Version2.4 2021-05-26T17:59:44Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 01-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1cc(cc(c1)C(=O)NC(=S)Nc2ccc(cc2)S(=O)(=O)[N-]c3nc(cc(n3)C)C)C C30828813 RHF 6-31G(d) (6D,7F) Cc1cc(cc(c1)C(=O)NC(=S)Nc2ccc(cc2)S(=O)(=O)[N-]c3nc(cc(n3)C)C)C C01[X(C22H22N5O3S2)] 156 C1 532 S=C(NC(=O)c1cc(C)cc(c1)C)Nc1ccc(cc1)S(=O)(=O)[N-]c1nc(C)cc(n1)C S=C(NC(=O)c1cc(C)cc(c1)C)Nc1ccc(cc1)S(=O)(=O)[N-]c1nc(C)cc(n1)C Cc1cc(C)cc(c1)C(=O)NC(=S)Nc2ccc(cc2)[S](=O)(=O)[N-]c3nc(C)cc(C)n3 InChIKey=YYLAMQAPOSWPLT-UHFFFAOYSA-M InChI=1S/C22H23N5O3S2/c1-13-9-14(2)11-17(10-13)20(28)26-22(31)25-18-5-7-19(8-6-18)32(29,30)27-21-23-15(3)12-16(4)24-21/h5-12H,1-4H3,(H3,23,24,25,26,27,28,31)/p-1 InChI=1/C22H23N5O3S2/c1-13-9-14(2)11-17(10-13)20(28)26-22(31)25-18-5-7-19(8-6-18)32(29,30)27-21-23-15(3)12-16(4)24-21/h5-12H,1-4H3,(H3,23,24,25,26,27,28,31)/p-1/fC22H22N5O3S2/h25-26H/q-1 Cc1cc(cc(c1)C(=O)NC(=S)Nc2ccc(cc2)S(=O)(=O)[N-]c3nc(cc(n3)C)C)C C01[X(C22H22N5O3S2)] 156 C01 532 S=C(NC(=O)c1cc(C)cc(c1)C)Nc1ccc(cc1)S(=O)(=O)[N-]c1nc(C)cc(n1)C S[C]([NH][C]1[CH][CH][C]([CH][CH]1)[S]([N][C]1[N][C]([CH][C]([N]1)C)C)([O])[O])NC(=O)[C]1[CH][C]([CH][C]([CH]1)C)C C[C]1[CH][C](C)[CH][C]([CH]1)C(=O)N[C](S)N[C]2[CH][CH][C]([CH][CH]2)[S]([O])([O])[N][C]3[N][C](C)[CH][C](C)[N]3 InChIKey=AOIODHMQZZNQQN-UHFFFAOYSA-N InChI=1S/C22H23N5O3S2/c1-13-9-14(2)11-17(10-13)20(28)26-22(31)25-18-5-7-19(8-6-18)32(29,30)27-21-23-15(3)12-16(4)24-21/h5-12H,1-4H3,(H3,25,26,28,31) InChI=1/C22H23N5O3S2/c1-13-9-14(2)11-17(10-13)20(28)26-22(31)25-18-5-7-19(8-6-18)32(29,30)27-21-23-15(3)12-16(4)24-21/h5-12H,1-4H3,(H3,25,26,28,31)/f/h25-26,31H 3210.6037117754 -2137.7918619 1-A 32777.2392 123 409 532 |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| -92.03149 -91.80791 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0.8394 0.8560 0.8562 0.8569 0.8565 0.7314 0.8192 0.4400 0.8556 0.8563 0.8526 0.8569 0.8539 0.8557 0.5986 0.8345 0.7820 0.8546 0.8410 0.3991 0.7004 0.8485 0.4634 0.7938 0.6059 0.7772 0.5894 0.6340 0.7054 0.3856 0.4476 0.6629 0.8569 0.8554 0.8571 0.4913 0.8527 0.2754 0.1890 0.8257 0.8571 0.7184 0.6139 0.3502 0.8541 0.8477 0.6669 0.4976 0.3526 0.7180 0.6042 0.2948 0.8393 0.8565 0.8469 0.1515 0.8570 0.5454 0.6648 0.8544 0.8073 0.3771 0.4939 0.5200 0.6716 0.7750 0.6519 0.4361 0.2142 0.5616 0.2493 0.8076 0.3361 0.5206 0.6250 0.6787 0.8571 0.8571 0.6773 0.7138 0.8234 0.8554 0.6159 0.3348 0.1331 0.4100 0.7774 0.3644 0.3384 0.8258 0.7995 0.7893 0.4237 0.3481 0.3255 0.6339 0.7356 0.7466 0.8569 0.2856 0.8571 0.7839 0.6666 0.8437 0.4607 0.8560 0.8334 0.4843 0.4876 0.8571 0.8571 0.8562 0.8469 0.8571 0.8391 0.8151 0.8481 0.4129 0.7257 0.6076 0.3620 0.4184 