Version2.4 2021-05-08T19:46:20Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 08-Sep-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE c1ccc(cc1)C2=CCC[C@H](C2)C[NH+]3CCC(=CC3)c4cccs4 C13738842 RHF 6-31G(d) (6D,7F) c1ccc(cc1)C2=CCC[C@H](C2)C[NH+]3CCC(=CC3)c4cccs4 C01[X(C22H26N1S1)] 144 C1 416 c1ccc(cc1)C1=CCC[C@H](C1)C[NH+]1CCC(=CC1)c1cccs1 c1ccc(cc1)C1=CCC[C@H](C1)C[NH+]1CCC(=CC1)c1cccs1 C1C[C@@H](C[NH+]2CCC(=CC2)c3sccc3)CC(=C1)c4ccccc4 InChIKey=RDVUGHRYXIWMDD-GOSISDBHSA-O InChI=1S/C22H25NS/c1-2-7-19(8-3-1)21-9-4-6-18(16-21)17-23-13-11-20(12-14-23)22-10-5-15-24-22/h1-3,5,7-11,15,18H,4,6,12-14,16-17H2/p+1/t18-/m1/s1 InChI=1/C22H25NS/c1-2-7-19(8-3-1)21-9-4-6-18(16-21)17-23-13-11-20(12-14-23)22-10-5-15-24-22/h1-3,5,7-11,15,18H,4,6,12-14,16-17H2/p+1/t18-/m1/s1/fC22H26NS/h23H/q+1 c1ccc(cc1)C2=CCC[C@H](C2)C[NH+]3CCC(=CC3)c4cccs4 C01[X(C22H26N1S1)] 144 C01 416 c1ccc(cc1)C1=CCC[C@H](C1)C[NH+]1CCC(=CC1)c1cccs1 C1C[C@@H](C[NH]2CCC(=CC2)C2=[CH][CH]=[CH]S2)CC(=C1)[C]1[CH][CH][CH][CH][CH]1 [CH]1[CH][CH][C]([CH][CH]1)C2=CCC[C@@H](C[NH]3CCC(=CC3)c4sccc4)C2 InChIKey=JKGGGUVZXIIRPY-GOSISDBHSA-N InChI=1S/C22H26NS/c1-2-7-19(8-3-1)21-9-4-6-18(16-21)17-23-13-11-20(12-14-23)22-10-5-15-24-22/h1-3,5,7-11,15,18,23H,4,6,12-14,16-17H2/t18-/m1/s1 InChI=1/C22H26NS/c1-2-7-19(8-3-1)21-9-4-6-18(16-21)17-23-13-11-20(12-14-23)22-10-5-15-24-22/h1-3,5,7-11,15,18,23H,4,6,12-14,16-17H2/t18-/m1/s1 1999.0369334699 -1299.9743435 1-A 16713.4550 90 326 416 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -92.06668 -15.84729 -11.44344 -11.44090 -11.43436 -11.39414 -11.38493 -11.37441 -11.37343 -11.37061 -11.35556 -11.35060 -11.34375 -11.34011 -11.33110 -11.33076 -11.32752 -11.31738 -11.31631 -11.30414 -11.30166 -11.30038 -11.29911 -11.29731 -9.07715 -6.75976 -6.75877 -6.75710 -1.49327 -1.29011 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1.0721 1.0837 1.0710 1.0921 1.0959 1.0947 1.0621 1.0610 1.0879 1.0713 1.1078 1.1102 1.1076 1.0876 1.0906 1.0900 1.0926 1.0956 1.0929 1.0990 1.0925 1.0946 1.1003 1.0775 0.0006 0.0015 0.0023 0.0044 0.0070 0.0120 0.0184 0.0290 0.0389 0.0550 0.0647 0.0702 0.0622 0.0799 0.2380 0.1732 0.1695 0.1935 0.2825 0.3314 0.3034 0.2726 0.3552 0.2686 0.4638 0.5871 0.6945 0.7292 0.7188 0.7624 0.7605 0.7298 0.7311 1.7033 2.1253 1.2375 0.6876 1.3194 2.1259 0.4676 0.7031 0.8339 1.1327 0.9594 1.6078 0.8017 1.0950 0.7153 0.8484 1.2738 0.8484 1.6041 1.5763 1.5387 1.1947 1.0007 1.1857 0.9327 1.4266 3.9108 1.2195 0.9922 2.2394 1.3234 1.2209 1.2895 1.8611 1.5594 2.0306 1.8794 1.4603 1.7485 2.1245 1.0033 1.9350 1.8177 1.2011 1.1000 1.1557 2.9392 1.5732 1.4342 2.1342 1.7155 1.6191 1.4866 1.4317 1.6194 1.5349 1.6391 1.6599 1.6911 1.8196 1.7599 2.3999 2.0359 2.0875 2.1037 2.5528 2.0406 2.0573 