Version2.1 2020-12-17T22:48:04Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 07-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE C[C@H](c1ccc(cc1)S(=O)(=O)N)[NH+](C)Cc2[nH]c(=O)c3c(n2)cc(s3)c4ccc(cc4)OC C22011303 RHF 6-31G(d) (6D,7F) C[C@H](c1ccc(cc1)S(=O)(=O)N)[NH+](C)Cc2[nH]c(=O)c3c(n2)cc(s3)c4ccc(cc4)OC C01[X(C23H25N4O4S2)] 168 C1 553 COc1ccc(cc1)c1cc2c(s1)c(=O)[nH]c(n2)C[NH+]([C@@H](c1ccc(cc1)S(=O)(=O)N)C)C COc1ccc(cc1)c1cc2c(s1)c(=O)[nH]c(n2)C[NH+]([C@@H](c1ccc(cc1)S(=O)(=O)N)C)C COc1ccc(cc1)c2sc3C(=O)NC(=Nc3c2)C[NH+](C)[C@H](C)c4ccc(cc4)[S](N)(=O)=O InChIKey=GOLCZNZGULDLBI-CQSZACIVSA-O InChI=1S/C23H24N4O4S2/c1-14(15-6-10-18(11-7-15)33(24,29)30)27(2)13-21-25-19-12-20(32-22(19)23(28)26-21)16-4-8-17(31-3)9-5-16/h4-12,14H,13H2,1-3H3,(H2,24,29,30)(H,25,26,28)/p+1/t14-/m1/s1 InChI=1/C23H24N4O4S2/c1-14(15-6-10-18(11-7-15)33(24,29)30)27(2)13-21-25-19-12-20(32-22(19)23(28)26-21)16-4-8-17(31-3)9-5-16/h4-12,14H,13H2,1-3H3,(H2,24,29,30)(H,25,26,28)/p+1/t14-/m1/s1/fC23H25N4O4S2/h26-27H,24H2/q+1 C[C@H](c1ccc(cc1)S(=O)(=O)N)[NH+](C)Cc2[nH]c(=O)c3c(n2)cc(s3)c4ccc(cc4)OC C01[X(C23H25N4O4S2)] 168 C01 553 COc1ccc(cc1)c1cc2c(s1)c(=O)[nH]c(n2)C[NH+]([C@@H](c1ccc(cc1)S(=O)(=O)N)C)C CO[C]1[CH][CH][C]([CH][CH]1)[C]1S[C]2[C]([CH]=1)N=C(NC2=O)C[NH]([C@@H]([C]1[CH][CH][C]([CH][CH]1)S(=O)(=O)N)C)C CO[C]1[CH][CH][C]([CH][CH]1)C2=C[C]3N=C(C[NH](C)[C@H](C)[C]4[CH][CH][C]([CH][CH]4)[S](N)(=O)=O)NC(=O)[C]3S2 InChIKey=ZVORZTZPGNGXRV-CQSZACIVSA-N InChI=1S/C23H25N4O4S2/c1-14(15-6-10-18(11-7-15)33(24,29)30)27(2)13-21-25-19-12-20(32-22(19)23(28)26-21)16-4-8-17(31-3)9-5-16/h4-12,14,27H,13H2,1-3H3,(H2,24,29,30)(H,25,26,28)/t14-/m1/s1 InChI=1/C23H25N4O4S2/c1-14(15-6-10-18(11-7-15)33(24,29)30)27(2)13-21-25-19-12-20(32-22(19)23(28)26-21)16-4-8-17(31-3)9-5-16/h4-12,14,27H,13H2,1-3H3,(H2,24,29,30)(H,25,26,28)/t14-/m1/s1/f/h26H,24H2 3496.0554186972 -2197.5285602 1-A 28943.9350 127 426 553 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -92.30251 -92.07351 -20.65948 -20.64459 -20.64449 -20.64375 -15.84907 -15.75424 -15.71105 -15.68941 -11.49353 -11.48001 -11.46552 -11.45861 -11.43573 -11.40244 -11.39399 -11.38432 -11.38338 -11.37833 -11.37578 -11.37509 -11.37402 -11.37364 -11.37217 -11.36462 -11.34465 -11.33310 -11.32490 -11.32343 -11.31925 -11.30492 -11.29936 -9.27421 -9.08259 -6.96066 -6.96032 -6.95914 -6.76494 -6.76403 -6.76231 -1.57182 -1.52543 -1.49918 -1.49102 -1.45374 -1.44781 -1.35005 -1.31418 -1.30704 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16 6 6 6 6 6 6 8 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 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 31.97207 15.99491 15.99491 14.00307 14.00307 1.00783 12.00000 12.00000 12.00000 14.00307 