Version2.4 2021-05-29T07:45:33Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 08-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE c1ccc(c(c1)CS(=O)(=O)[C@@H]2NN[C@@H](O2)CCCNS(=O)(=O)c3ccc4c(c3)oc(n4)[O-])F C38794385 RHF 6-31G(d) (6D,7F) c1ccc(c(c1)CS(=O)(=O)[C@@H]2NN[C@@H](O2)CCCNS(=O)(=O)c3ccc4c(c3)oc(n4)[O-])F C01[X(C19H20F1N4O7S2)] 153 C1 543 [O-]c1nc2c(o1)cc(cc2)S(=O)(=O)NCCC[C@H]1NN[C@H](O1)S(=O)(=O)Cc1ccccc1F [O-]c1nc2c(o1)cc(cc2)S(=O)(=O)NCCC[C@H]1NN[C@H](O1)S(=O)(=O)Cc1ccccc1F [O-]c1oc2cc(ccc2n1)[S](=O)(=O)NCCC[C@H]3NN[C@H](O3)[S](=O)(=O)Cc4ccccc4F InChIKey=PAABACCNPCOXIZ-PKOBYXMFSA-M InChI=1S/C19H21FN4O7S2/c20-14-5-2-1-4-12(14)11-32(26,27)19-24-23-17(31-19)6-3-9-21-33(28,29)13-7-8-15-16(10-13)30-18(25)22-15/h1-2,4-5,7-8,10,17,19,21,23-24H,3,6,9,11H2,(H,22,25)/p-1/t17-,19+/m0/s1 InChI=1/C19H21FN4O7S2/c20-14-5-2-1-4-12(14)11-32(26,27)19-24-23-17(31-19)6-3-9-21-33(28,29)13-7-8-15-16(10-13)30-18(25)22-15/h1-2,4-5,7-8,10,17,19,21,23-24H,3,6,9,11H2,(H,22,25)/p-1/t17-,19+/m0/s1/fC19H20FN4O7S2/q-1 c1ccc(c(c1)CS(=O)(=O)[C@@H]2NN[C@@H](O2)CCCNS(=O)(=O)c3ccc4c(c3)oc(n4)[O-])F C01[X(C19H20F1N4O7S2)] 153 C01 543 [O-]c1nc2c(o1)cc(cc2)S(=O)(=O)NCCC[C@H]1NN[C@H](O1)S(=O)(=O)Cc1ccccc1F O=[C]1[N][C]2[C]([CH][C]([CH][CH]2)[S@@]([O])(=O)NCCC[C@H]2NN[C@H](O2)[S]([O])([O])C[C]2[CH][CH][CH][CH][C]2F)O1 [O][S]([O])(C[C]1[CH][CH][CH][CH][C]1F)[C@@H]2NN[C@H](CCCN[S]([O])(=O)[C]3[CH][CH][C]4[N]C(=O)O[C]4[CH]3)O2 InChIKey=JWFFLURABWXRHL-PKOBYXMFSA-N InChI=1S/C19H20FN4O7S2/c20-14-5-2-1-4-12(14)11-32(26,27)19-24-23-17(31-19)6-3-9-21-33(28,29)13-7-8-15-16(10-13)30-18(25)22-15/h1-2,4-5,7-8,10,17,19,23-24H,3,6,9,11H2,(H,21,28,29)/t17-,19+/m0/s1 InChI=1/C19H20FN4O7S2/c20-14-5-2-1-4-12(14)11-32(26,27)19-24-23-17(31-19)6-3-9-21-33(28,29)13-7-8-15-16(10-13)30-18(25)22-15/h1-2,4-5,7-8,10,17,19,23-24H,3,6,9,11H2,(H,21,28,29)/t17-,19+/m0/s1/f/h21H 3733.1628872122 -2367.3070034 1-A 26629.1999 130 413 543 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -92.12775 -92.09724 -26.27116 -20.54988 -20.50807 -20.50734 -20.47254 -20.44395 -20.44367 -20.36812 -15.56167 -15.54568 -15.49995 -15.38034 -11.31145 -11.28955 -11.27238 -11.23637 -11.22915 -11.21826 -11.20965 -11.20959 -11.19925 -11.19828 -11.18862 -11.17847 -11.16859 -11.16138 -11.14662 -11.13925 -11.13716 -11.13447 -11.10778 -9.10801 -9.06879 -6.79356 -6.79254 -6.79226 -6.75534 -6.75484 -6.75350 -1.59012 -1.42658 -1.40084 -1.36644 -1.33665 -1.29800 -1.24873 -1.24239 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40 41 42 43 44 45 46 47 48 49 50 51 52 53 6 6 6 6 6 6 6 16 8 8 6 1 7 7 6 1 8 6 6 6 7 16 8 8 6 6 6 6 6 6 8 6 7 8 9 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 31.97207 15.99491 15.99491 12.00000 1.00783 14.00307 14.00307 12.00000 1.00783 15.99491 12.00000 12.00000 12.00000 14.00307 31.97207 15.99491 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 14.00307 15.99491 18.99840 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 9845.8038 44044.4947 46328.4299 0.99999 -0.00327 -0.00388 