2.0049 1.9782 3.2348 4.1843 1.8088 2.0710 1.7172 1.7174 1.7585 1.7787 1.7759 3.5954 9.8626 9.3600 10.0749 15.1491 15.2095 6.3210 6.3886 6.4243 6.5570 6.5063 6.6993 6.7797 6.7979 6.6022 6.6622 6.8707 6.8154 7.1207 7.2171 7.3315 7.2266 7.2735 7.2813 7.3383 7.3944 7.4123 7.4663 7.4380 7.5312 7.7201 8.7076 0.9217 1.0581 0.3176 0.2899 0.3503 0.6850 0.5640 3.4598 1.4145 0.5682 0.3256 4.6377 1.8277 1.3934 4.0385 1.3168 1.2359 1.9451 3.1704 1.2662 0.0376 0.0742 0.1053 1.0505 2.3821 2.3415 2.8221 4.9824 1.1732 2.5950 0.7249 3.1370 2.6492 0.2277 7.1192 7.0878 25.6162 4.1084 1.6352 73.9063 31.9094 21.4691 8.5918 3.9830 31.1294 16.3712 4.1100 0.7054 3.6253 1.9543 13.3412 3.0899 28.6429 19.9417 10.5185 0.5019 2.7198 0.2999 1.4904 1.3910 10.3071 0.0593 8.8975 1.2277 2.8275 1.0918 8.2243 6.5090 10.2081 4.6016 1.9548 19.0007 1.2256 1.7134 2.0150 2.6371 9.0371 6.0896 1.3050 17.1924 0.1411 3.3757 0.9435 9.8719 12.8420 1.8863 16.7411 2.9438 1.3599 0.7861 14.4763 0.2754 0.4743 4.3674 0.7378 1.0001 22.7324 8.8531 2.0849 20.5823 37.1725 99.2854 90.0443 9.6543 18.7143 7.4298 19.6664 0.6112 2.2041 4.8618 8.4040 14.0535 15.8908 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102.7985 5.4037 8.8519 11.7744 13.7192 13.1339 2.2617 61.1586 6.4576 102.7235 237.6724 127.1572 90.4936 26.9274 204.7831 50.0524 54.8128 29.0840 90.1572 94.1325 91.4509 75.7918 43.8289 99.6995 56.5291 36.8972 57.6203 27.1026 110.3465 45.8402 94.0433 32.9147 65.3147 299.1538 57.7335 136.4335 186.0994 22.1221 0.7499 0.7500 0.6754 0.7495 0.6798 0.7111 0.7455 0.7312 0.5413 0.2504 0.5353 0.3562 0.2284 0.7394 0.7356 0.4850 0.5818 0.6771 0.4228 0.7496 0.4963 0.3848 0.4467 0.7487 0.7032 0.6305 0.1736 0.6337 0.4018 0.6339 0.3854 0.4710 0.7442 0.7499 0.2274 0.0722 0.7366 0.1401 0.6139 0.7284 0.1620 0.3395 0.1507 0.0396 0.7262 0.4282 0.1317 0.7486 0.7176 0.7377 0.4624 0.6973 0.5491 0.3508 0.6449 0.4708 0.4530 0.7032 0.1529 0.1360 0.6194 0.3142 0.7372 0.7239 0.2642 0.1226 0.6116 0.7324 0.4070 0.7187 0.7031 0.6025 0.3883 0.3023 0.1477 0.3108 0.4735 0.3738 0.5243 0.4811 0.6923 0.4885 0.1719 0.4065 0.1168 0.7148 0.7331 0.7347 0.5629 0.3047 0.5907 0.6465 0.7407 0.7489 0.4067 0.1451 0.6695 0.4657 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0.6355 0.4681 0.6499 0.6873 0.6090 0.6898 0.7919 0.4915 0.5871 0.5112 0.7494 0.4688 0.8285 0.8497 0.8509 0.5494 0.5538 0.8030 0.6648 0.4543 0.4235 0.6384 0.2259 0.2169 0.6856 0.2458 0.6337 0.5547 0.5885 0.2820 0.1053 0.8377 0.0958 0.8269 0.8535 0.6659 0.8250 0.6440 0.7023 0.7237 0.8494 0.5465 0.2013 0.7606 0.5006 0.3647 0.2693 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 6 6 6 6 6 6 6 6 6 6 6 1 6 6 7 1 6 6 6 6 6 6 6 6 6 16 1 1 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 12.00000 12.00000 