0.7327 0.7430 0.8016 0.6067 0.2740 0.2868 0.0198 0.0153 0.0126 0.8568 0.8468 0.8342 0.8571 0.8195 0.8571 0.8566 0.8561 0.4729 0.5547 0.4040 0.4671 0.6280 0.4068 0.3950 0.2684 0.3168 0.3219 298.150 1.00000 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 6 6 6 6 6 6 6 6 8 7 6 16 7 6 6 6 6 6 6 16 8 8 7 6 7 6 6 6 7 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 14.00307 12.00000 31.97207 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 31.97207 15.99491 15.99491 14.00307 12.00000 14.00307 12.00000 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 5468.0801 54792.2416 58919.1226 1.00000 0.00097 -0.00078 -0.00098 0.99995 -0.01013 0.00077 0.01013 0.99995 1 0.01584 0.00158 0.00147 0.33005 0.03294 0.03063 5.22 19.28 20.27 28.25 35.36 42.93 47.34 50.51 71.13 80.92 90.51 106.07 112.00 130.00 150.92 180.15 196.52 251.82 269.33 282.49 305.86 313.34 326.91 349.35 364.66 365.66 397.53 414.41 445.34 462.77 530.39 558.25 569.27 619.68 658.37 667.65 709.41 711.75 767.77 794.08 796.49 816.94 823.74 834.50 843.28 860.02 875.69 898.65 914.41 954.57 978.47 1000.63 1052.26 1058.48 1059.34 1085.72 1120.02 1143.84 1163.35 1182.97 1219.90 1239.05 1259.43 1313.36 1344.55 1354.56 1369.54 1419.09 1439.29 1471.42 1478.64 1487.22 1505.37 1520.17 1532.15 1558.59 1567.07 1575.82 1591.35 1597.11 1603.15 1611.15 1613.46 1671.76 1682.58 1690.17 1693.60 1708.15 1712.38 1757.91 1785.39 1798.08 1823.97 1830.88 1853.57 1861.14 1861.76 1866.08 1888.38 1918.61 1971.26 1974.88 2069.05 2078.47 2097.59 2126.75 2188.59 2228.74 2237.05 2244.78 2254.13 2259.59 2294.02 2296.92 2304.58 2319.37 2335.19 2337.88 2347.89 2348.96 2349.67 2354.74 2366.67 2381.17 2415.08 2485.85 2518.42 2522.17 2571.58 2576.29 2600.28 2601.42 2605.27 2805.77 4610.47 4611.52 4613.97 4616.20 4685.84 4692.08 4708.21 4708.42 4711.49 4718.96 4721.03 4726.76 4812.62 4840.99 4848.07 4858.88 4879.13 4885.47 4916.78 4919.91 5463.69 5607.73 0.445999 0.475714 0.476658 0.375274 -2137.345862 -2137.316148 -2137.315204 -2137.416588 3.400436D-04 MUNgauss RevisionA2.1 retrievium 26-May-2021 DUDE Cc1cc(cc(c1)C(=O)NC(=S)Nc2ccc(cc2)S(=O)(=O)[N-]c3nc(cc(n3)C)C)C C30828813 RHF 6-31G(d) (6D,10F) C1 468.116408 |X|Y|Z| 171.528822 23.228445 53.057996 59.571156 24 6 7 16 18 5 1 |36.858105| |12.604131|36.858105| |7.561238|13.680254|36.858105| |5.002886|7.839104|13.749321|36.858105| |4.433135|6.837558|7.989033|13.702358|36.858105| |5.007334|7.902330|6.915684|7.905065|13.766282|36.858105| |7.549199|13.764611|7.984446|6.833539|7.923169|13.675640|36.858105| |3.762115|5.007411|4.478995|5.070166|7.737389|12.701558|7.498228|36.858105| |3.134935|4.020101|3.844003|4.549381|6.777057|8.077123|5.317616|15.861718|73.516695| |3.624738|4.466726|3.791268|3.973111|5.256558|7.860520|6.567613|13.904057|14.939714|53.358707| |2.926311|3.389316|2.968408|3.098470|3.875845|5.034264|4.483004|7.592778|11.523240|18.602872|36.858105| |2.756135|3.009263|2.599254|2.609528|3.069795|3.838023|3.775813|4.816082|7.396131|9.917758|11.354658|388.023441| |2.544971|2.950393|2.687859|2.885602|3.621495|4.388859|3.745583|6.649452|12.415361|11.271862|14.472019|50.359874|53.358707| |2.152065|2.420064|2.236017|2.378342|2.863456|3.301054|2.933223|4.442519|8.454227|7.040653|7.723069|42.135178|18.080767|36.858105| |1.965418|2.183545|2.036047|2.158219|2.547064|2.868879|2.587090|3.670683|6.817052|5.803385|5.953539|38.518774|10.570668|13.772299|36.858105| |1.727265|1.890112|1.778115|1.875194|2.165446|2.386372|2.187100|2.924820|5.463210|4.455624|4.214970|29.084092|6.986037|7.969710|13.762172|36.858105| |1.647406|1.793377|1.690789|1.779615|2.041990|2.237447|2.061070|2.712963|5.136995|4.032136|3.702391|25.132644|6.185306|6.899311|7.936731|13.757221|36.858105| |1.753454|1.918261|1.800528|1.897244|2.194551|2.425576|2.224502|2.983984|5.736519|4.387190|4.033768|26.083109|7.024630|7.955012|6.865092|7.941190|13.765684|36.858105| |2.004876|2.227763|2.070023|2.191869|2.594546|2.938132|2.650460|3.790465|7.371227|5.657792|5.479588|32.291004|10.721457|13.763859|7.926709|6.882092|7.951457|13.762859|36.858105| |1.428566|1.535227|1.459853|1.528531|1.719010|1.850280|1.727343|2.164535|4.068253|3.155295|2.753309|19.266513|4.335426|4.186074|4.703654|6.907731|10.643926|6.918677|4.709792|388.023441| |1.397845|1.490546|1.412393|1.468452|1.640745|1.770260|1.670119|2.050268|3.833854|2.978043|2.567296|18.095699|3.978001|3.716862|3.860661|5.008580|7.391087|6.484698|4.432579|93.566715|73.516695| |1.382613|1.475877|1.400977|1.458370|1.628893|1.754173|1.652385|2.030128|3.749824|2.996470|2.608690|18.964381|3.968335|3.715111|4.433986|6.500760|7.387167|4.995561|3.856991|93.591229|13.774855|73.516695| |1.377631|1.491808|1.437009|1.521434|1.711393|1.810839|1.668942|2.110701|4.046307|2.997290|2.551972|17.216816|4.076767|3.797968|4.188655|5.654753|7.460100|5.717834|4.213257|85.504084|13.264370|13.256957|53.358707| |1.257821|1.354217|1.312144|1.386388|1.542064|1.615258|1.497763|1.848598|3.526666|2.600832|2.165780|14.743050|3.376303|3.000717|3.257869|4.110737|4.934942|4.143161|3.273104|53.210789|10.575080|10.574047|19.396709|36.858105| |1.222501|1.321340|1.291842|1.373974|1.524718|1.577518|1.453646|1.793989|3.453621|2.484146|2.033613|13.624261|3.170714|2.738778|2.928637|3.507140|3.994259|3.539188|2.945800|36.060970|7.643825|7.640881|11.415403|14.106576|53.358707| |1.128351|1.212836|1.189742|1.261252|1.386382|1.426246|1.322816|1.599