0.00343 0.99917 0.04049 0.00374 -0.04050 0.99917 1 0.00880 0.00197 0.00187 0.18330 0.04098 0.03896 7.13 15.78 22.34 29.72 36.31 49.73 71.92 87.51 106.84 113.02 144.58 157.70 195.61 214.34 227.27 245.87 260.38 282.84 328.31 341.61 359.10 360.95 378.24 417.45 444.44 451.54 478.13 499.35 513.22 551.32 602.74 608.39 646.73 673.05 683.95 695.95 721.42 749.09 790.18 829.18 832.87 848.57 853.55 856.26 895.37 925.61 966.38 967.24 980.50 1042.88 1050.65 1122.25 1132.61 1135.12 1145.13 1145.79 1176.28 1204.74 1218.02 1238.50 1268.71 1276.42 1286.73 1309.27 1332.94 1337.11 1343.60 1387.53 1393.64 1410.10 1435.65 1442.96 1451.36 1465.29 1535.28 1553.14 1553.82 1602.39 1615.93 1628.80 1635.51 1658.03 1660.90 1705.72 1728.68 1729.97 1740.80 1742.37 1744.60 1756.50 1799.67 1825.19 1826.85 1836.78 1841.07 1878.42 1886.36 1918.56 1941.70 1972.10 2005.08 2007.64 2013.93 2024.34 2026.43 2056.98 2061.77 2076.22 2078.80 2086.91 2094.26 2117.65 2142.96 2164.35 2178.44 2230.43 2269.18 2303.75 2309.24 2312.86 2325.22 2340.15 2345.08 2369.22 2370.82 2401.93 2413.91 2422.78 2504.69 2580.13 2582.10 2618.13 2847.30 4584.17 4598.11 4625.50 4678.01 4699.29 4709.42 4728.05 4734.36 4754.15 4819.98 4845.92 4853.47 4866.05 4880.52 4884.29 4900.05 4904.17 5330.07 5450.64 5495.27 0.430079 0.457608 0.458552 0.364444 -2366.876925 -2366.849396 -2366.848452 -2366.942560 3.156398D-04 MUNgauss RevisionA2.1 retrievium 29-May-2021 DUDE c1ccc(c(c1)CS(=O)(=O)[C@@H]2NN[C@@H](O2)CCCNS(=O)(=O)c3ccc4c(c3)oc(n4)[O-])F C38794385 RHF 6-31G(d) (6D,10F) C1 499.075746 |X|Y|Z| 46.448326 58.042922 145.266023 73.163498 27 6 7 8 16 19 4 2 2 |36.858105| |13.738571|36.858105| |7.929040|13.771606|36.858105| |6.940093|8.018737|13.821818|36.858105| |7.892498|6.834276|7.865900|13.771890|36.858105| |13.772283|7.950378|6.872669|8.026148|13.700360|36.858105| |5.006951|4.437027|5.021630|7.595421|12.647671|7.520105|36.858105| |4.085962|3.651341|3.980857|5.288960|6.991748|5.527613|10.627196|388.023441| |3.839817|3.671962|4.183364|5.458917|6.083378|4.751483|7.208307|93.951258|73.516695| |4.200339|3.533684|3.578141|4.377417|5.890263|5.662919|7.209968|93.799065|13.618325|73.516695| |3.002558|2.756071|2.992935|3.763920|4.502216|3.780488|6.637641|74.189253|12.759610|12.930656|36.858105| |2.940543|2.640120|2.795762|3.446768|4.231170|3.724251|6.142171|57.270353|9.618077|12.557836|17.608407|0.500000| |2.585770|2.412088|2.594937|3.123298|3.544359|3.105970|4.584900|49.912614|11.164427|10.415260|13.228407|0.251940|53.358707| |2.432964|2.344070|2.586716|3.104972|3.334890|2.850303|4.161190|41.098085|11.113888|8.052990|8.375996|0.165267|18.257391|53.358707| |2.407100|2.335336|2.616041|3.193078|3.402451|2.836429|4.407824|38.005336|9.554160|7.204261|8.344495|0.170761|11.831338|18.109513|36.858105| |2.167505|2.092035|2.305898|2.752669|2.945792|2.527880|3.738303|30.968898|7.465350|6.313356|6.821107|0.159152|10.167840|12.622035|17.624139|0.500000| |2.800837|2.658581|2.979185|3.787419|4.265506|3.442108|6.220126|51.631346|10.967198|8.970208