12.00000 1.00783 12.00000 12.00000 14.00307 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 31.97207 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 1.00783 1.00783 2336.4465 29099.7685 29774.2317 1.00000 0.00307 0.00059 -0.00307 0.99999 0.00281 -0.00058 -0.00281 1.00000 1 0.03707 0.00298 0.00291 0.77243 0.06202 0.06061 20.19 32.00 42.86 61.10 82.82 96.98 134.88 154.17 179.39 247.88 250.80 259.18 297.68 342.67 424.07 442.10 456.99 485.62 515.70 561.95 580.31 624.54 654.54 677.37 723.53 765.90 818.08 829.40 835.99 849.87 875.22 887.71 918.62 978.64 1010.68 1038.99 1120.18 1156.61 1161.73 1183.91 1216.59 1229.02 1258.55 1293.44 1310.58 1352.12 1367.76 1377.14 1387.97 1413.14 1421.64 1425.37 1458.78 1474.30 1497.19 1509.34 1520.39 1528.19 1550.01 1567.03 1575.01 1587.78 1606.79 1629.34 1629.89 1632.32 1655.71 1674.16 1689.60 1707.13 1710.51 1715.11 1747.24 1752.02 1762.73 1774.95 1844.48 1878.92 1881.20 1898.90 1917.63 1934.39 1959.74 1987.99 1999.37 2013.24 2034.28 2081.01 2083.54 2096.93 2110.53 2120.44 2147.17 2163.78 2173.08 2188.83 2201.73 2209.91 2228.83 2238.23 2261.33 2287.76 2299.89 2318.79 2336.52 2341.06 2344.31 2352.40 2355.89 2370.81 2375.00 2389.59 2404.98 2527.74 2556.57 2602.30 2706.89 2717.15 4555.62 4581.29 4588.45 4610.62 4620.08 4642.44 4662.08 4670.91 4673.32 4697.05 4710.50 4727.76 4752.32 4779.04 4822.39 4831.81 4840.60 4844.69 4857.82 4869.69 4881.52 4885.54 4890.87 4916.67 4965.11 5328.52 0.467009 0.486934 0.487878 0.414651 -1299.507335 -1299.487409 -1299.486465 -1299.559692 2.456046D-04 MUNgauss RevisionA2.1 retrievium 08-May-2021 DUDE c1ccc(cc1)C2=CCC[C@H](C2)C[NH+]3CCC(=CC3)c4cccs4 C13738842 RHF 6-31G(d) (6D,10F) C1 336.178597 |X|Y|Z| 31.317290 24.609177 122.992014 45.595228 24 6 7 16 22 1 1 |36.858105| |13.756626|36.858105| |7.932800|13.755652|36.858105| |6.814346|7.888209|13.683001|36.858105| |7.934099|6.891914|7.963404|13.673175|36.858105| |13.750360|7.959889|6.890278|7.886366|13.762172|36.858105| |4.442193|5.034073|7.594753|12.760676|7.586267|5.031961|36.858105| |3.727216|4.351255|6.273817|7.728306|5.267721|3.970351|14.375904|36.858105| |2.886034|3.249340|4.232331|4.899868|3.855740|3.069539|7.587043|12.648455|36.858105| |2.664453|2.876800|3.605118|4.369315|3.709048|2.929030|6.626964|7.562628|12.458953|36.858105| |2.893188|3.102951|3.915703|4.900862|4.174564|3.227196|7.500228|6.712034|7.579824|12.427504|36.858105| |2.837025|3.122794|3.960387|4.655954|3.836568|3.060927|6.720498|6.319167|7.073459|8.881925|17.519084|0.500000| |3.694563|3.900950|5.108960|7.431186|6.240392|4.340591|12.545715|7.677058|6.399415|7.594080|12.408991|0.248338|36.858105| |2.515294|2.604658|3.104575|3.775535|3.514411|2.832892|4.940828|4.412541|4.892136|7.455781|12.449