845|3.058547|2.207803|1.784411|12.063654|2.733237|2.305696|2.446687|2.853633|3.169545|2.873713|2.458284|28.096553|6.330994|6.330057|7.480581|8.369273|19.803168|36.858105| |1.070979|1.142651|1.116913|1.175427|1.284520|1.326530|1.241940|1.478236|2.795613|2.054721|1.660615|11.415313|2.508922|2.110021|2.242147|2.621146|2.911938|2.634195|2.249707|26.724905|6.266772|6.267875|6.435270|7.072355|10.927319|13.696125|36.858105| |1.100357|1.170265|1.136038|1.189680|1.302600|1.357349|1.276890|1.519048|2.854626|2.135061|1.744518|12.146350|2.630520|2.245910|2.405654|2.881952|3.267712|2.892618|2.411575|32.442559|7.722153|7.726385|7.372434|8.351680|9.586199|8.107899|13.732617|36.858105| |1.187101|1.266689|1.223645|1.282467|1.414851|1.485473|1.393243|1.681926|3.166735|2.381929|1.975548|13.750694|3.013711|2.641135|2.860616|3.564361|4.204046|3.578822|2.867943|47.299572|10.645673|10.653318|11.084355|14.171050|10.944010|7.073889|8.053646|14.522784|53.358707| |1.039655|1.097347|1.062670|1.105328|1.202276|1.255123|1.191601|1.392676|2.591291|1.966224|1.599685|11.309965|2.374379|2.003470|2.136979|2.520565|2.813678|2.524884|2.139631|27.068190|6.811164|6.816823|5.482606|5.233989|6.157698|5.062145|7.531567|12.638144|10.845044|36.858105| |1.091271|1.175570|1.162519|1.238180|1.355217|1.378866|1.274514|1.534066|2.945981|2.091136|1.665407|11.153129|2.540510|2.093876|2.196156|2.475631|2.677176|2.493367|2.207385|22.067514|5.046348|5.045105|5.564947|5.231523|10.842778|12.621916|7.539696|5.066638|6.171602|3.769382|36.858105| |3.778536|4.990541|7.543702|12.605718|7.567292|5.021322|4.431430|3.828910|6.568850|4.242816|2.569874|15.663348|3.357254|2.096968|1.932660|1.707812|1.628459|1.723128|1.954584|10.095938|2.422151|2.410026|1.945731|1.314849|1.790157|1.215021|1.130508|1.136046|1.655350|1.055168|1.203927|36.858105| |17.584190|8.833893|5.571885|4.154943|3.961810|4.738743|7.243189|3.774756|5.518692|5.215645|3.124891|21.562594|3.619888|2.250723|2.051560|1.798783|1.714010|1.826038|2.093159|10.532509|2.584060|2.554939|1.925544|1.287584|1.692623|1.145825|1.090796|1.126313|1.658930|1.066643|1.102112|3.212062|0.500000| |17.542454|8.840986|6.667296|4.579005|3.984467|4.316846|5.924688|3.348894|5.128766|4.324428|2.631304|17.578016|3.186007|2.006729|1.827091|1.622595|1.564012|1.672933|1.900484|9.717721|2.393031|2.342117|1.798143|1.211203|1.605393|1.092042|1.037863|1.064768|1.558860|1.007714|1.058324|3.623524|0.301880|0.500000| |17.547914|8.840901|6.777838|4.602523|3.968306|4.275704|5.840135|3.309604|4.986889|4.388602|2.658378|18.122474|3.165218|1.991574|1.848376|1.633603|1.550353|1.632631|1.847399|9.632794|2.347969|2.346416|1.781818|1.200379|1.590956|1.082491|1.029053|1.055783|1.545420