1.00783 12.00000 15.99491 12.00000 12.00000 14.00307 12.00000 12.00000 31.97207 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 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 13466.1559 41508.1652 53185.7036 0.99976 0.02171 -0.00232 -0.02171 0.99976 -0.00000 0.00232 0.00005 1.00000 1 0.00643 0.00209 0.00163 0.13402 0.04348 0.03393 5.18 14.28 24.54 37.43 51.14 57.59 69.58 78.33 103.31 123.06 156.34 168.65 191.31 209.54 219.29 247.41 267.35 290.46 295.75 310.93 331.24 361.08 372.60 383.94 397.55 413.15 421.71 433.80 499.79 535.93 548.42 558.45 589.23 612.10 613.67 646.72 653.39 667.67 689.23 704.95 722.85 739.69 793.82 801.71 827.18 870.09 895.10 906.40 922.43 932.28 944.58 975.77 983.21 996.89 1007.21 1029.04 1058.49 1086.49 1104.39 1129.65 1155.45 1171.95 1187.43 1238.96 1250.98 1261.34 1324.97 1333.81 1358.49 1368.53 1380.39 1380.91 1418.55 1433.97 1483.43 1532.25 1551.27 1562.33 1584.86 1593.02 1595.41 1602.74 1613.94 1617.19 1663.84 1671.09 1678.96 1689.71 1708.44 1720.07 1725.67 1749.40 1756.78 1758.40 1817.88 1829.70 1835.08 1860.58 1873.54 1876.62 1894.84 1901.53 1902.66 1915.25 1929.09 1955.20 1964.04 2017.10 2046.18 2081.37 2083.85 2102.73 2106.06 2143.76 2158.07 2195.06 2241.61 2263.40 2272.22 2280.75 2300.67 2301.63 2306.60 2337.75 2345.63 2348.26 2352.26 2358.55 2376.02 2383.37 2385.29 2395.26 2404.48 2419.51 2453.09 2500.03 2537.08 2546.12 2550.23 2604.38 2608.39 2655.00 2883.48 4628.32 4659.60 4703.85 4721.02 4724.88 4730.52 4765.79 4777.51 4813.73 4824.39 4835.50 4837.22 4851.33 4856.26 4856.98 4892.72 4899.67 4910.82 4917.42 4918.44 4919.82 5091.17 5398.91 5504.01 5561.19 0.498314 0.527318 0.528262 0.431898 -2197.030246 -2197.001242 -2197.000298 -2197.096662 3.232064D-04 MUNgauss RevisionA2.0 retrievium 17-Dec-2020 DUDE C[C@H](c1ccc(cc1)S(=O)(=O)N)[NH+](C)Cc2[nH]c(=O)c3c(n2)cc(s3)c4ccc(cc4)OC C22011303 RHF 6-31G(d) (6D,10F) C1 485.131724 |X|Y|Z| 82.813911 146.279103 26.231750 68.239780 24 6 7 16 20 3 1 |36.858105| |12.440269|36.858105| |8.831082|17.611839|0.500000| |7.551920|12.551709|0.248177|36.858105| |5.324611|7.595625|0.206808|13.742491|36.858105| |4.028542|5.024401|0.134151|7.910214|13.732328|36.858105| |3.780246|4.446067|0.111626|6.883334|7.972927|13.788120|36.858105| |4.364740|5.006419|0.116559|7.911412|6.867919|7.906993|13.730377|36.858105| |6.176884|7.511792|0.155222|13.672045|7.936779|6.863357|7.969300|13.791045|36.858105| |2.820341|3.142330|0.081579|4.190878|4.728425|6.956924|10.713169|6.950589|4.731172|388.023441| |2.699619|2.882444|0.073485|3.709654|3.859311|4.998217|7.381921|6.519609|4.447492|94.926819|73.516695| |2.608530|2.885320|0.077498|3.708397|4.442954|6.531011|7.383940|4.988195|3.857619|94.955996