507|0.245937|7.662430|36.858105| |2.128890|2.222428|2.596952|2.995007|2.774457|2.330682|3.753883|3.608336|4.231575|6.050049|7.495576|0.193394|4.943935|12.640025|53.358707| |2.077638|2.191196|2.577755|2.946086|2.682821|2.254702|3.759143|3.797558|4.764250|7.066991|7.364677|0.191708|4.690174|9.290226|25.718614|0.500000| |2.056378|2.168596|2.511646|2.800659|2.569119|2.205202|3.388044|3.252150|3.681197|4.652283|5.886838|0.181766|4.255125|7.585101|17.291807|0.259224|36.858105| |1.787978|1.889147|2.154721|2.342514|2.156024|1.889982|2.769805|2.758204|3.178096|3.818628|4.258590|0.129573|3.256522|4.967772|10.465710|0.205457|12.528815|36.858105| |1.635163|1.703438|1.917907|2.097095|1.972013|1.741004|2.447533|2.436033|2.797500|3.395297|3.620668|0.102956|2.867973|4.409204|9.139294|0.180824|7.558994|12.573316|36.858105| |1.674697|1.725415|1.941521|2.160362|2.061509|1.808021|2.531005|2.489535|2.849703|3.585828|3.812491|0.102772|3.032722|4.983570|10.470292|0.196308|6.799377|7.706465|14.368959|36.858105| |1.896676|1.943517|2.212386|2.530127|2.427117|2.084335|3.029076|2.908188|3.315123|4.450733|4.977329|0.126188|3.834995|7.648161|17.319368|0.260721|7.776190|6.456493|7.611890|12.681370|36.858105| |1.457567|1.517239|1.686702|1.814783|1.713987|1.537000|2.074845|2.084607|2.367013|2.750231|2.852397|0.081555|2.355142|3.288882|6.028595|0.123631|4.930029|7.453363|12.918516|7.785376|4.932122|36.858105| |1.348597|1.391948|1.529903|1.642367|1.571465|1.423025|1.847430|1.842206|2.053862|2.359146|2.447850|0.069038|2.085863|2.825737|4.891439|0.098132|3.865322|5.063498|7.513993|6.171806|4.177199|14.097796|36.858105| |1.239553|1.281969|1.400081|1.486320|1.420479|1.297566|1.655745|1.664536|1.847403|2.069919|2.117143|0.060096|1.832406|2.364718|3.939686|0.080579|3.111200|3.968763|5.073533|4.287468|3.209923|8.195504|13.297589|36.858105| |1.244888|1.297482|1.421650|1.498620|1.418289|1.294916|1.675172|1.703303|1.906152|2.107717|2.131726|0.061286|1.832493|2.324508|3.874383|0.081078|3.101889|4.075237|4.853755|3.918952|3.017994|7.684366|8.248401|14.167029|36.858105| |1.387612|1.458857|1.619755|1.713592|1.600080|1.444420|1.950251|1.998949|2.283696|2.552064|2.576754|0.075236|2.146286|2.797138|4.870384|0.104561|4.017041|5.891734|6.778739|4.828477|3.638072|10.945848|7.456712|7.461812|11.057350|388.023441| |17.724911|8.908704|5.642470|4.922060|5.643491|8.907799|3.551999|3.090821|2.487129|2.316609|2.493313|0.068229|3.072448|2.217674|2.599836|0.051769|1.857374|1.634095|1.504376|1.538017|1.724461|1.352810|1.259687|1.163640|1.167491|9.183560|0.500000| |8.914712|17.720427|8.933337|5.628691|4.962109|5.653319|4.105844|3.763275|2.928482|2.575669|2.741193|0.077915|3.287941|2.329081|2.768542|0.055974|2.010638|1.777848|1.602289|1.609660|