Version2.0 2020-01-23T07:50:57Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 11-Sep-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCOC(=O)c1c(csc1NC(=O)c2c3c(n(n2)[C@H]4CCS(=O)(=O)C4)CCCC3)c5ccc(cc5)C C40987547 RHF 6-31G(d) (6D,7F) CCOC(=O)c1c(csc1NC(=O)c2c3c(n(n2)[C@H]4CCS(=O)(=O)C4)CCCC3)c5ccc(cc5)C C01[X(C26H29N3O5S2)] 189 C1 606 CCOC(=O)c1c(scc1c1ccc(cc1)C)NC(=O)c1nn(c2c1CCCC2)[C@H]1CCS(=O)(=O)C1 CCOC(=O)c1c(scc1c1ccc(cc1)C)NC(=O)c1nn(c2c1CCCC2)[C@H]1CCS(=O)(=O)C1 CCOC(=O)c1c(NC(=O)c2nn([C@H]3CC[S](=O)(=O)C3)c4CCCCc24)scc1c5ccc(C)cc5 InChIKey=LZAXKZBQMTYXQN-SFHVURJKSA-N InChI=1S/C26H29N3O5S2/c1-3-34-26(31)22-20(17-10-8-16(2)9-11-17)14-35-25(22)27-24(30)23-19-6-4-5-7-21(19)29(28-23)18-12-13-36(32,33)15-18/h8-11,14,18H,3-7,12-13,15H2,1-2H3,(H,27,30)/t18-/m0/s1 InChI=1/C26H29N3O5S2/c1-3-34-26(31)22-20(17-10-8-16(2)9-11-17)14-35-25(22)27-24(30)23-19-6-4-5-7-21(19)29(28-23)18-12-13-36(32,33)15-18/h8-11,14,18H,3-7,12-13,15H2,1-2H3,(H,27,30)/t18-/m0/s1/f/h27H CCOC(=O)c1c(csc1NC(=O)c2c3c(n(n2)[C@H]4CCS(=O)(=O)C4)CCCC3)c5ccc(cc5)C C01[X(C26H29N3O5S2)] 189 C01 606 CCOC(=O)c1c(scc1c1ccc(cc1)C)NC(=O)c1nn(c2c1CCCC2)[C@H]1CCS(=O)(=O)C1 CCOC(=O)[C@@H]1[C@@H](SC=C1c1ccc(cc1)C)NC(=O)[C@@H]1NN([C@H]2[C@@H]1CCCC2)[C@H]1CC[S@@](=O)(C1)O CCOC(=O)[C@@H]1[C@H](NC(=O)[C@@H]2NN([C@H]3CC[S](O)(=O)C3)[C@@H]4CCCC[C@H]24)SC=C1c5ccc(C)cc5 InChIKey=ZKVDOKSQKNMRBS-UYSQUTSUSA-N InChI=1S/C26H36N3O5S2/c1-3-34-26(31)22-20(17-10-8-16(2)9-11-17)14-35-25(22)27-24(30)23-19-6-4-5-7-21(19)29(28-23)18-12-13-36(32,33)15-18/h8-11,14,18-19,21-23,25,28H,3-7,12-13,15H2,1-2H3,(H,27,30)(H,32,33)/t18-,19-,21+,22-,23+,25+/m0/s1 InChI=1/C26H36N3O5S2/c1-3-34-26(31)22-20(17-10-8-16(2)9-11-17)14-35-25(22)27-24(30)23-19-6-4-5-7-21(19)29(28-23)18-12-13-36(32,33)15-18/h8-11,14,18-19,21-23,25,28H,3-7,12-13,15H2,1-2H3,(H,27,30)(H,32,33)/t18-,19-,21+,22-,23+,25+/m0/s1/f/h27,32H 4226.6481396167 -2334.1149511 1-A 27036.9094 139 467 606 |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|A|A|A|A|A|A|A|A|A| -92.18281 -91.97482 -20.60501 -20.55351 -20.55057 -20.54798 -20.54707 -15.66885 -15.61203 -15.60862 -11.38572 -11.37098 -11.33216 -11.31937 -11.28658 -11.28653 -11.27841 -11.27712 -11.27375 -11.26745 -11.25689 -11.25073 -11.24690 -11.24141 -11.23928 -11.23864 -11.23753 -11.23582 -11.23102 -11.23037 -11.22875 -11.22791 -11.22544 -11.22500 -11.22217 -11.21913 -9.16109 -8.98438 -6.84691 -6.84592 -6.84582 -6.66673 -6.66567 -6.66399 -1.47551 -1.46348 -1.42728 -1.41312 -1.36543 -1.34576 -1.27632 -1.19619 -1.17766 -1.15226 -1.14717 -1.12182 -1.05997 -1.05458 -1.05086 -1.03694 -1.02186 -1.01258 -1.00929 -0.99627 -0.97691 -0.93046 -0.90546 -0.89354 -0.88729 -0.85301 -0.83341 -0.82735 -0.81579 -0.81176 -0.80445 -0.79227 -0.77928 -0.77113 -0.74573 -0.73440 -0.71901 -0.70865 -0.69428 -0.68886 -0.67963 -0.67736 -0.66517 -0.65887 -0.64775 -0.64433 -0.64025 -0.63667 -0.63065 -0.62902 -0.62199 -0.61768 -0.61257 -0.60659 -0.59666 -0.58999 -0.58555 -0.58120 -0.58017 -0.57753 -0.57634 -0.57028 -0.56681 -0.55676 -0.55197 -0.55002 -0.54418 -0.53451 -0.53328 -0.53229 -0.52393 -0.51463 -0.50764 -0.50068 -0.49153 -0.49138 -0.48594 -0.48476 -0.48275 -0.48099 -0.47962 -0.47597 -0.46726 -0.46592 -0.45946 -0.45157 -0.44704 -0.43359 -0.42722 -0.37304 -0.35224 -0.34334 -0.33191 -0.31918 -0.29656 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0.21186 0.22126 0.23439 0.23966 0.24613 0.24750 0.25423 0.26346 0.26530 0.27025 0.27409 