|0.049292|0.053763|0.068627|0.058705|0.053891|0.055173|0.076938|0.073345|0.045430|0.071911|0.063300|0.052156|0.056860|0.056302|0.092738|0.112287|0.125360|0.148212|0.200589|0.228633|0.500000| |1.940585|2.219035|3.919358|2.419708|2.270318|2.378509|2.720394|2.979797|2.773227|3.730111|2.419151|3.984167|2.290225|2.016878|1.967572|2.177706|3.301767|2.850920|2.824247|2.358511|3.388040|5.581084|5.927001|5.653724|7.183086|8.899080|17.517548|8.816211|6.205025|6.195067|2.075961|1.842197|12.331005|0.053810|0.049468|0.052880|0.068847|0.060382|0.057004|0.060914|0.091059|0.079163|0.052243|0.091191|0.076540|0.059452|0.063840|0.064385|0.120192|0.128481|0.146098|0.223287|0.174228|0.204569|0.305679|0.500000| |1.804144|1.988126|3.558857|2.131431|2.052902|2.108205|2.270241|2.371543|2.290835|3.061592|1.973930|3.254310|1.884006|1.676959|1.656591|1.836752|2.743490|2.359563|2.409622|2.145529|2.952714|5.356301|4.643042|4.566279|4.631055|6.248739|8.846154|17.523763|8.916301|5.458904|1.791250|1.599907|10.583815|0.051556|0.046016|0.048955|0.061299|0.052547|0.053222|0.055339|0.067916|0.063904|0.043569|0.070935|0.066198|0.053544|0.059645|0.060205|0.086788|0.124439|0.106503|0.115258|0.185028|0.139118|0.227817|0.175793|0.500000| |1.676496|1.863362|3.348824|2.037689|1.976198|2.075088|2.285413|2.375708|2.228116|3.182909|2.073884|3.385305|2.018280|1.798848|1.799138|2.015330|2.985832|2.582625|2.528498|2.208363|3.053460|5.383516|4.893264|4.632243|4.588031|5.469385|8.906542|17.522921|8.845096|6.269675|1.986600|1.764223|11.523393|0.047255|0.043179|0.045478|0.056770|0.050073|0.050819|0.054706|0.069659|0.061976|0.046350|0.079690|0.072873|0.055350|0.059928|0.062375|0.092939|0.115716|0.101898|0.124505|0.139943|0.124066|0.207158|0.226816|0.305062|0.500000| |1.998087|2.237010|4.160171|2.557449|2.535081|2.655837|2.842089|2.866038|2.710064|3.831404|2.365362|3.809205|2.232297|1.935406|1.903507|2.153192|3.304218|2.967770|3.157588|2.802653|4.229206|8.176812|6.539603|7.235214|5.734960|6.278936|6.235814|8.819613|17.522147|8.897434|2.075281|1.812890|11.904151|0.057601|0.051086|0.052917|0.068549|0.058266|0.065341|0.070058|0.079829|0.072765|0.049663|0.087512|0.084352|0.067444|0.078981|0.079344|0.111664|0.226826|0.131392|0.129212|0.204222|0.129796|0.137969|0.141439|0.226272|0.175521|0.500000| |1.713153|1.901964|3.525554|2.169092|2.174975|2.322170|2.509619|2.494490|2.310459|3.532460|2.238983|3.578201|2.187910|1.919545|1.933359|2.215096|3.319857|2.975473|2.970993|2.651272|3.794204|7.222200|5.725056|5.538681|4.456695|4.658273|5.456313|8.921471|17.543556|8.867181|2.196170|1.912073|12.273541|0.048863|0.044394|0.045665|0.057280|0.050424|0.056324|0.062379|0.070870|0.062174|0.048865|0.088728|0.087370|0.064559|0.072396|0.077130|0.100520|0.149798|0.101973|0.112307|0.132815|0.102909|0.124171|0.137064|0.208625|0.226969|0.306233|0.500000| |1.863294|2.139752|3.965629|2.533902|2.507213|2.773053|3.224684|3.272477|2.853423|4.744262|2.957337|4.610411|2.883369|2.452732|2.446575|2.859038|4.439603|4.196549|3.966364|3.178728|5.153338|8.384110|9.338990|8.799577|6.775666|5.654455|6.400263|6.942579|8.746300|17.497882|2.745858|2.327629|14.992742|0.051944|0.048305|0.049576|0.064537|0.057929|0.062654|0.072726|0.098224|0.076709|0.061409|0.139284|0.117149|0.077260|0.083257|0.089357|0.168175|0.174324|0.139086|0.195786|0.135612|0.123633|0.131939|0.201186|0.139816|0.185773|0.174129|0.199222|0.500000| |1.871814|2.132561|4.063557|2.607866|2.682112|3.017070|3.387913|3.234064|2.824367|5.019445|3.027038|4.631143|2.960802|2.486071|2.496617|2.978014|4.682971|4.629937|4.592996|3.820152|6.642507|12.377639|10.094921|8.989977|5.478598|4.586077|4.636415|5.482494|8.897244|17.581709|2.878829|2.398779|15.225403|0.052842|0.048815|0.049137|0.063556|0.056886|0.067795|0.081245|0.092074|0.073545|0.061710|0.140327|0.138542|0.088824|0.100779|0.112032|0.157041|0.214639|0.124881|0.139799|0.123563|0.102053|0.102578|0.128510|0.124161|0.139676|0.204312|0.229426|0.303476|0.500000| |1.418569|1.583148|3.034870|1.938121|2.076735|2.436705|2.698160|2.413413|2.059500|4.587247|3.443255|5.137788|4.429958|4.239651|5.634866|8.506465|8.473738|5.674313|4.019986|3.869329|3.456868|5.736946|4.303007|2.691024|2.341185|2.029561|2.035459|2.097916|2.365940|2.829677|17.757658|8.910556|37.227852|0.038983|0.038604|0.037353|0.044616|0.044057|0.053725|0.070598|0.069436|0.053250|0.095913|0.142818|0.188577|0.108969|0.088576|0.118524|0.087396|0.069345|0.061926|0.067838|0.053729|0.052149|0.050952|0.060149|0.052712|0.058990|0.061529|0.066506|0.082262|0.087993|0.500000| |1.247899|1.374324|2.606449|1.634365|1.735181|1.982997|2.148432|1.966195|1.722399|3.488484|2.768880|4.402343|3.509426|3.870058|5.429882|5.742653|5.586033|3.460286|2.787897|2.765846|2.422946|4.059862|3.104467|2.005753|1.828129|1.626181|1.632196|1.657420|1.804253|2.067217|8.817789|17.783354|55.253996|0.034096|0.034286|0.033079|0.038350|0.038625|0.045497|0.057367|0.056515|0.045126|0.093341|0.090740|0.101471|0.081675|0.066616|0.080695|0.064454|0.052406|0.049159|0.053145|0.043164|0.042714|0.041795|0.048099|0.042378|0.046789|0.047473|0.050553|0.060059|0.061826|0.205015|0.500000| 1786.413151 -11404.173995 4440.992086 -216.162511 -5392.931269 3604.856647 -1788.074621 2.000930 40DE780000000009 44C69AA1977AAA83 4447554BF7344CEA 4272EF6C3CDF0005 37D5C72F9A248A01 445973FDDD7719AF