|0.999584|1.049170|3.657466|0.301842|0.302130|0.500000| |7.057554|8.933420|17.681830|8.947134|5.668280|4.971316|5.671372|3.573800|5.634742|4.265735|2.549897|16.284652|3.176401|1.985309|1.827517|1.616531|1.543292|1.635164|1.854659|9.589685|2.326491|2.308570|1.809536|1.222172|1.641167|1.116680|1.051592|1.067817|1.557998|1.002513|1.094294|7.011309|0.141160|0.188769|0.195319|0.500000| |3.546957|4.935533|5.659841|8.880146|17.738052|8.976327|5.651868|7.276970|13.484443|6.653011|3.791799|20.944880|5.067148|2.964462|2.640894|2.246875|2.118832|2.274996|2.686176|12.661344|3.000354|2.982211|2.444483|1.616823|2.192611|1.460427|1.343092|1.354686|2.002938|1.242234|1.435020|6.991268|0.090302|0.090737|0.090306|0.124255|0.500000| |7.029221|8.969612|5.671739|4.931960|5.633799|8.862706|17.716592|6.869444|8.688654|9.783009|4.968744|31.059344|5.374845|3.092076|2.709601|2.282120|2.150622|2.328603|2.789863|12.747702|3.096895|3.056738|2.325019|1.526902|1.999589|1.334692|1.258703|1.302644|1.941938|1.219710|1.276815|3.545001|0.223652|0.154758|0.150899|0.124709|0.124215|0.500000| |4.108197|4.970280|4.001370|3.987586|5.002119|7.556878|7.492443|9.362478|10.836611|26.085524|9.579564|52.638078|8.237132|4.288362|3.733547|2.953301|2.670790|2.854741|3.542120|15.216294|3.610521|3.667830|2.748407|1.770327|2.298278|1.513190|1.418920|1.476790|2.230245|1.371275|1.434257|3.084952|0.124361|0.096779|0.101501|0.091888|0.123168|0.252044|0.500000| |2.586347|3.070293|2.855087|3.153736|4.083872|4.846546|3.902659|7.811134|17.486650|10.797591|9.643350|38.017339|25.940522|9.166547|6.098564|4.423916|4.074666|4.697491|6.885565|21.073254|4.862942|4.761448|3.931760|2.419234|3.152676|2.000767|1.819979|1.884774|2.914227|1.692529|1.883766|2.698628|0.073729|0.066485|0.065366|0.068304|0.120620|0.109974|0.156719|0.500000| |2.023781|2.254435|2.102499|2.228747|2.630232|2.963563|2.671694|3.762138|6.799387|6.072373|6.132156|41.219789|9.685868|8.933387|17.744182|8.899721|5.642143|4.950011|5.646740|27.656881|5.757717|6.889748|4.850353|2.890146|3.606708|2.255973|2.076970|2.208188|3.503942|1.981400|2.054142|1.991874|0.058631|0.051749|0.053287|0.052353|0.075534|0.077453|0.110504|0.157710|0.500000| |1.620832|1.761417|1.665387|1.751184|1.998465|2.178647|2.012893|2.607881|4.817354|3.949338|3.608438|25.849780|5.651821|5.656324|8.902158|17.762989|8.964801|5.661994|4.960457|47.186915|8.239065|13.296759|7.521753|4.186364|4.831924|2.918442|2.707697|2.996698|5.034724|2.630396|2.514970|1.608317|0.046802|0.042277|0.042941|0.042335|0.057522|0.058119|0.074254|0.101867|0.213604|0.500000| |1.659983|1.802616|1.698634|1.783569|2.039735|2.232573|2.065669|2.683704|5.159633|3.867105|3.412432|22.340686|5.690034|5.648865|4.951