|13.524138|73.516695| |2.502291|2.849035|0.074600|3.654870|4.043660|5.431425|7.054484|5.455427|4.053043|82.461624|13.675186|13.642484|53.358707| |7.577713|12.455119|0.253607|7.605372|5.370906|4.031817|3.766786|4.324921|6.101854|19.945564|4.634470|4.510194|3.647174|53.358707| |7.205438|9.142030|0.181161|6.854663|4.733610|3.773566|3.729005|4.524195|6.516526|19.963672|4.759083|4.422287|3.653006|25.481152|0.500000| |4.926057|7.501431|0.188911|6.579102|5.355627|4.189596|3.871373|4.250642|5.460615|20.752223|4.694968|4.673425|3.977947|17.326570|0.260420|36.858105| |6.282144|7.518043|0.197164|4.941680|3.973360|3.137933|2.925891|3.245841|4.188611|16.399470|3.857624|3.797845|3.021851|17.361903|0.264929|7.785748|36.858105| |4.991983|5.193809|0.129774|3.927155|3.187967|2.662700|2.586939|2.931617|3.673207|14.949033|3.601474|3.427012|2.782811|10.586282|0.230921|5.770944|12.572377|36.858105| |3.917798|3.941229|0.104302|3.114189|2.652826|2.265378|2.193475|2.429198|2.921337|13.033520|3.150313|3.028494|2.439045|7.025682|0.145469|4.308520|7.808893|14.129125|53.358707| |3.706589|3.763074|0.103916|2.958921|2.582237|2.197648|2.096019|2.278830|2.712306|12.511518|3.002197|2.940759|2.339795|6.423078|0.125613|4.044006|7.325955|9.268255|25.936052|0.500000| |3.202712|3.144095|0.082598|2.622136|2.265048|1.988015|1.958403|2.172533|2.545418|11.895044|2.912571|2.759560|2.238408|5.310096|0.114568|3.423656|5.035727|7.820027|18.371223|0.259251|36.858105| |2.753626|2.698434|0.072477|2.286242|2.019994|1.789950|1.755709|1.919628|2.208826|10.812434|2.646580|2.531384|2.038807|4.378430|0.092070|2.903502|4.059859|5.446140|11.489494|0.217943|16.018568|73.516695| |3.197666|3.113238|0.079150|2.674612|2.274927|2.022399|2.035459|2.303885|2.694452|12.394000|3.073075|2.837105|2.336905|5.269933|0.120964|3.406267|4.541763|7.108139|11.058233|0.162941|13.216888|14.232223|36.858105| |3.749270|3.676462|0.089790|3.168908|2.608275|2.305837|2.351235|2.733541|3.274245|14.064187|3.498314|3.170758|2.643844|6.469737|0.161031|4.056964|5.199797|8.433418|9.735842|0.144464|7.762915|9.455698|13.949993|36.858105| |4.879585|4.971226|0.117043|4.031131|3.183813|2.718338|2.730257|3.204251|4.043774|15.771413|3.860013|3.546212|2.940973|9.883642|0.269034|5.559017|7.959212|14.998178|11.159563|0.164562|6.640528|8.356453|7.898804|13.722352|53.358707| |3.269069|3.185046|0.077471|2.910791|2.419848|2.200874|2.303600|2.712423|3.149251|14.048868|3.562365|3.132636|2.653672|5.282349|0.131731|3.467556|3.902544|5.295830|6.354643|0.104170|5.164130|7.199876|8.195398|13.403898|10.419245|36.858105| |2.705241|2.618939|0.065445|2.412956|2.065132|1.902249|1.982448|2.282381|2.575343|12.376366|3.149441|2.790075|2.348724|4.199080|0.099340|2.827