Version2.1 2021-01-08T04:24:35Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 11-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCN(CC)c1cc([nH+]c(n1)C)Nc2ccc(cc2)NS(=O)(=O)c3ccc4ccccc4c3 C33324508 RHF 6-31G(d) (6D,7F) CCN(CC)c1cc([nH+]c(n1)C)Nc2ccc(cc2)NS(=O)(=O)c3ccc4ccccc4c3 C01[X(C25H28N5O2S1)] 177 C1 555 CCN(c1cc(Nc2ccc(cc2)NS(=O)(=O)c2ccc3c(c2)cccc3)[nH+]c(n1)C)CC CCN(c1cc(Nc2ccc(cc2)NS(=O)(=O)c2ccc3c(c2)cccc3)[nH+]c(n1)C)CC CCN(CC)c1cc(Nc2ccc(N[S](=O)(=O)c3ccc4ccccc4c3)cc2)[nH+]c(C)n1 InChIKey=BHIGFKHEAZGLHS-UHFFFAOYSA-O InChI=1S/C25H27N5O2S/c1-4-30(5-2)25-17-24(26-18(3)27-25)28-21-11-13-22(14-12-21)29-33(31,32)23-15-10-19-8-6-7-9-20(19)16-23/h6-17,29H,4-5H2,1-3H3,(H,26,27,28)/p+1 InChI=1/C25H27N5O2S/c1-4-30(5-2)25-17-24(26-18(3)27-25)28-21-11-13-22(14-12-21)29-33(31,32)23-15-10-19-8-6-7-9-20(19)16-23/h6-17,29H,4-5H2,1-3H3,(H,26,27,28)/p+1/fC25H28N5O2S/h26,28H/q+1 CCN(CC)c1cc([nH+]c(n1)C)Nc2ccc(cc2)NS(=O)(=O)c3ccc4ccccc4c3 C01[X(C25H28N5O2S1)] 177 C01 555 CCN(c1cc(Nc2ccc(cc2)NS(=O)(=O)c2ccc3c(c2)cccc3)[nH+]c(n1)C)CC CC[N]([C]1[N]=C(C)N[C]([CH]1)N[C]1[CH][CH][C]([CH][CH]1)NS(=O)(=O)[C]1[CH]=[CH][C]2[C]([CH]1)[CH]=[CH][CH]=[CH]2)CC CCN(CC)[C]1[CH][C](N[C]2[CH][CH][C]([CH][CH]2)N[S](=O)(=O)[C]3[CH][C]4C=CC=C[C]4C=C3)NC(=N1)C InChIKey=FMURIQXSAQYDGA-UHFFFAOYSA-N InChI=1S/C25H28N5O2S/c1-4-30(5-2)25-17-24(26-18(3)27-25)28-21-11-13-22(14-12-21)29-33(31,32)23-15-10-19-8-6-7-9-20(19)16-23/h6-17,29H,4-5H2,1-3H3,(H2,26,27,28) InChI=1/C25H28N5O2S/c1-4-30(5-2)25-17-24(26-18(3)27-25)28-21-11-13-22(14-12-21)29-33(31,32)23-15-10-19-8-6-7-9-20(19)16-23/h6-17,29H,4-5H2,1-3H3,(H2,26,27,28)/f/h26,28H 3388.2170071211 -1782.2832459 1-A 23827.2392 122 433 555 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -92.28701 -20.63201 -20.62683 -15.78433 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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 8301.8655 39049.4487 39292.2423 0.99997 0.00018 0.00782 0.00253 0.93849 -0.34529 -0.00740 0.34530 0.93846 1 0.01043 0.00222 0.00220 0.21739 0.04622 0.04593 9.44 21.10 27.87 41.23 42.65 58.18 87.89 101.42 114.32 128.15 134.84 148.40 167.06 208.33 243.54 255.26 263.08 280.88 288.71 316.11 334.01 336.52 367.38 377.19 397.08 448.83 453.42 475.83 494.67 517.57 555.81 579.02 617.10 626.10 638.05 667.56 675.88 705.46 712.11 747.96 770.45 797.87 801.69 816.70 832.04 856.71 878.34 895.48 909.35 923.43 952.27 969.92 973.88 1005.40 1027.25 1035.47 1058.93 1103.38 1148.20 1201.00 1205.33 1216.26 1220.42 1224.30 1238.09 1284.08 1293.02 1307.58 1311.21 1321.44 1345.82 1347.54 1397.42 1410.00 1424.96 1449.97 1488.94 1503.76 1521.49 1543.09 1562.87 1576.32 