529|5.659951|8.960960|17.762270|8.895894|47.256828|13.187788|8.206151|7.656290|4.243767|4.909124|2.954948|2.731769|3.016210|5.070117|2.637828|2.546825|1.631346|0.047929|0.044383|0.042910|0.043117|0.058623|0.059924|0.070765|0.109710|0.107535|0.124770|0.500000| |2.103264|2.344337|2.171314|2.296822|2.726621|3.105368|2.801375|4.003954|7.883019|5.792186|5.304518|30.264720|9.903729|8.931256|5.645834|4.956176|5.645914|8.897878|17.709523|27.678316|6.880489|5.748081|4.882892|2.907001|3.635110|2.270855|2.086557|2.215122|3.514683|1.984218|2.069441|2.035765|0.060955|0.055813|0.053258|0.053870|0.078057|0.081993|0.099994|0.192968|0.124334|0.107642|0.213476|0.500000| |1.010904|1.075235|1.053675|1.107023|1.202888|1.237362|1.162323|1.367791|2.578378|1.895394|1.519105|10.471503|2.274891|1.886409|1.992853|2.287349|2.502109|2.297240|1.998880|22.150080|5.301181|5.302225|5.081287|5.056566|7.751761|8.804940|17.740833|8.817550|7.763303|6.854966|6.875076|1.069145|0.028557|0.027267|0.027041|0.027654|0.034888|0.032670|0.036517|0.045962|0.051793|0.065624|0.066130|0.052012|0.500000| |1.047421|1.102817|1.064863|1.104452|1.200842|1.257835|1.198159|1.395409|2.592147|1.973084|1.606997|11.391599|2.382096|2.011977|2.119292|2.490206|2.831870|2.586789|2.178170|27.311219|7.336621|6.699432|5.297601|4.822624|5.550338|4.362787|5.891598|8.934037|9.692956|17.567514|3.347511|1.051502|0.029911|0.028256|0.027911|0.027904|0.034365|0.034170|0.038240|0.047083|0.054201|0.071067|0.076452|0.056484|0.149905|0.500000| |1.042933|1.098692|1.061505|1.101552|1.197710|1.253884|1.193611|1.391069|2.573731|1.977131|1.614285|11.538803|2.380973|2.012063|2.176669|2.584373|2.831940|2.492366|2.120900|27.309264|6.691757|7.342762|5.297639|4.822610|5.550326|4.362902|5.892002|8.934202|9.692260|17.567612|3.347613|1.049431|0.029781|0.028011|0.027906|0.027817|0.034291|0.034015|0.038440|0.046817|0.056448|0.076345|0.071151|0.054237|0.149921|0.303034|0.500000| |0.985351|1.038514|1.009244|1.049744|1.136762|1.180806|1.122214|1.301621|2.421098|1.828064|1.474240|10.398160|2.177611|1.813129|1.922295|2.225269|2.445911|2.229551|1.924977|22.423026|5.629863|5.633298|4.605307|4.291944|5.452502|4.731145|7.190034|8.810833|7.832357|17.554106|3.741452|1.006718|0.028014|0.026579|0.026368|0.026526|0.032639|0.031815|0.035501|0.043358|0.049952|0.064344|0.064554|0.050038|0.215669|0.299398|0.299400|0.500000| |1.112718|1.201948|1.191420|1.272955|1.395029|1.414901|1.303279|1.574872|3.046302|2.129754|1.688630|11.190479|2.590588|2.124074|2.188727|2.435406|2.662065|2.543236|2.264811|21.384344|4.981351|4.763458|5.381003|4.812530|9.676505|8.917424|5.891358|4.361320|5.554667|3.345636|17.560985|1.239973|0.031154|0.030047|0.029642|0.031132