0.27732 0.27863 0.28315 0.28842 0.29246 0.29410 0.29840 0.29875 0.30211 0.30765 0.30931 0.31147 0.31412 0.31648 0.31804 0.32297 0.32319 0.33461 0.33967 0.34127 0.34580 0.35134 0.35249 0.35833 0.36164 0.36964 0.37754 0.38057 0.39263 0.39888 0.40319 0.40468 0.40658 0.40986 0.41542 0.42164 0.43909 0.44268 0.45416 0.46809 0.46951 0.47518 0.48059 0.49240 0.49799 0.50659 0.52117 0.53037 0.53911 0.54316 0.54692 0.55198 0.55797 0.57705 0.57897 0.58507 0.59884 0.61256 0.64647 0.65733 0.66445 0.66967 0.67554 0.67683 0.69351 0.70000 0.70442 0.70567 0.70914 0.71519 0.71809 0.72093 0.72613 0.73065 0.73846 0.74044 0.74645 0.75117 0.75290 0.75673 0.76131 0.76600 0.77018 0.77958 0.78157 0.78598 0.79547 0.80735 0.81309 0.81661 0.82191 0.82442 0.83113 0.83270 0.84094 0.84804 0.85068 0.85356 0.85770 0.86357 0.86611 0.88022 0.88650 0.89049 0.89948 0.90753 0.91690 0.92012 0.92608 0.93894 0.94068 0.94321 0.94585 0.95302 0.95922 0.96547 0.96853 0.96967 0.97659 0.98280 0.98720 0.99521 1.00029 1.00283 1.00657 1.01150 1.02246 1.02619 1.02858 1.04070 1.04997 1.05664 1.05741 1.06589 1.06751 1.08861 1.09357 1.09787 1.10019 1.11162 1.11452 1.11552 1.11859 1.12132 1.12390 1.12452 1.12720 1.13124 1.13427 1.13771 1.14189 1.14466 1.14921 1.15359 1.15576 1.15990 1.16304 1.16377 1.16997 1.17663 1.18237 1.18589 1.19074 1.19354 1.19766 1.20006 1.20650 1.20952 1.21478 1.22146 1.22801 1.23412 1.23764 1.23993 1.24376 1.25252 1.25546 1.25685 1.26026 1.26683 1.27090 1.27497 1.28245 1.30270 1.30345 1.30430 1.31017 1.31947 1.33065 1.34606 1.35248 1.35471 1.36311 1.38023 1.39928 1.40493 1.41121 1.41155 1.43017 1.43723 1.44548 1.45003 1.45530 1.45915 1.46260 1.47879 1.48401 1.48819 1.50079 1.51261 1.52250 1.53391 1.54321 1.54650 1.56196 1.56982 1.57712 1.58982 1.59964 1.60266 1.60835 1.63498 1.64094 1.64420 1.64522 1.64895 1.66859 1.67939 1.68237 1.69049 1.69267 1.70484 1.72664 1.73459 1.73660 1.74871 1.75751 1.76181 1.77118 1.78389 1.78710 1.80357 1.80366 1.81969 1.83010 1.84699 1.85384 1.87129 1.87707 1.88483 1.90053 1.93738 1.94167 1.95169 1.95773 1.96523 1.96694 1.98701 1.98767 2.02239 2.02482 2.03704 2.04963 2.05187 2.05920 2.06792 2.07967 2.08835 2.09192 2.09864 2.10521 2.10943 2.11702 2.12060 2.13098 2.13394 2.13927 2.14524 2.15754 2.16021 2.16936 2.17447 2.18094 2.18617 2.18824 2.19495 2.19852 2.20220 2.20900 2.21056 2.21677 2.22174 2.23631 2.24003 2.24253 2.24719 2.24893 2.26697 2.27632 2.28512 2.29614 2.30246 2.31215 2.32953 2.33389 2.33865 2.34577 2.36122 2.37489 2.37835 2.38021 2.38533 2.40631 2.41539 2.42154 2.42732 2.43070 2.44779 2.44934 2.45714 2.46290 2.47251 2.47546 2.48061 2.49086 2.49418 2.50367 2.51413 2.52894 2.53226 2.53551 2.55054 2.55457 2.56840 2.58025 2.58218 2.59693 2.61335 2.61799 2.62298 2.63442 2.63595 2.65284 2.65821 2.66596 2.66851 2.67589 2.68054 2.68460 2.68999 2.69314 2.70094 2.70460 2.71536 2.73082 2.73241 2.74796 2.76204 2.77523 2.78686 2.79035 2.79652 2.81222 2.82261 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1568.70 1577.17 1590.36 1610.84 1614.72 1646.64 1673.05 1688.24 1692.02 1709.04 1718.52 1740.09 1750.14 1771.51 1783.25 1797.15 1825.25 1839.66 1862.42 1866.51 1868.38 1883.90 1903.23 1909.65 1935.98 1954.38 1970.55 1982.73 1992.83 2004.87 2023.09 2047.96 2049.84 2075.37 2084.38 2088.68 2101.88 2128.49 2136.09 2157.72 2162.25 2175.61 2187.71 2197.00 2203.65 2233.05 2247.28 2255.34 2268.20 2285.15 2293.31 2313.36 2315.53 2343.18 2344.11 2347.94 2351.46 2356.18 