1.788300|1.440763|1.324415|1.228093|1.247720|9.943627|0.214634|0.500000| |5.650675|8.940119|17.723544|8.907619|5.654242|4.961681|7.030751|6.706643|4.566452|3.695999|3.930494|0.114905|4.766025|3.055752|3.564646|0.073184|2.569327|2.227271|1.958621|1.957541|2.204703|1.727855|1.556620|1.430163|1.463878|11.945410|0.124255|0.216271|0.500000| |5.656529|4.961571|5.646929|8.876562|17.710984|8.966500|6.994259|4.925532|3.822510|3.896482|4.418327|0.107719|6.765518|3.860344|4.033716|0.078834|2.672215|2.223243|2.059992|2.189655|2.626078|1.777374|1.634100|1.466981|1.454810|11.649464|0.124412|0.107674|0.123981|0.500000| |8.912964|5.653580|4.961157|5.627053|8.933359|17.719440|4.103495|3.343145|2.702779|2.643146|2.896157|0.075684|3.777435|2.635927|2.975850|0.058452|2.061984|1.778169|1.658310|1.733372|1.994504|1.470663|1.372539|1.252343|1.243248|9.780797|0.214650|0.124176|0.107674|0.217081|0.500000| |3.874402|4.707307|6.781826|7.165936|4.933611|3.938767|9.184675|17.705723|8.651875|5.471426|4.877540|0.132743|5.506557|3.532611|4.099946|0.088029|2.780998|2.429077|2.165567|2.196142|2.504559|1.890410|1.684763|1.540187|1.582017|13.071837|0.089561|0.115333|0.214410|0.122817|0.091418|0.500000| |2.692133|3.083796|3.964242|4.293002|3.383440|2.785659|6.068142|8.929672|17.494519|8.821158|6.561846|0.198243|5.308186|4.461615|5.617151|0.130713|3.800189|3.362577|2.873824|2.835794|3.194565|2.451222|2.102778|1.904482|1.991745|17.215125|0.065180|0.079126|0.124352|0.091381|0.068291|0.202084|0.500000| |2.673601|2.973066|3.731932|4.206483|3.457883|2.829135|5.819365|8.938523|17.553716|8.862481|5.536511|0.141747|4.942187|4.064064|4.970518|0.115212|3.165137|2.838106|2.575598|2.640003|3.010692|2.222958|1.947362|1.768479|1.827840|15.403138|0.064863|0.075361|0.110699|0.095863|0.070159|0.215309|0.305024|0.500000| |2.321327|2.499039|3.041441|3.520302|3.063974|2.511660|4.860697|5.540831|8.882397|17.476739|8.686479|0.207302|5.478758|6.790437|9.129687|0.253143|5.035641|4.350620|3.887728|4.065732|4.891598|3.113419|2.612282|2.281710|2.344641|20.667420|0.057015|0.063377|0.087753|0.088872|0.063850|0.122684|0.221405|0.208815|0.500000| |2.644966|2.783298|3.413049|4.235019|3.781775|2.973081|6.106924|6.588599|8.844899|17.522097|8.870425|0.174263|7.019976|6.785032|7.268404|0.165979|4.003910|3.353526|3.132450|3.426809|4.323806|2.570608|2.250556|1.976273|1.989262|16.757393|0.064079|0.068733|0.094179|0.114649|0.075634|0.139520|0.174176|0.221011|0.302962|0.500000| |3.578192|3.592168|4.446084|6.463503|6.378027|4.407460|8.873871|6.161788|5.381326|6.659782|8.828251|0.174886|17.492476|7.260903|6.325779|0.121426|3.832775|2.999715|2.747622|2.990953|3.853283|2.267911|2.036928|1.785645|1.767878|14.519783|0.083604|0.084007|0.111773|0.222063|0.110617|0.