|13.895369|0.258065|11.650394|11.413009|13.161265|0.259399|73.516695| |2.325033|2.327499|2.676693|3.242564|3.253656|2.672153|3.984065|31.139692|8.536303|5.965498|5.407350|0.120234|7.261898|10.473943|12.591849|0.244690|13.942993|36.858105| |2.194200|2.207106|2.537864|3.043947|3.027308|2.501875|3.668801|25.908648|6.666512|5.145252|4.402320|0.106137|5.536014|6.781057|7.528195|0.191909|11.324525|12.450124|36.858105| |2.046338|2.107533|2.445943|2.847934|2.715485|2.269717|3.098936|21.382353|5.683838|4.369173|3.343926|0.082443|4.300871|5.175741|4.901577|0.126468|7.719715|7.514442|12.485413|36.858105| |1.905406|1.959847|2.247630|2.571834|2.463696|2.095540|2.774576|18.504914|4.755592|3.886524|2.876776|0.073622|3.648339|4.163231|3.837627|0.104087|6.440846|5.007634|7.828091|13.082574|53.358707| |1.768918|1.848273|2.116461|2.348136|2.200086|1.901665|2.379548|15.741063|4.087182|3.378060|2.348637|0.060756|3.006055|3.374355|2.931336|0.078988|5.004201|3.653349|4.770012|7.073405|15.601687|388.023441| |1.650887|1.710902|1.928214|2.120556|2.016726|1.770309|2.178777|14.286628|3.629277|3.118429|2.144860|0.056617|2.734099|2.994483|2.584916|0.071217|4.502415|3.053931|3.929812|5.008346|10.628123|94.370951|73.516695| |1.929485|2.053509|2.398251|2.646410|2.404982|2.056677|2.542038|16.482306|4.341803|3.512627|2.371711|0.060913|2.999618|3.358170|2.867446|0.074977|5.007015|3.585289|4.422411|6.337052|10.513288|94.421879|13.575079|73.516695| |1.588304|1.659735|1.880211|2.054009|1.929580|1.692297|2.067717|14.167554|3.738974|3.079966|2.116046|0.054545|2.796352|3.181071|2.679066|0.072859|4.406944|3.329799|4.014723|5.762265|9.409868|77.734413|13.046056|13.054084|36.858105| |1.440211|1.491713|1.665261|1.809120|1.724838|1.532982|1.853259|12.814225|3.341460|2.825889|1.938000|0.050537|2.587132|2.910030|2.430404|0.067704|3.985510|2.910035|3.458990|4.496926|7.354571|49.950011|11.468726|8.817422|13.692435|36.858105| |1.335679|1.382358|1.531911|1.650088|1.576830|1.414198|1.683553|11.826763|3.102472|2.633821|1.783222|0.046520|2.419236|2.723482|2.222074|0.062104|3.605359|2.618069|2.964357|3.675600|5.489422|33.758946|7.822597|6.771623|7.864283|13.751758|36.858105| |1.346140|1.401143|1.556971|1.668330|1.581947|1.418553|1.675327|11.885969|3.166086|2.645501|1.770801|0.045821|2.423635|2.755559|2.208716|0.060881|3.553044|2.626309|2.863454|3.564275|4.965556|29.953371|6.539123|6.505587|6.846086|7.960998|13.643680|36.858105| |1.468892|1.542269|1.734359|1.861494|1.741377|1.546571|1.835193|12.980675|3.508607|2.857649|1.909092|0.048879|2.599252|2.990005|2.398391|0.064741|3.855649|2.935721|3.174019|4.139980|5.526426|34.154479|6.857167|7.848679|8.085084|6.969998|7.892232|13.465089|36.858105| |1.608081|1.695269|1.930661|2.092889|1.941253|1.701656|2.054064|14.277280|3.855078|3.100227|2.095089|0.053417|2.802190|3.230940|2.653354|0.070804|4.310678|3.343090|3.766226|5.341156|7.284223|49.529938|8.756391|11.405714|13.461058|7.807114|6.709351|7.786417|14.065639|36.858105| |1.430427|1.507203|1.688831|1.794170|1.672