2359.42 2361.83 2369.85 2377.32 2381.05 2405.95 2412.11 2425.83 2507.18 2513.32 2539.87 2543.84 2628.05 2764.07 2826.87 4597.23 4599.70 4607.05 4613.20 4620.44 4629.23 4660.34 4676.30 4680.59 4683.81 4690.04 4691.11 4714.92 4718.74 4719.10 4719.23 4725.80 4736.25 4743.13 4770.09 4773.04 4811.55 4813.51 4816.07 4824.78 4851.56 4859.66 4946.12 5435.35 0.562976 0.595099 0.596043 0.492030 -2333.551975 -2333.519852 -2333.518908 -2333.622921 3.488613D-04 MUNgauss RevisionA2.0 retrievium 23-Jan-2020 DUDE CCOC(=O)c1c(csc1NC(=O)c2c3c(n(n2)[C@H]4CCS(=O)(=O)C4)CCCC3)c5ccc(cc5)C C40987547 RHF 6-31G(d) (6D,10F) C1 527.154865 |X|Y|Z| 79.300553 141.693271 25.909257 66.276587 27 6 7 16 22 3 2 |36.858105| |12.584001|36.858105| |8.047591|13.366243|73.516695| |5.284594|8.112057|25.778100|36.858105| |4.634239|7.231586|15.367313|15.833840|73.516695| |4.066577|5.195213|14.483386|12.929481|14.318210|36.858105| |3.861344|4.414499|11.709983|7.254990|9.113436|13.074025|36.858105| |3.042156|3.389921|8.073611|5.106996|7.245024|8.235368|14.209196|36.858105| |2.649914|3.054116|6.925202|4.774924|7.429766|7.382678|7.382711|11.009003|388.023441| |3.194693|3.958851|9.408863|7.700581|11.861554|13.873567|8.119508|7.739088|78.377181|36.858105| |2.929191|3.692650|8.035712|6.522190|12.521784|7.809602|5.190462|4.993207|49.636370|13.855071|53.358707| |2.426850|2.937471|6.077147|4.451060|8.552782|5.138020|3.988961|4.129647|43.269587|7.811068|19.040053|36.858105| |2.200276|2.583200|5.355916|3.749478|6.823165|4.524030|3.819964|4.238811|48.284893|6.709243|11.474338|15.891372|73.516695| |2.256287|2.727584|5.355243|3.788504|7.753371|3.949999|3.146931|3.154471|29.373806|5.122795|10.827824|12.826769|14.417040|36.858105| |1.937697|2.277420|4.379766|2.958213|5.883637|3.079199|2.590200|2.644584|24.001772|3.803500|6.918990|7.320747|11.352447|13.480006|36.858105| |1.893786|2.225726|4.160164|2.763391|5.627127|2.755902|2.322695|2.316955|20.022845|3.237528|5.721849|5.235683|7.966348|8.726141|13.965599|36.858105| |2.133755|2.567112|4.739016|3.196804|6.818951|3.062820|2.505593|2.431542|20.618457|3.532249|6.446172|5.409923|7.616887|9.072672|8.702604|14.057825|53.358707| |2.422594|2.994483|5.694534|4.038893|8.896351|3.886566|3.033165|2.915291|25.377930|4.665213|9.532139|7.847749|9.644718|14.604092|8.479604|8.602851|19.605568|53.358707| |2.127880|2.550454|4.534728|2.969243|6.405862|2.734934|2.266421|2.160464|17.564351|2.996550|5.147730|3.970124|5.827415|5.489242|5.282700|7.537710|17.944398|10.845221|36.858105| |1.904786|2.234190|3.964956|2.545475|5.323430|2.383921|2.022144|1.949468|15.785338|2.605225|4.347845|3.425910|5.232994|4.608438|4.872501|7.290678|12.705590|7.971488|17.634012|0.500000| |2.324275|2.809342|4.860198|3.135562|6.877001|2.786135|2.299667|2.153850|17.099484|2.959350|4.961458|3.621448|5.332649|4.604722|4.206274|5.248590|10.435095|8.749661|12.369651|0.245015|36.858105| |2.274097|2.700131|4.505441|2.800793|6.032481|2.450608|2.067096|1.920441|14.811640|2.518640|4.029624|2.878435|4.370112|3.441532|3.207390|3.858333|6.845042|6.049359|7.640077|0.186278|12.356118|36.858105| |2.142541|2.525122|4.252610|2.646732|5.640988|2.346796|1.994601|1.861757|14.362705|2.418606|3.849343|2.772677|4.243145|3.311789|3.125575|3.777317|6.572725|5.739035|7.328134|0.185319|7.095810|10.580442|388.023441| |1.844929|2.121436|3.611802|2.224103|4.594810|2.024419|1.755676|1.663093|12.861153|2.103841|3.307806|2.447922|3.840391|2.923684|2.900859