758|3.191292|4.181500|5.521458|0.093514|4.885359|7.260050|7.715345|8.253304|7.140751|14.014709|36.858105| |2.565600|2.480468|0.063564|2.223354|1.931285|1.760631|1.795562|2.021204|2.288037|11.214581|2.816879|2.569178|2.126106|3.985047|0.090554|2.677343|3.230143|4.346219|6.465423|0.109474|6.740951|10.423413|11.062942|7.431137|6.645481|7.395503|10.961202|388.023441| |2.319851|2.246154|0.056552|2.128631|1.852973|1.740213|1.833431|2.098506|2.301020|11.700292|3.014279|2.636517|2.230011|3.483080|0.080969|2.397485|2.584084|3.176786|4.203639|0.074256|3.582289|5.663721|4.871576|5.096173|5.190043|7.500196|12.928268|48.497336|36.858105| |2.005551|1.964762|0.050258|1.869963|1.657393|1.566569|1.640597|1.845362|1.995592|10.609956|2.722135|2.409714|2.040503|3.028415|0.068743|2.129731|2.268611|2.732923|3.721330|0.067209|3.200324|5.278013|4.093240|4.002853|4.270138|5.123345|7.602015|42.045384|13.615917|36.858105| |1.795016|1.757420|0.045161|1.696675|1.520294|1.453576|1.529909|1.709863|1.818595|10.043995|2.595375|2.285509|1.935328|2.657326|0.059759|1.883141|1.967126|2.299793|3.113710|0.057270|2.603612|4.366217|3.169189|3.150018|3.538782|3.890734|5.057172|29.729039|7.895650|13.873669|36.858105| |1.792015|1.740948|0.044507|1.700957|1.523401|1.467835|1.560200|1.752820|1.847028|10.315146|2.696736|2.337813|1.977775|2.592864|0.058545|1.828023|1.888816|2.174853|2.891942|0.053344|2.360438|3.925641|2.847882|2.928869|3.370557|3.660423|4.459404|25.188151|6.807434|7.930803|13.647311|36.858105| |2.002668|1.924809|0.048632|1.885966|1.668924|1.605856|1.721267|1.962925|2.078228|11.297971|2.977477|2.540896|2.146901|2.856610|0.065441|1.985881|2.056099|2.375169|3.096344|0.056580|2.497677|4.070917|3.069507|3.278247|3.763981|4.281774|5.058047|26.354981|7.871693|6.873802|7.923279|13.718696|36.858105| |2.310545|2.209543|0.055228|2.134429|1.856501|1.762815|1.883889|2.176387|2.356034|12.121032|3.172446|2.714793|2.293221|3.338222|0.077935|2.284746|2.412056|2.868192|3.700313|0.066235|3.017955|4.791564|3.899491|4.291859|4.695667|6.165357|7.669160|33.998784|13.729938|7.972094|6.903101|7.942907|13.747032|36.858105| |1.603046|1.561207|0.040191|1.537030|1.392268|1.352181|1.437436|1.598779|1.664040|9.627646|2.523972|2.192466|1.850381|2.297883|0.051310|1.632170|1.669800|1.887646|2.518004|0.047047|2.030764|3.421766|2.377826|2.430344|2.876179|2.918189|3.398358|20.364480|4.610039|5.315779|8.227106|14.250400|7.888546|5.214609|73.516695| |1.556520|1.508983|0.038815|1.500084|1.363712|1.334509|1.427607|1.587034|1.634862|9.651719|2.554676|2.196831|1.847064|2.190506|0.048829|1.552839|1.576309|1.756757|2.322560|0.043610|1.842872|3.098974|2.131756|2.209608|2.671273|2.625380|2.934684|17.622280|3.776096|3.987393