770|1.495371|1.744319|12.488893|3.414799|2.768922|1.813593|0.046329|2.496028|2.872676|2.244712|0.060168|3.601769|2.706225|2.796615|3.477134|4.461510|26.214932|5.439737|6.397636|5.208932|4.695165|5.408125|8.601642|14.165738|7.814465|73.516695| |1.300171|1.360330|1.505848|1.593135|1.502257|1.357280|1.568595|11.302470|3.059748|2.536604|1.653610|0.042597|2.294787|2.614269|2.025133|0.055106|3.249001|2.374667|2.445135|2.919588|3.825080|22.005415|4.804101|5.223627|4.241011|4.255581|5.403989|8.877439|8.654395|5.390619|24.086077|36.858105| |1.260690|1.311092|1.446323|1.537467|1.461425|1.321753|1.538024|11.025389|2.945706|2.478027|1.634116|0.042372|2.260292|2.559099|2.009135|0.055440|3.228182|2.341124|2.472111|2.950099|4.001614|23.198966|5.199579|5.260488|4.645386|5.164348|7.641249|14.237241|8.437566|5.366929|14.963224|14.156052|53.358707| |1.247852|1.306174|1.437931|1.510111|1.424884|1.296102|1.478041|10.723329|2.912496|2.425323|1.557352|0.040170|2.174676|2.465374|1.878525|0.051019|3.021922|2.168066|2.187118|2.541430|3.295921|18.601826|4.120119|4.509054|3.370678|3.358762|4.067207|5.729720|5.741060|4.140008|15.152917|15.930254|11.200122|73.516695| |4.679278|5.321235|8.195574|14.363598|8.162185|5.313295|6.826944|35.905686|9.917133|6.961944|3.883239|0.095730|4.413946|4.601341|3.596731|0.084461|7.448296|3.868223|3.656421|3.481737|4.178621|19.766021|4.345631|5.714561|2.391058|2.062209|1.860624|1.885741|2.136723|2.449515|3.632155|1.785875|2.339617|2.983262|97.533100| |17.729592|8.901350|5.641545|4.987719|5.629590|8.930133|4.083593|25.057003|5.847637|6.738292|2.693170|0.074472|3.216275|3.001876|2.167207|0.054938|4.426906|2.079015|1.968801|1.840287|2.350373|11.460312|2.695944|3.098406|1.458506|1.333302|1.242788|1.251475|1.356810|1.474395|2.355338|1.212554|1.602824|2.076229|8.329912|0.500000| |8.905189|17.721766|8.946129|5.685273|4.932210|5.649919|3.548596|21.688392|5.517988|5.327889|2.391486|0.063943|2.909008|2.844607|2.075318|0.052162|4.119046|2.081727|1.985173|1.920884|2.450367|12.245024|2.847297|3.401075|1.560357|1.408087|1.311601|1.332754|1.463852|1.599014|2.556844|1.302775|1.705653|2.233567|9.633446|0.214348|0.500000| |5.622600|8.839000|17.746087|8.985524|5.635941|4.954640|4.116120|24.299730|6.585514|5.429126|2.689857|0.069439|3.242672|3.302697|2.464497|0.060588|4.858521|2.587189|2.473837|2.450532|3.073521|15.434243|3.492608|4.450410|1.936591|1.703399|1.568451|1.603536|1.799973|2.008110|3.129933|1.560374|2.027975|2.651493|16.843380|0.123580|0.213038|0.500000| |8.926225|5.651436|4.952762|5.689901|8.942772|17.728528|6.979443|39.625918|7.910575|11.421389|3.920458|0.111798|4.360650|3.865327|2.805579|0.070451|6.107652|2.569583|2.405564|2.152254|2.718624|12.800644|3.004894|3.408131|1.609063|1.471147|1.360894|1.359697|1.470430|1.608500|2.524804|1.298147|1.728434|2.205747|9.616186|0.215399|0.124181|0.107569|0.500000| |4.664953|3.963308|4.218041|5.710696|8.847093|6.963223|17.595994|57.940600|9.635316|12.204732|6.316855|0.185339|5.891358|5.122501|4.031500|0.099417|10.