1577.58 1581.18 1583.37 1594.52 1599.68 1618.71 1632.42 1685.22 1686.57 1709.43 1717.59 1730.46 1735.03 1741.63 1752.13 1793.64 1824.10 1835.18 1853.51 1866.88 1876.01 1881.54 1892.59 1949.17 1967.32 1975.22 1981.05 2000.17 2019.92 2078.95 2086.10 2115.11 2119.88 2125.31 2125.55 2155.09 2168.31 2182.83 2205.29 2210.16 2230.43 2256.13 2259.25 2265.03 2300.00 2308.26 2332.82 2344.38 2344.66 2349.72 2353.73 2355.51 2361.20 2361.95 2390.57 2402.85 2411.44 2431.94 2477.80 2522.25 2560.94 2566.15 2589.59 2591.45 2612.91 2643.88 2686.14 4629.84 4632.93 4634.70 4700.52 4711.55 4722.10 4724.43 4724.78 4742.32 4745.76 4774.04 4826.15 4831.83 4838.69 4847.17 4853.80 4858.87 4866.08 4868.55 4878.82 4886.49 4898.95 4901.19 4923.91 5010.79 5489.65 5522.81 5535.76 0.538272 0.567125 0.568069 0.473706 -1781.744974 -1781.716121 -1781.715177 -1781.809540 3.164951D-04 MUNgauss RevisionA2.0 retrievium 08-Jan-2021 DUDE CCN(CC)c1cc([nH+]c(n1)C)Nc2ccc(cc2)NS(=O)(=O)c3ccc4ccccc4c3 C33324508 RHF 6-31G(d) (6D,10F) C1 462.196372 |X|Y|Z| 48.833721 49.777787 137.711579 69.434496 25 6 7 16 20 4 1 |36.858105| |12.484853|36.858105| |7.622442|12.969992|53.358707| |5.670028|7.630614|17.583102|36.858105| |4.214339|5.731155|10.390325|12.500933|36.858105| |5.812144|7.806514|19.680371|7.805011|5.796703|36.858105| |5.490653|6.619719|10.789053|5.062956|4.176658|13.490621|36.858105| |3.997352|4.485841|7.163480|3.945349|3.444132|7.965358|13.890515|36.858105| |3.398974|3.819409|6.484626|3.898250|3.476970|7.099045|8.122468|13.943316|53.358707| |2.907285|3.189326|5.192103|3.263828|2.989321|5.176418|5.853090|9.268360|25.991795|0.500000| |3.494252|4.033669|7.510756|4.791117|4.231765|8.333168|7.020104|8.018354|19.060902|0.259692|36.858105| |4.254827|5.197495|11.354720|7.048755|5.712639|13.902666|7.893088|6.909182|11.214651|0.165801|14.937147|53.358707| |2.800400|3.138094|5.518034|3.910054|3.659674|5.175775|4.524523|5.130480|10.663919|0.207442|12.709750|10.728490|36.858105| |3.438433|3.679827|5.400649|3.124791|2.805319|5.206114|7.912044|14.230145|11.256623|0.212522|5.342488|6.339275|4.028848|53.358707| |3.531488|3.657053|4.951411|2.859807|2.576209|4.393031|6.504709|7.792213|7.089073|0.134883|3.955235|5.084195|3.129809|18.090569|36.858105| |3.614182|3.475932|4.575068|2.688021|2.372505|3.882935|5.357031|5.787983|5.779511|0.110899|3.421659|4.504856|2.782309|10.616364|13.743539|36.858105| |3.372623|3.173288|3.999979|2.403421|2.151639|3.219715|4.149728|4.192341|4.467180|0.086489|2.783101|3.750602|2.330935|6.990321|7.938317|13.802699|36.858105| |3.124990|3.052176|3.778183|2.286293|2.099440|2.988917|3.779965|3.761899|4.070054|0.079011|2.569469|3.485