|5.255382|8.009462|6.709777|4.511054|24.116179|36.858105| |17.587257|8.747404|0.172796|6.717851|4.660417|3.759875|3.746453|4.586636|6.600940|20.128107|4.957545|4.545408|3.424339|9.402930|0.214707|4.627478|5.651800|5.075545|5.333922|0.099302|3.308846|4.982412|3.450919|4.206080|7.392524|3.755093|3.031146|19.798490|2.588270|2.192727|1.955209|1.967736|2.235137|2.613873|3.103548|1.698104|0.500000| |17.608376|8.672995|0.213249|5.477743|4.289860|3.355382|3.130748|3.505964|4.614807|17.339750|4.161860|4.072985|2.999531|9.136074|0.173280|4.458844|6.838007|5.420941|5.995948|0.118186|3.516272|5.395514|3.385338|3.832243|6.704827|3.233729|2.722123|18.981178|2.309359|2.007055|1.786835|1.768725|1.962360|2.268238|2.810244|1.526387|0.301253|0.500000| |17.608347|8.938477|0.210185|7.111335|5.520190|4.250168|3.929986|4.389416|5.839710|20.919327|5.004674|4.927207|3.446066|7.542834|0.146128|4.096787|4.729778|3.895451|4.395775|0.086540|2.727440|4.274540|2.721947|3.115080|5.218531|2.808266|2.383027|16.074577|2.092806|1.827920|1.657905|1.667696|1.858981|2.109990|2.678301|1.475398|0.302473|0.303518|0.500000| |4.993256|7.045605|0.230171|8.896189|17.713638|8.948739|5.670063|4.949215|5.636950|27.833558|5.760238|6.928102|4.719474|6.884219|0.118746|5.084158|3.987383|3.110899|3.593341|0.072834|2.233635|3.576686|2.196994|2.468750|4.084906|2.257193|1.949756|13.220274|1.745411|1.574095|1.443251|1.437467|1.562393|1.733431|2.341511|1.286288|0.116351|0.117994|0.144761|0.500000| |3.399190|4.098411|0.114782|5.633368|8.894667|17.756728|8.930739|5.637029|4.950520|47.251974|8.192639|13.355285|7.274981|4.625140|0.087875|3.582101|2.767780|2.365435|2.797178|0.055952|1.816330|2.940327|1.832922|2.056151|3.246609|1.964776|1.723298|11.454699|1.587765|1.443506|1.346765|1.358279|1.474757|1.605026|2.238838|1.244625|0.087655|0.081468|0.100427|0.215543|0.500000| |3.766377|4.078646|0.096267|5.630979|4.952817|5.640363|8.915780|17.757065|8.914915|47.268404|13.318978|8.180127|7.339722|5.056636|0.111353|3.648028|2.899715|2.719466|3.105791|0.059081|2.082635|3.280078|2.243634|2.665444|4.126044|2.727000|2.308358|14.279490|2.159384|1.893805|1.769351|1.834965|2.071070|2.278627|2.982310|1.678796|0.113898|0.086481|0.104644|0.107522|0.124224|0.500000| |6.450988|6.906862|0.139509|8.839748|5.630973|4.946330|5.672113|8.991762|17.701667|27.879347|6.946019|5.762353|4.735618|8.544788|0.211053|5.229648|4.391334|4.070982|4.316935|0.079916|2.789724|4.237688|3.034492|3.818265|6.457604|3.731649|2.960463|18.224312|2.617293|2.221872|2.007705|2.047460|2.340796|2.702915|3.241687|1.787757|0.220378|0.134943|0.158761|0.123603|0.107477|0.216711|0.500000| |2.305782|2.626010|0.070204|3.283095|3.734170|4.948189|5.696148|4.397923|3.480