182183|3.545269|3.378449|2.839039|3.557749|15.955629|3.727679|4.192015|1.946894|1.767531|1.606083|1.584621|1.715716|1.909997|2.888723|1.474435|1.982645|2.470357|11.495808|0.110508|0.090250|0.097694|0.205699|0.500000| |4.183730|3.977690|4.749585|7.209169|8.840661|5.591346|17.654427|57.828981|11.810365|9.658900|6.479181|0.159125|6.148509|5.943437|4.980626|0.114860|12.888586|4.720064|4.472759|3.707178|4.465627|19.547828|4.416719|5.257331|2.333865|2.064501|1.851670|1.835404|2.025141|2.303178|3.384269|1.696073|2.268790|2.817370|17.827613|0.096288|0.090570|0.113586|0.141422|0.300153|0.500000| |2.619430|2.424169|2.566635|3.034364|3.455405|3.119500|4.264567|48.507845|11.230539|11.423132|9.131200|0.202608|25.937847|12.831683|6.141363|0.151113|10.881127|4.359506|3.408965|2.773712|3.238376|14.282212|3.258147|3.592014|1.887964|1.751837|1.652733|1.667053|1.786757|1.909132|3.084238|1.602089|2.135537|2.721636|6.910416|0.067100|0.059911|0.065251|0.090188|0.111690|0.112059|0.500000| |2.622684|2.556515|2.861440|3.459791|3.644189|3.062026|4.434358|45.316487|14.503629|8.480339|7.415509|0.146362|13.015608|25.778455|9.548824|0.183829|13.030540|7.456893|4.745421|3.805079|4.105680|17.714688|3.881522|4.509562|2.350927|2.120732|1.986691|2.033984|2.240481|2.430395|3.865158|1.957664|2.575858|3.294640|8.571443|0.065341|0.062999|0.074655|0.083085|0.106626|0.128824|0.230635|0.500000| |2.567627|2.609727|3.078389|3.800235|3.695050|2.949446|4.440625|34.443826|10.252781|6.359751|5.309625|0.116015|6.866105|9.535023|8.958846|0.173988|12.802948|17.538711|8.816452|6.854837|6.303953|25.457498|5.244118|6.607213|3.237730|2.767395|2.495832|2.545523|2.911038|3.348405|4.846701|2.354872|3.103847|3.848215|10.664654|0.062878|0.064303|0.082978|0.077093|0.104699|0.148839|0.119383|0.221925|0.500000| |2.099979|2.112450|2.401904|2.822965|2.806109|2.367924|3.302752|26.324080|7.370200|5.285173|4.445781|0.102018|6.491557|9.651273|9.020627|0.210614|10.121047|17.537059|8.817342|6.865466|6.303498|24.979656|5.200120|6.013123|3.405937|3.013819|2.776093|2.832747|3.163291|3.506268|5.239897|2.595275|3.464495|4.211975|7.428426|0.052724|0.053170|0.065244|0.063485|0.082824|0.104336|0.112487|0.190074|0.301960|0.500000| |1.999274|1.990555|2.242960|2.642311|2.676247|2.270345|3.230058|23.196414|5.810134|4.768594|4.101147|0.102395|5.324933|6.345841|6.927615|0.208949|10.109268|8.860260|17.493568|8.867054|9.726281|31.466574|6.849812|6.880829|3.859030|3.503443|3.020666|2.850909|3.048007|3.511919|4.747643|2.392547|3.358480|3.800467|6.888612|0.050443|0.050114|0.060570|0.061582|0.085325|0.105416|0.090854|0.117421|0.173378|0.211759|0.500000| |2.384886|2.385542|2.758473|3.382350|3.402231|2.759865|4.249991|28.063358|6.918101|5.493234|4.723093|0.116011|5.501703|6.285366|6.856699|0.172261|12.672877|8.822137|17.581048|8.910236|9.809061|32.604990|6.983116|7.848125|3.633326|3.142708|2.676456|2.564813|2.827347|3.363574|4.457580|2.204015|3.032767|3.531680|9.206184|0.058999|0.059015|0.073847|0.073560|0.109451|0.151242|0.094024|0.123384