|3.562255|5.733802|4.810348|6.046207|0.183746|5.458569|7.244167|94.090147|73.516695| |2.302187|2.707613|4.444405|2.710516|5.754027|2.354929|2.012861|1.853345|13.983636|2.362151|3.659238|2.557242|3.939811|2.916977|2.689057|3.083345|5.198333|4.916855|5.022311|0.125173|5.134055|7.111681|94.455246|13.603700|73.516695| |2.200869|2.647199|4.640170|3.013581|6.548608|2.726203|2.264149|2.132191|16.982819|2.913200|4.870330|3.596340|5.328914|4.588597|4.237496|5.334667|10.462580|8.616836|12.435514|0.247128|7.771625|7.160387|75.959331|12.993559|12.704588|36.858105| |1.662959|1.914007|3.526957|2.275773|4.541263|2.264586|1.965189|1.969194|16.585821|2.585532|4.304365|3.760540|6.122249|5.216609|7.470427|12.698532|10.143238|7.076275|6.013310|0.196624|4.408005|3.509681|24.875744|6.331028|5.029309|4.512184|36.858105| |1.526733|1.734508|3.233660|2.072396|4.030724|2.115332|1.873873|1.914978|16.278626|2.435342|3.947944|3.528420|6.111181|4.533573|6.725253|7.710975|6.867191|5.602939|4.121679|0.125801|3.284615|2.740225|19.671262|5.015849|4.167671|3.435311|12.389072|36.858105| |1.556663|1.766047|3.343967|2.154603|4.129226|2.250630|2.004093|2.083744|18.155347|2.647055|4.279782|3.989462|7.258952|4.931577|7.675451|6.781168|6.266409|5.586778|3.610699|0.104003|3.047886|2.507982|17.454876|4.320408|3.784745|3.013864|7.481198|12.424944|36.858105| |1.727346|1.984236|3.832849|2.527385|4.838096|2.702786|2.369166|2.490790|22.720614|3.314297|5.547727|5.697467|10.722744|7.127873|12.671013|7.535295|7.128325|6.968147|3.808614|0.103156|3.204646|2.587581|18.064231|4.319552|3.971905|3.230602|6.198965|7.487341|12.406839|36.858105| |4.429381|4.594170|11.749189|5.840341|7.597576|7.199615|12.760190|7.721807|33.794654|5.032818|5.137909|3.060803|5.227580|2.560127|2.170482|1.994121|2.928859|3.439524|2.000177|0.050055|2.052218|1.893089|13.026960|2.879965|3.339656|2.022346|1.723650|1.643203|1.736036|2.001749|36.858105| |4.193549|4.044969|9.387717|4.548008|6.293591|5.205933|7.617838|5.996649|28.342565|4.025925|4.326114|2.671914|4.627078|2.277431|1.968891|1.818894|2.648012|3.055239|1.820909|0.046015|1.889256|1.751482|11.903126|2.655947|3.038414|1.818870|1.592324|1.523458|1.616001|1.838117|13.762501|36.858105| |4.088084|3.642224|7.710104|3.644484|5.289378|3.885274|5.037902|4.269527|22.137481|3.146327|3.553241|2.248660|3.898731|1.968592|1.730331|1.619164|2.352159|2.665808|1.640858|0.041785|1.705298|1.607426|10.981716|2.465426|2.827040|1.651456|1.436695|1.376387|1.447847|1.623845|7.898592|13.710418|36.858105| |4.181559|3.616276|7.376217|3.449899|5.087496|3.562108|4.424650|3.738560|20.052300|2.896729|3.330968|2.114489|3.645459|1.873770|1.652116|1.557985|2.270935|2.559573|1.597991|0.040725|1.651304|1.575252|10.911706|2.448730|2.842033|1.632582|1.387830|1.328114|1.383446|1.546244|6.770450|7.886294|13.759103|36.858105| |4.431202|4.007435|8.416860|3.940491|5.724490|4.063221|5.038801|4.087474|21.806524|3.223388|3.671929|2.297232|3.926621|2.025616|1.768521|1.666116|2.444188|2.777913|1.717230|0.043494|1.758865|1.677599|11.770898|2.623457|3.087504|1.777363|1.473841|1.406749|1.458187|1.642143|7.902507|6.914683|8.001382|13.659673|36.858105| |4.570332|4.564323|10.746979|5.157878|7.059390|5.642459|7.583988|5.501394|27.589827|4.181386|4.537969|2.750468|4.666822|2.364348|2.023685|1.884642|2.779183|3.224280|1.925806|0.048301|1.961795|1.842698|12.923282|2.855719|3.368309|1.990304|1.642163|1.563759|1.629031|1.862925|13.673290|7.990285|6.911