439|60.969829|10.501079|13.595456|25.889216|3.365176|0.067889|2.715615|2.083272|1.910384|2.302483|0.045413|1.553090|2.531792|1.607605|1.798707|2.713893|1.793638|1.601297|10.420862|1.521485|1.402894|1.333148|1.357038|1.462200|1.555764|2.266351|1.270938|0.063612|0.057097|0.065031|0.092194|0.145785|0.118010|0.083737|0.500000| |2.336847|2.610809|0.067817|3.263540|3.457577|4.365022|5.655953|4.925237|3.715333|61.032013|13.650744|10.550017|25.889324|3.403131|0.070664|2.706119|2.093503|1.963028|2.352097|0.045838|1.602622|2.597406|1.687547|1.909837|2.852535|1.944439|1.729421|11.038161|1.659050|1.520710|1.451158|1.491272|1.619699|1.717947|2.489026|1.403832|0.066226|0.057533|0.065277|0.083208|0.117059|0.145798|0.091885|0.317410|0.500000| |4.134721|5.524457|0.141874|4.878796|4.120731|3.432196|3.274227|3.607646|4.417976|18.421239|4.245536|4.153304|3.604562|12.361402|0.224646|17.652405|7.413256|6.333303|6.505273|0.122096|3.816142|5.684466|3.806721|4.522179|8.323399|3.788559|3.085535|20.946401|2.577579|2.301563|2.011488|1.926616|2.076555|2.404221|3.040357|1.610136|0.111838|0.108456|0.096253|0.109968|0.083771|0.089743|0.123666|0.068718|0.069395|0.500000| |4.609932|6.822291|0.163853|7.442263|6.031100|4.901369|4.675198|5.227382|6.631641|24.218088|5.406412|5.288853|4.715621|12.260148|0.225737|17.714840|5.647476|4.650821|4.886384|0.092950|2.997156|4.569219|3.079907|3.712653|6.592382|3.350000|2.730416|17.845991|2.364843|2.096873|1.873385|1.838370|2.007901|2.293285|2.928622|1.578233|0.124511|0.111147|0.110454|0.147062|0.112660|0.121869|0.167805|0.087705|0.088444|0.300162|0.500000| |4.532300|6.903653|0.204015|6.038181|5.540435|4.242472|3.704933|3.830285|4.691675|20.134440|4.465246|4.667992|3.860963|12.288595|0.181125|17.640521|6.908834|4.878956|5.330397|0.107106|3.114567|4.832015|2.998832|3.411505|6.042013|2.935885|2.473648|17.058063|2.127755|1.919503|1.712787|1.661241|1.788097|2.029665|2.661465|1.428109|0.112866|0.116991|0.108826|0.158996|0.103943|0.090706|0.119868|0.074760|0.071988|0.298353|0.299507|0.500000| |4.863784|6.049775|0.176437|4.361666|3.750867|2.998546|2.750032|2.957781|3.663972|15.666896|3.641612|3.668614|2.935589|12.300615|0.189318|7.850178|17.625939|8.842450|9.588930|0.205020|4.679410|7.014600|4.066110|4.409169|8.232915|3.415186|2.886989|21.206059|2.376221|2.132046|1.859167|1.772581|1.902576|2.201674|2.806435|1.486785|0.120936|0.144576|0.109646|0.107988|0.074958|0.073475|0.103112|0.056865|0.056310|0.221226|0.151690|0.220086|0.500000| |7.280730|7.547843|0.212247|4.739807|3.885159|3.049561|2.810456|3.080496|3.942845|15.834882|3.737014|3.718761|2.864767|12.222944|0.199919|5.790355|17.673225|8.912130|9.356406|0.194077|4.635463|6.906672|4.091770|4.494295|8.487