|0.210883|0.173118|0.303151|0.500000| |2.203197|2.307962|2.738831|3.200252|2.952044|2.428743|3.293504|22.254858|6.070878|4.497693|3.303560|0.080760|4.185941|5.003826|4.538478|0.111953|7.473610|6.824427|8.861329|17.622439|12.606613|48.214707|8.314807|13.167572|5.405894|4.060220|3.378948|3.382859|4.088953|5.418136|6.263080|2.884028|3.860054|4.504865|9.167503|0.054507|0.058272|0.077254|0.062923|0.081875|0.110840|0.076090|0.106402|0.203742|0.168536|0.173894|0.214450|0.500000| |1.889520|1.946777|2.235568|2.555772|2.440735|2.075393|2.744287|19.606027|5.299573|4.076677|3.067941|0.075632|4.113283|5.055890|4.568653|0.120362|6.820516|6.902185|8.819019|17.508592|12.242681|44.469458|8.023922|9.677548|6.260994|4.940263|4.175693|4.165351|4.914846|6.188972|7.242446|3.381322|4.641402|5.150994|6.885374|0.047566|0.049712|0.062529|0.054916|0.070071|0.088428|0.074544|0.103128|0.171208|0.207112|0.210449|0.173840|0.301880|0.500000| |1.777785|1.810078|2.044646|2.325392|2.267933|1.956844|2.570357|17.403739|4.410238|3.708038|2.772084|0.071905|3.561633|4.027851|3.715715|0.105131|6.150160|4.622730|7.074187|9.190319|25.897599|61.508384|13.374519|10.201903|6.358828|5.659430|4.208099|3.648053|3.846699|4.771866|5.518717|2.745521|4.008896|4.204261|6.092287|0.045113|0.046343|0.056674|0.052397|0.068389|0.082968|0.064378|0.079351|0.113856|0.122060|0.211484|0.177010|0.180888|0.214411|0.500000| |1.415361|1.457938|1.619027|1.761589|1.693320|1.510252|1.827955|12.537823|3.223854|2.777050|1.910442|0.050312|2.532023|2.810476|2.365700|0.066695|3.930688|2.773297|3.361778|4.189510|7.292414|47.896212|13.294703|8.193000|8.946261|17.728935|8.935478|5.653991|5.003623|5.595319|6.600486|3.466622|5.635083|5.065447|4.485067|0.036482|0.038204|0.045756|0.040436|0.048896|0.056532|0.047501|0.056402|0.072580|0.078448|0.096757|0.086647|0.103634|0.121824|0.165873|0.500000| |1.251634|1.289293|1.417458|1.521838|1.464895|1.323806|1.564160|11.016597|2.867891|2.475191|1.667774|0.043841|2.270541|2.530339|2.051628|0.057955|3.342139|2.361763|2.652313|3.152747|4.715570|27.892520|6.857685|5.696315|5.607424|8.878688|17.730646|8.862287|5.608999|4.867584|7.760320|4.676976|9.172399|6.590291|3.819786|0.032501|0.034060|0.040167|0.035560|0.041744|0.047449|0.043215|0.050941|0.062187|0.069419|0.076340|0.067185|0.080310|0.097591|0.102781|0.214342|0.500000| |1.732476|1.845309|2.129380|2.307626|2.104363|1.828377|2.205878|15.241451|4.174418|3.281193|2.194556|0.055501|2.913950|3.373897|2.756259|0.071965|4.517273|3.526366|3.885297|5.568611|7.109122|46.706448|8.053042|12.929839|8.756060|5.576690|4.869547|5.565937|8.951087|17.754039|12.196692|4.657949|5.914208|6.759108|6.183096|0.043845|0.048271|0.062133|0.047577|0.056291|0.069079|0.055279|0.071707|0.101818|0.101195|0.096723|0.097539|0.173319|0.171421|0.122998|0.123235|0.106124|0.500000| 2364.212413 -13070.766565 4857.114113 -251.030153 -6100.470192 3733.163156 -2367.307036 2.001309 40B5480000000004 454792999542126E 44C74CB37AD19D95 42556DC2B3780002 B8005563B39B677E 44835C633D1EE38B