941|7.884184|13.808868|36.858105| |3.566898|3.013362|5.767334|2.758639|4.234310|2.786680|3.275318|2.899252|16.421697|2.357246|2.796244|1.812407|3.135782|1.635590|1.463179|1.391937|2.019773|2.242165|1.434986|0.036869|1.483785|1.432110|9.951427|2.251728|2.601312|1.469299|1.254706|1.203487|1.247187|1.377736|4.404900|5.001240|7.534966|12.606861|7.548481|5.014691|36.858105| |17.551664|8.902513|10.219694|4.279186|7.136414|3.370440|3.176663|2.599743|16.539577|2.768378|3.555463|2.210862|3.566431|2.099311|1.825566|1.807571|2.776042|3.097111|2.070120|0.051777|2.282378|2.284764|15.277485|3.293671|4.156290|2.152942|1.603436|1.466378|1.483380|1.628149|3.540707|3.410285|3.403843|3.520877|3.673080|3.684401|3.174563|0.500000| |17.578698|8.856432|12.904469|4.920512|7.505790|3.995471|3.927706|3.113658|18.997554|3.152427|3.880729|2.379009|3.875710|2.192908|1.892785|1.837325|2.788809|3.161075|2.024746|0.050646|2.218646|2.145885|14.183238|3.085792|3.744055|2.055413|1.617739|1.493163|1.535772|1.701922|4.597082|4.683216|4.603664|4.440506|4.380534|4.451910|3.761256|0.300397|0.500000| |17.588132|8.854936|12.905505|4.909833|7.474365|3.987416|3.960090|3.107655|18.781663|3.114869|3.818948|2.337142|3.808146|2.154478|1.858729|1.806809|2.746464|3.112866|2.000318|0.049976|2.140478|2.095604|14.353520|3.113759|3.870114|2.089678|1.591918|1.473851|1.502255|1.670431|4.811786|4.449404|4.514836|4.973031|5.527283|5.416931|4.190073|0.300290|0.301409|0.500000| |8.810165|17.621095|16.528725|7.276525|13.079529|4.776005|3.958315|3.153182|20.953952|3.841026|5.076558|2.994947|4.633070|2.836472|2.367306|2.336418|3.707816|4.309893|2.734116|0.066201|3.118696|2.985098|19.102916|3.982232|5.057936|2.780848|2.005211|1.797247|1.829760|2.044102|3.937406|3.606619|3.232716|3.118672|3.333474|3.747599|2.658455|0.211635|0.211223|0.173024|0.500000| |8.805940|17.618478|16.523813|7.242824|12.924585|4.761651|3.990105|3.146234|20.664233|3.773851|4.941765|2.913372|4.519639|2.755658|2.302364|2.275411|3.611564|4.191912|2.676156|0.064752|2.914084|2.855922|19.533745|4.044371|5.384428|2.868583|1.957289|1.764304|1.774293|1.990671|4.067406|3.495293|3.200107|3.285072|3.759466|4.266324|2.795897|0.211558|0.172983|0.210962|0.302453|0.500000| |2.752187|2.953760|6.729968|4.034969|5.925837|5.686649|8.826521|17.790224|55.438710|5.437156|5.364633|3.450925|6.461835|2.729649|2.359066|2.080847|2.934292|3.434665|1.932736|0.049013|1.923501|1.733452|11.996924|2.707659|2.990482|1.909917|1.800119|1.769929|1.926997|2.270467|6.851833|5.938713|4.387616|3.805961|4.037862|5.131067|2.979096|0.066111|0.078931|0.079043|0.076413|0.076495|0.500000| |3.185540|4.189629|8.848189|7.526187|17.386550|7.324554|4.748409|4.286684|37.494465|9.448898|25.890162|9.327456|10.809950|7.607337|4.864417|4.320373|7.157696|11.222942|4.319976|0.097798|4.267476|3.421187|22.999302|4.792740|5.485731|4.140618|3.227069|2.858696|3.001539|3.749545|3.641798|3.074365|2.564896|2.431738|2.692167|3.296277|2.052318|0.079317|0.084615|0.083416|0.119810|0.116524|0.096168|0.500000| |2.174975|2.580627|4.496864|2.867023|6.091053|2.600130|2.179487|2.063695|16.427783|2.778486|4.594191|3.431369|5.167057|4.322286|4.129666|5.133234|9.101497|7.559216|8.747812|0.217161|17.599085|8.728314|38.000935|8.249540|7.252160|5.597751|4.510338|3.355249|3.156268|3.227748|1.948479|1.818079|1.642776|1.578379|1.663163|1.844790|1.423296|0.059349|0.058546|0.055537|0.079981|0.072829|0.051524|0.106181|0.500000| |2.653252|3.310809