831|3.482214|2.925190|21.343671|2.405702|2.119214|1.854235|1.791491|1.951655|2.271474|2.831685|1.512404|0.167837|0.258265|0.150514|0.110834|0.075367|0.076404|0.113758|0.055096|0.055015|0.147303|0.127390|0.154476|0.303258|0.500000| |3.350030|3.290441|0.078630|3.115854|2.563106|2.358327|2.521423|3.040103|3.510264|15.348115|3.934874|3.370069|2.899348|5.363577|0.137177|3.561879|3.714966|4.689552|5.397374|0.091335|4.117271|5.943420|5.713625|8.643689|9.206383|17.770918|8.852087|37.485018|6.638642|4.620454|3.722641|3.672350|4.462986|6.362870|5.246086|2.711663|0.109205|0.089046|0.080547|0.065255|0.057966|0.086495|0.118770|0.053858|0.059410|0.105954|0.099102|0.082670|0.090139|0.092083|0.500000| |1.958941|1.935387|0.049919|1.826042|1.626354|1.530114|1.587863|1.771231|1.922246|10.247103|2.605842|2.339527|1.978556|3.011355|0.067637|2.134418|2.294153|2.783576|3.884855|0.070396|3.423935|5.752805|4.322685|4.005125|4.258062|4.799680|6.985733|46.689261|8.860136|17.719538|9.013183|5.654142|4.952826|5.652868|7.647534|3.336640|0.058798|0.054886|0.049456|0.043203|0.039293|0.050026|0.058921|0.037964|0.040788|0.064786|0.057765|0.053727|0.060583|0.059301|0.116165|0.500000| |1.643818|1.618079|0.041920|1.563853|1.414343|1.355923|1.420810|1.572382|1.663171|9.388010|2.417441|2.147903|1.816608|2.438099|0.054215|1.743172|1.813276|2.097397|2.870217|0.053402|2.395555|4.090465|2.832872|2.766514|3.167577|3.276359|4.105919|26.096063|5.617301|8.919326|17.747486|8.948380|5.655779|4.970170|13.521508|4.873797|0.049247|0.045581|0.042371|0.037479|0.035093|0.045053|0.050470|0.034935|0.037833|0.051766|0.048091|0.044419|0.048083|0.047590|0.086907|0.216210|0.500000| |1.962003|1.875258|0.047331|1.858254|1.649982|1.600366|1.728265|1.973149|2.065380|11.443662|3.048921|2.569516|2.162984|2.737971|0.062548|1.900366|1.949042|2.211102|2.858564|0.052629|2.263723|3.697502|2.723108|2.940364|3.483394|3.731346|4.133281|22.394601|5.635721|4.956811|5.626556|8.863364|17.769726|8.963048|12.487842|7.420229|0.060992|0.053047|0.051092|0.042754|0.040858|0.058420|0.064535|0.040834|0.045533|0.054557|0.053798|0.047695|0.050021|0.051745|0.111149|0.107594|0.124076|0.500000| |2.571392|2.421044|0.059721|2.344675|2.012065|1.906004|2.051981|2.408824|2.629073|13.081319|3.447502|2.911712|2.446379|3.625277|0.085966|2.434393|2.579871|3.054250|3.842847|0.068452|3.059325|4.778681|3.944121|4.567503|5.107779|6.666037|7.079589|31.792867|8.917163|5.653518|4.968428|5.662369|8.977321|17.722547|7.478408|3.914991|0.082547|0.069476|0.065072|0.051772|0.047834|0.070476|0.085499|0.045804|0.050840|0.070211|0.068248|0.059627|0.064375|0.067772|0.207412|0.123966|0.107831|0.218382|0.500000| 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