|0.041168|0.036178|0.040419|0.053839|0.056544|0.067442|0.072933|0.059612|0.150209|0.085642|0.082415|0.091584|0.500000| |1.027535|1.101848|1.090611|1.157422|1.258740|1.278521|1.188348|1.410851|2.692440|1.923919|1.523673|10.280923|2.299572|1.877413|1.963976|2.195644|2.358051|2.209001|1.972643|19.412594|4.533140|4.532322|4.654597|4.293948|7.832649|8.803000|7.211026|4.743385|5.468683|3.745410|17.556590|1.128642|0.028817|0.027735|0.027501|0.028624|0.036889|0.033076|0.036861|0.047276|0.051406|0.062204|0.062877|0.051740|0.216933|0.091701|0.091701|0.108187|0.299751|0.500000| |1.107266|1.196521|1.186626|1.268408|1.389991|1.409154|1.297325|1.568483|3.016179|2.134662|1.696949|11.329245|2.588876|2.123954|2.251925|2.523103|2.661876|2.453036|2.200361|21.382133|4.764099|4.979027|5.380415|4.812118|9.674078|8.917593|5.892567|4.361746|5.554651|3.346019|17.560965|1.236470|0.031005|0.029750|0.029634|0.031009|0.041037|0.035991|0.040652|0.053436|0.059106|0.071899|0.068279|0.056980|0.150256|0.082419|0.085655|0.091597|0.302771|0.299756|0.500000| |3.801990|4.724730|7.202746|8.833557|5.590599|4.178081|3.965781|3.252468|5.539628|3.734018|2.299356|14.336961|2.992612|1.896340|1.755957|1.566814|1.501563|1.586575|1.783671|9.396099|2.266637|2.249108|1.806185|1.227019|1.669449|1.138877|1.064480|1.069958|1.553336|0.998371|1.129235|17.575359|0.088145|0.104465|0.104313|0.220865|0.140869|0.090354|0.076492|0.065941|0.050126|0.041146|0.041981|0.051655|0.028051|0.027673|0.027584|0.026517|0.032283|0.029523|0.032139|0.500000| |3.287793|4.226962|5.747337|8.843044|6.934655|4.658740|3.966581|3.756647|6.764452|4.094751|2.520548|15.170307|3.371223|2.118440|1.940068|1.722186|1.654853|1.761238|1.995964|10.271258|2.467152|2.434388|1.994598|1.349233|1.846387|1.252681|1.160854|1.162161|1.691945|1.075670|1.246399|17.563143|0.079723|0.089339|0.086832|0.147395|0.202009|0.090377|0.080738|0.076409|0.055029|0.044895|0.046517|0.058089|0.030491|0.029778|0.029614|0.028528|0.035830|0.032412|0.035541|0.301560|0.500000| |3.399410|4.347659|6.043489|8.846612|6.512864|4.538867|3.979409|3.616066|6.227945|4.093710|2.509521|15.408857|3.282315|2.063131|1.929686|1.705928|1.612921|1.688378|1.903910|10.024359|2.388317|2.406411|1.938364|1.312040|1.790793|1.216579|1.130720|1.134093|1.650433|1.052516|1.208281|17.537128|0.081888|0.088723|0.094099|0.159022|0.178818|0.090499|0.082925|0.072886|0.055802|0.044929|0.044207|0.054415|0.029722|0.029036|0.029134|0.027918|0.034466|0.031470|0.034628|0.301825|0.302283|0.500000| 2135.408705 -11477.806731 4224.639871 -230.637712 -5348.395868 3210.603943 -2137.791925 2.001116 BC43EC27D8000002 44EB6E27B9C4FFDF 446CA96F847612AC 41D61B63C0000003 33A011C2D10134D9 43E7F8958E36021B