|5.735601|3.788524|8.702959|3.263895|2.618165|2.412525|19.120626|3.441419|5.875652|4.085905|5.834554|5.043730|4.247747|4.913081|9.865709|10.045480|8.893671|0.174878|17.616988|8.799059|41.893871|7.868208|8.602289|6.821451|3.915271|3.051753|2.936671|3.206708|2.312612|2.112569|1.887019|1.819109|1.944798|2.193240|1.617699|0.071638|0.070134|0.067107|0.104072|0.094961|0.059062|0.147564|0.302216|0.500000| |2.050748|2.377863|3.979200|2.437581|5.101203|2.171440|1.865236|1.749100|13.453180|2.235007|3.521403|2.557770|3.966460|3.033294|2.928495|3.533600|5.878872|5.087499|6.188668|0.172726|8.649413|17.623979|57.758478|13.045130|10.230329|5.560851|3.389756|2.661952|2.416354|2.427456|1.720735|1.608821|1.486368|1.455063|1.537614|1.673814|1.333157|0.057550|0.054254|0.052679|0.072696|0.069075|0.044250|0.080977|0.220697|0.175239|0.500000| |2.511263|3.000087|4.855777|2.966608|6.429510|2.526440|2.129536|1.950151|14.768419|2.533361|3.974009|2.754010|4.187766|3.168860|2.881709|3.316844|5.755838|5.473432|5.686190|0.137052|8.666617|17.637474|57.104184|9.941412|12.643630|5.725976|2.984505|2.414544|2.259701|2.360417|1.972381|1.828684|1.684737|1.654530|1.760476|1.926147|1.505040|0.070973|0.065330|0.063475|0.093805|0.088617|0.048839|0.094654|0.188236|0.224749|0.299847|0.500000| |2.471702|3.049782|5.360815|3.555173|8.008828|3.141718|2.548905|2.363514|18.751609|3.327987|5.625414|3.968019|5.730986|4.890090|4.181351|4.865884|9.578218|9.510586|8.782536|0.173918|6.875229|6.208207|57.214645|9.695643|12.355461|17.615538|3.923486|3.131818|2.856981|3.174744|2.260747|2.003091|1.806962|1.791911|1.972456|2.234779|1.598324|0.066601|0.063372|0.065215|0.088292|0.093526|0.058149|0.138347|0.139056|0.197265|0.131563|0.154210|0.500000| |2.010370|2.375536|4.208066|2.709840|5.707136|2.514528|2.126063|2.027889|16.204128|2.706274|4.452520|3.373004|5.130294|4.256691|4.130390|5.187616|8.970982|7.332954|8.632945|0.215626|5.565642|5.308046|57.279738|12.436195|10.733362|17.624986|4.636519|3.606601|3.060451|3.241600|1.904680|1.712562|1.562021|1.551480|1.692284|1.887796|1.402651|0.054577|0.052259|0.053690|0.068171|0.071460|0.050870|0.101530|0.123776|0.138186|0.125860|0.122716|0.297914|0.500000| |1.632692|1.869934|3.418301|2.184314|4.349829|2.156325|1.879927|1.876735|15.618585|2.431909|3.994735|3.408472|5.569202|4.551195|6.017383|8.936764|8.745802|6.318926|5.682656|0.193029|4.544333|3.603015|24.205865|6.236841|4.865225|4.113542|17.511321|8.791259|6.515154|5.209799|1.660496|1.548971|1.401585|1.348733|1.421861|1.575400|1.223327|0.043923|0.044347|0.043156|0.054945|0.052745|0.047798|0.083694|0.138002|0.109490|0.099596|0.084646|0.099323|0.112862|0.500000| |1.628094|1.869320|3.407373|2.181000|4.369319|2.143952|1.866365|1.855491|15.365700|2.406394|3.953063|3.336929|5.407663|4.467411|5.720279|8.871526|9.173796|6.405458|6.287327|0.225028|4.385655|3.669311|27.547435|7.325269|5.454033|5.001441|17.547256|8.803263|5.488223|4.814738|1.653828|1.524403|1.384896|1.348091|1.436680|1.593264|1.224165|0.043867|0.043703|0.043411|0.054191|0.053653|0.047251|0.083567|0.120260|0.105464|0.099215|0.085299|0.115236|0.151307|0.303210|0.500000| |1.416582|1.593835|2.948885|1.864940|3.603562|1.894376|1.697740|1.732842|14.478389|2.146237|3.403878|2.953609|5.159646|3.633430|4.917899|5.604394|5.580769|4.627263|3.590221|0.112341|2.963397|2.544165|18.206626|4.757104|3.873378|3.042066|8.847708|17.557050|8.800249|5.470180|1.506044|1.407260|1.280508|1.237019|1.303