131797|0.121937|0.125358|0.138415|0.200619|0.500000| |3.868575|4.037549|5.130114|7.091092|6.289012|4.534409|8.920040|5.834007|4.905140|5.529642|8.828772|0.220690|17.545168|6.880102|6.316262|0.117203|4.289323|3.227334|2.808542|2.934955|3.662117|2.316418|2.064899|1.813741|1.806638|14.949899|0.089496|0.094416|0.130689|0.183085|0.109731|0.127663|0.122579|0.109432|0.122743|0.141311|0.304256|0.500000| |2.447423|2.486945|2.920442|3.593697|3.473301|2.802637|4.594983|4.133849|4.556396|6.957592|8.834052|0.173770|6.795123|17.612636|12.400843|0.212386|5.629030|4.174394|4.012911|4.795229|7.592868|3.076274|2.708516|2.273444|2.211297|18.509856|0.060211|0.061580|0.078604|0.109683|0.073612|0.093376|0.111146|0.110383|0.175275|0.207001|0.210705|0.162335|0.500000| |2.577602|2.636562|3.091366|3.737529|3.573899|2.917197|4.600938|3.926425|4.065865|5.450913|8.749835|0.207388|7.156445|17.609624|12.431236|0.182833|7.358608|4.690804|4.134422|4.588777|6.679676|3.140476|2.751759|2.303317|2.242294|18.853659|0.063339|0.065392|0.083388|0.109150|0.075951|0.089592|0.105521|0.095108|0.137991|0.141017|0.188897|0.210823|0.301817|0.500000| |2.038981|2.121364|2.418811|2.698934|2.534322|2.197909|3.161989|2.947106|3.195453|3.937670|5.072055|0.150824|4.014795|6.844334|12.472933|0.182595|17.617305|8.799580|6.621426|6.330528|7.333217|4.586267|3.809235|3.042916|2.949028|25.801535|0.051430|0.054580|0.067755|0.073682|0.057634|0.070779|0.089972|0.077250|0.113311|0.098073|0.102811|0.117519|0.147463|0.216479|0.500000| |2.226846|2.389488|2.813653|3.110651|2.773629|2.364710|3.816415|3.664865|4.112831|5.002337|6.684707|0.239979|4.738268|7.222528|12.320396|0.217247|17.663121|8.804032|5.518877|4.966075|5.645002|4.054358|3.261186|2.743323|2.796382|25.547489|0.055451|0.061551|0.081158|0.078660|0.060541|0.086279|0.121676|0.095095|0.145471|0.114147|0.112171|0.134758|0.144185|0.196387|0.301344|0.500000| |1.720518|1.818472|2.051532|2.196352|2.028865|1.802556|2.536075|2.507330|2.807892|3.238595|3.647589|0.112848|2.930282|4.121985|7.643458|0.146685|8.977576|17.580231|8.897905|5.868083|4.982410|6.985544|5.022612|4.066697|4.213090|42.110496|0.043948|0.047897|0.059023|0.057620|0.047203|0.062236|0.083134|0.069971|0.099138|0.079793|0.074824|0.082640|0.097478|0.113762|0.219617|0.207559|0.500000| |1.781849|1.903393|2.185966|2.354022|2.133239|1.868247|2.812399|2.886739|3.430847|4.030410|4.252493|0.132121|3.206516|4.574315|9.049569|0.205289|8.841061|17.517029|8.869444|6.125049|5.345536|6.529308|4.481979|3.741151|4.055254|44.415923|0.045171|0.049988|0.063623|0.060562|0.048522|0.070939|0.103967|0.085455|0.132667|0.096033|0.081111|0.086441|0.108020|0.115357|0.173492|0.219158|0.304913|0.500000| |1.558624|1.594833|1.776579|1.969441|1.900864|1.682955|2.273