810|2.171116|6.161996|6.865440|7.939876|13.694422|36.858105| |3.065538|3.167061|3.977464|2.386912|2.234639|3.201611|4.122812|4.181330|4.460990|0.086541|2.774489|3.733463|2.325524|6.996535|7.955871|6.890382|7.929655|13.705035|36.858105| |3.234888|3.456690|4.529437|2.659607|2.480258|3.841251|5.280202|5.746344|5.760718|0.110995|3.401804|4.467623|2.771490|10.626553|13.769088|7.945625|6.869115|7.921253|13.781790|36.858105| |2.770335|2.670152|3.266333|2.029692|1.883994|2.510024|3.018510|2.957485|3.340561|0.065314|2.171534|2.972212|1.876040|4.619881|4.558108|5.158220|7.815543|13.560439|7.904959|5.176769|53.358707| |2.844009|2.634440|3.148790|1.982925|1.826663|2.348649|2.732747|2.593558|2.981703|0.057825|1.990581|2.774490|1.730770|3.866855|3.585606|4.160512|5.844547|7.008377|4.967571|3.801265|15.553718|388.023441| |2.499876|2.367989|2.834054|1.815415|1.702995|2.090977|2.378776|2.259777|2.648297|0.051593|1.789284|2.498358|1.574654|3.324978|2.980908|3.264914|4.197852|5.141803|4.197481|3.260560|10.680725|94.904357|73.516695| |3.542825|3.150520|3.644674|2.260245|2.043529|2.673601|3.113698|2.846018|3.225520|0.061461|2.173068|3.085012|1.861981|4.126762|3.803595|4.503227|6.092964|6.469966|4.770927|3.875517|10.294805|94.827611|13.589868|73.516695| |2.475685|2.259580|2.778727|1.781721|1.633487|2.089053|2.397279|2.331533|2.740691|0.053887|1.831770|2.523288|1.617965|3.494181|3.136804|3.770284|5.128341|5.220403|3.832999|3.155094|9.535289|76.892838|12.998906|13.059111|36.858105| |2.106726|1.964015|2.456668|1.594241|1.479310|1.858038|2.114772|2.096618|2.505637|0.049891|1.673536|2.281630|1.498165|3.165785|2.790402|3.239173|4.188741|4.402740|3.435823|2.851416|7.970607|49.307982|10.925449|8.699735|13.416309|36.858105| |1.914004|1.777659|2.251435|1.477850|1.370408|1.704076|1.916363|1.914856|2.324484|0.046594|1.560680|2.118636|1.412414|2.873629|2.464829|2.854993|3.509906|3.503557|2.847460|2.463892|5.751715|33.845502|7.716335|6.793608|7.964883|14.072744|36.858105| |1.953150|1.783365|2.264320|1.492906|1.372030|1.708204|1.906617|1.896831|2.313982|0.046282|1.563152|2.128020|1.417098|2.814934|2.378898|2.802034|3.364772|3.185397|2.600398|2.313700|4.942370|29.827206|6.556786|6.539314|6.851071|7.874924|13.375643|36.858105| |1.745950|1.600448|2.055052|1.370942|1.263641|1.550152|1.709046|1.710749|2.119547|0.042650|1.441104|1.954869|1.321588|2.520289|2.080045|2.407537|2.771572|2.612849|2.208501|2.011476|3.918889|22.732884|5.175033|5.168644|4.537914|5.121978|7.668044|13.438239|36.858105| |1.735809|1.576132|2.031745|1.364443|1.251263|1.527031|1.667726|1.663511|2.075584|0.041706|1.421724|1.933453|1.308754|2.422742|1.969948|2.281528