780|1.437334|1.128214|0.037988|0.038568|0.037996|0.045916|0.044971|0.044849|0.068785|0.085332|0.075751|0.070099|0.062433|0.076574|0.088765|0.219958|0.206953|0.500000| |1.510679|1.714415|3.204830|2.054499|3.981703|2.107255|1.873538|1.919605|16.316837|2.426231|3.907616|3.481677|6.079826|4.374507|6.194741|6.715336|6.407814|5.390546|3.891012|0.116413|3.055328|2.605955|19.381345|4.941375|4.162650|3.434474|8.848406|17.524679|8.851786|6.908145|1.644004|1.514251|1.370402|1.330050|1.417040|1.576699|1.205611|0.040260|0.040853|0.040776|0.048890|0.048767|0.049382|0.078283|0.084202|0.079732|0.069670|0.064233|0.087718|0.103672|0.174110|0.220816|0.303294|0.500000| |1.558315|1.764403|3.325960|2.132016|4.086638|2.211553|1.970310|2.039343|17.597749|2.579020|4.148531|3.785916|6.802681|4.628919|6.693604|6.241823|6.057928|5.393842|3.567255|0.103307|3.128457|2.550130|17.200675|4.256095|3.715444|2.898475|6.900135|8.854935|17.508310|8.833907|1.713138|1.609166|1.442171|1.370459|1.434490|1.597199|1.237043|0.041332|0.042940|0.041517|0.051237|0.048884|0.052408|0.081432|0.092906|0.083430|0.068945|0.063877|0.076140|0.079890|0.194279|0.139495|0.210663|0.173761|0.500000| |1.449925|1.627739|3.086438|1.968008|3.717955|2.073591|1.879790|1.974046|17.074643|2.419892|3.798714|3.468760|6.540221|4.007097|5.579984|4.946055|5.000684|4.602402|3.011657|0.086709|2.597942|2.198492|15.443254|3.850647|3.403136|2.606370|5.474839|8.832716|17.552744|8.826201|1.639510|1.533511|1.380354|1.320155|1.387478|1.542011|1.195122|0.038395|0.039833|0.039069|0.046559|0.045362|0.051305|0.073377|0.074408|0.069959|0.059215|0.055647|0.069189|0.074199|0.137495|0.123249|0.215889|0.211005|0.303382|0.500000| |1.682749|1.923698|3.732911|2.453786|4.646539|2.655751|2.356471|2.502903|22.906339|3.255999|5.317285|5.367322|10.590095|6.159006|8.931926|6.063241|6.200772|6.207327|3.443744|0.093074|2.879455|2.391655|17.173880|4.117480|3.835154|3.074633|5.221681|6.532101|8.799533|17.530823|1.993089|1.817307|1.609560|1.542477|1.648040|1.871345|1.375263|0.043991|0.045877|0.045612|0.054373|0.053943|0.063789|0.098740|0.078899|0.080365|0.062187|0.061046|0.084847|0.087803|0.119779|0.121804|0.137526|0.194949|0.173928|0.219180|0.500000| |1.746912|1.997823|3.902537|2.570470|4.832856|2.806400|2.485154|2.658309|24.781993|3.490062|5.712125|5.936481|12.250191|6.485996|8.910659|5.752229|6.077705|6.298877|3.361371|0.089915|2.972820|2.412777|16.509259|3.917114|3.682864|2.873199|4.804602|5.483671|8.783985|17.599797|2.081506|1.925371|1.689075|1.592346|1.679638|1.909393|1.413822|0.045496|0.048240|0.046877|0.057221|0.054998|0.067443|0.104002|0.084207|0.084297|0.062990|0.062102|0.079751|0.078650|0.121169|0.107480|0.122928|0.139647|0.219050|0.206097|0.305127|0.500000| |3.764618|3.723320|8.482494|4.318244|6.101572|5.049822|7.056524|6.105850|29.622409|4.088083|4.400220|2.746828|4.803238|2.326573|2.017252|1.851992|2.678842|3.089946|1.829314|0.046336|1.906362|1.750517|11.760219|2.633725|2.969608|1.800186|1.620819|1.554462|1.664776|1.894291|8.940304|17.716368|8.916638|5.630909|4.973572|5.666049|4.084749|0.086984|0.119108|0.105887|0.096281|0.088873|0.169136|0.085753|0.051465|0.059211|0.044832|0.050583|0.054686|0.046974|0.044009|0.042800|0.039906|0.042658|0.046347|0.043894|0.051652|0.055714|0.500000| |3.630277|3.205263|6.515466|3.144736|4.695057|3.316632|4.112978|3.665710|19.842146|2.783442|3.210174|2.066678|3.605249|1.826825|1.622980|1.523203|2.200429|2.470027|1.539601|0.039