274|2.242210|2.542254|3.131649|3.238941|0.086290|2.675728|4.093649|7.577044|0.147883|4.923336|5.506044|9.119347|17.735333|8.720668|7.136736|6.607320|4.534786|3.950509|31.998575|0.040000|0.041439|0.049549|0.056247|0.045167|0.055607|0.069738|0.066712|0.097478|0.085453|0.074632|0.071804|0.114874|0.106078|0.132637|0.107817|0.127506|0.131134|0.500000| |1.888049|1.924117|2.188845|2.525260|2.442637|2.089861|3.035714|2.944659|3.392380|4.644944|4.822359|0.116664|3.796135|7.015550|12.418400|0.230905|5.662613|4.961388|5.802792|8.900243|17.609536|4.209670|3.690139|2.934382|2.770695|23.217080|0.047669|0.049025|0.060263|0.074281|0.055787|0.070513|0.088484|0.087557|0.142348|0.132876|0.109840|0.097433|0.228229|0.160739|0.146404|0.126926|0.110391|0.124037|0.216338|0.500000| |1.924907|1.949303|2.196696|2.521966|2.468191|2.131611|2.950107|2.751752|3.013225|3.921013|4.612993|0.117056|3.796561|7.249787|12.416736|0.182676|6.884851|5.431821|6.090778|8.799873|17.576696|4.301015|3.854482|2.992049|2.765366|22.823136|0.048749|0.049675|0.060098|0.074832|0.057150|0.066169|0.080184|0.075807|0.113273|0.107460|0.107892|0.104347|0.203239|0.204658|0.213655|0.144140|0.126542|0.122997|0.197163|0.302330|0.500000| |1.350052|1.383201|1.514489|1.635202|1.580306|1.432798|1.829873|1.805037|1.991563|2.304828|2.417769|0.067299|2.085193|2.849999|4.852416|0.094746|3.744996|4.562488|6.675258|6.338160|4.355357|8.904991|17.742865|8.608066|5.740279|37.683818|0.035072|0.036444|0.042488|0.045940|0.038591|0.045773|0.055967|0.052419|0.069934|0.061836|0.057184|0.057603|0.076946|0.078144|0.106386|0.086975|0.124604|0.109263|0.203661|0.106876|0.116001|0.500000| |1.167752|1.202517|1.304639|1.381854|1.329096|1.221582|1.525515|1.528892|1.680543|1.869373|1.911420|0.053965|1.680306|2.127138|3.454379|0.070205|2.693122|3.281809|4.046951|3.621344|2.825435|5.715284|8.597821|17.759717|8.918099|37.729323|0.030574|0.032055|0.036899|0.038143|0.032889|0.039498|0.047875|0.044895|0.056620|0.050006|0.045756|0.046326|0.057343|0.057977|0.074296|0.066761|0.093674|0.086045|0.108557|0.072852|0.074646|0.202055|0.500000| |1.179380|1.230791|1.342719|1.405321|1.329400|1.220498|1.560372|1.593676|1.775167|1.931776|1.939910|0.055883|1.686299|2.079725|3.385826|0.071192|2.693935|3.418123|3.855818|3.226991|2.594371|5.407694|5.690313|8.764106|17.790981|55.493202|0.030823|0.033027|0.038496|0.037720|0.032561|0.041446|0.051692|0.047577|0.059341|0.050729|0.045166|0.046184|0.055115|0.055803|0.071241|0.069008|0.098712|0.096595|0.090347|0.067125|0.066598|0.122640|0.203543|0.500000| 1299.127362 -7023.519082 2580.536613 -155.156341 -3299.011449 1999.037077 -1299.974371 2.000652 408B000000000001 435BBDBB29BD60B7 42E39E37FB92A767 4234DEFEAE000003 37C16C2614EA07FF 43D86456CB58A177