442|1.606572|1.517996|10.310327|2.329380|2.643951|1.539178|1.361697|1.307811|1.378142|1.533429|5.639435|8.934336|17.700673|8.927668|5.665800|4.971003|6.971462|0.086694|0.116102|0.107835|0.081405|0.078372|0.106165|0.064351|0.043321|0.049095|0.039254|0.044167|0.046387|0.040468|0.037090|0.036422|0.033954|0.036049|0.038309|0.036606|0.042082|0.044439|0.216367|0.500000| |4.077623|3.672703|7.296272|3.494170|5.261817|3.514246|4.109276|3.461327|19.406187|2.877295|3.367050|2.133469|3.642318|1.908736|1.679238|1.593791|2.337965|2.632818|1.655875|0.042080|1.687524|1.626674|11.548779|2.580779|3.056026|1.732753|1.418708|1.354575|1.393400|1.560308|5.635646|4.971488|5.669715|8.896556|17.689016|8.961905|7.010398|0.097550|0.107929|0.143834|0.085096|0.099596|0.095105|0.069102|0.044161|0.051469|0.041482|0.047422|0.053355|0.046090|0.037948|0.038658|0.034958|0.038058|0.037955|0.036896|0.043685|0.044016|0.107837|0.124270|0.500000| |4.275233|4.522997|10.467586|5.385913|7.530153|5.833160|7.019100|5.268068|28.179166|4.397073|4.827117|2.906815|4.886713|2.501368|2.127034|1.982223|2.937550|3.425863|2.033433|0.050771|2.045562|1.923244|13.705607|3.014325|3.593305|2.133350|1.718785|1.633941|1.690949|1.944354|8.905481|5.668098|4.971768|5.626487|8.951079|17.711242|4.095569|0.098058|0.110448|0.139471|0.102610|0.124444|0.132435|0.097999|0.052882|0.063507|0.048238|0.055650|0.067244|0.056465|0.045446|0.046542|0.041546|0.046078|0.045703|0.044373|0.054663|0.054851|0.124379|0.107822|0.216905|0.500000| |3.051576|2.667327|5.117023|2.518672|3.908475|2.582611|3.036086|2.761649|15.766693|2.225299|2.649130|1.734307|3.022434|1.566201|1.409369|1.338961|1.932138|2.136424|1.370399|0.035332|1.405048|1.357026|9.507325|2.162046|2.483443|1.407320|1.211501|1.168268|1.209757|1.335053|3.952727|4.298993|5.891319|8.837607|6.685396|4.587778|17.540532|0.076594|0.087377|0.098538|0.065811|0.070159|0.080092|0.053701|0.037426|0.042314|0.035164|0.039407|0.042417|0.037558|0.032723|0.032889|0.030456|0.032629|0.033215|0.032327|0.037220|0.038003|0.099659|0.152502|0.189466|0.108167|0.500000| |3.849391|3.133341|5.771175|2.721116|4.228599|2.664844|3.023830|2.645317|15.361153|2.252620|2.712099|1.755974|3.012240|1.601928|1.433673|1.374565|2.005485|2.217691|1.437486|0.036922|1.492634|1.453885|10.120820|2.285431|2.667211|1.480913|1.241496|1.184963|1.220312|1.342636|3.949227|4.280362|5.851771|8.834145|6.730103|4.600307|17.542627|0.097058|0.110552|0.129076|0.076206|0.081486|0.073994|0.055945|0.039649|0.045176|0.037585|0.042678|0.044788|0.039209|0.033658|0.033782|0.030896|0.032974|0.033633|0.032413|0.037175|0.038075|0.099169|0.151027|0.191737|0.108539|0.302329|0.500000| |3.292236|2.785905|5.291241|2.555792|3.955286|2.589239|3.024809|2.726630|15.606219|2.219946|2.648381|1.730033|3.006033|1.565423|1.407942|1.339716|1.936398|2.140397|1.375768|0.035471|1.428465|1.377292|9.500567|2.158527|2.470098|1.397715|1.212191|1.164614|1.210567|1.331595|3.943269|4.735575|7.227578|8.836200|5.565406|4.167448|17.578152|0.082502|0.099378|0.103103|0.069820|0.071042|0.078411|0.053857|0.038308|0.043156|0.035779|0.040182|0.041987|0.037028|0.032967|0.032776|0.030411|0.032295|0.033489|0.032275|0.036794|0.038100|0.112892|0.221458|0.140466|0.095960|0.301840|0.301811|0.500000| 2331.664824 -13944.338017 5308.980792 -257.071051 -6560.763453 4226.648444 -2334.115009 2.001051 40E5300000000033 457105CD39ABA462 44EF59E11B04DDB6 426374DD7D51FFFD BC079CA100000001 447184516F4FCDB8