|2.563384|2.370849|2.026664|1.879176|3.460012|20.107838|4.551348|4.778891|3.800586|3.943740|5.118928|7.899912|14.009082|36.858105| |1.923650|1.715940|2.201089|1.475411|1.339759|1.646088|1.794215|1.771555|2.200682|0.043901|1.513261|2.071905|1.384839|2.557285|2.078303|2.441171|2.734558|2.474173|2.098227|1.956993|3.560174|21.159561|4.673061|5.234442|3.955759|3.778445|4.510716|6.805183|7.902626|13.460084|36.858105| |2.201715|1.938527|2.454527|1.625437|1.466309|1.831841|2.017489|1.971943|2.411976|0.047733|1.651155|2.273923|1.491977|2.852760|2.361742|2.835389|3.268852|2.916489|2.407172|2.217504|4.231018|26.182693|5.556770|6.593290|5.135846|4.503786|5.093815|7.803538|6.827299|7.921988|14.019929|36.858105| |2.232277|1.993242|2.505504|1.641436|1.490908|1.879628|2.102289|2.061828|2.491184|0.049339|1.687191|2.316595|1.515066|3.032595|2.577618|3.115390|3.784089|3.450992|2.757390|2.464072|5.250000|33.629193|6.937280|7.878587|7.920909|6.776050|7.796657|13.525080|7.827650|6.830999|7.902148|13.428307|36.858105| |2.573339|2.282483|2.813754|1.813823|1.641743|2.104293|2.388758|2.307815|2.731010|0.053532|1.840300|2.546244|1.628025|3.403957|2.982610|3.670880|4.749222|4.368275|3.319810|2.878590|6.909298|50.183221|9.172903|11.755816|14.024525|7.852318|6.822709|7.816064|5.108615|4.526433|5.128876|7.688977|13.415096|36.858105| |17.573198|8.861450|7.574909|4.480442|3.627568|4.515272|4.500348|3.452647|3.999331|0.071377|2.961908|4.731367|2.436440|4.226436|3.311048|3.442339|3.372331|3.199812|3.086940|3.131812|3.969401|22.030848|4.869527|7.076607|2.640639|2.219102|1.998916|2.035530|1.805414|1.789022|1.987504|2.295934|2.342329|2.741331|0.500000| |17.570732|8.795199|9.375488|6.009287|4.275767|5.173050|4.576818|3.517649|4.269929|0.075352|3.327251|5.551545|2.742415|4.117225|3.029828|3.117262|2.910052|2.684409|2.624005|2.767006|3.294730|17.809201|3.962720|5.424161|2.242908|1.930651|1.779432|1.832984|1.659088|1.666612|1.853460|2.097933|2.090003|2.360352|0.301421|0.500000| |17.574968|8.764091|9.273832|4.931759|3.713671|6.058628|6.313495|4.574249|5.108402|0.088754|3.726912|5.989323|2.935168|5.385869|4.104371|4.363538|3.958170|3.500254|3.356635|3.584019|4.111912|21.827226|4.655639|6.873946|2.702202|2.274378|2.065541|2.120539|1.884960|1.875214|2.091529|2.416334|2.448811|2.840315|0.301660|0.301485|0.500000| |8.856061|17.627242|12.608050|7.600957|6.377471|5.881700|4.942250|3.660238|4.428157|0.077302|3.495976|6.029604|2.843579|4.207529|3.079301|2.930563|2.743886|2.696074|2.805644|2.997519|3.299007|17.219092|3.961155|5.078479|2.081351|1.825905|1.658435|1.660625|1.498580|1.477249|1.602294|1.797423|1.843879|2.095750|0.213594|0.211597|0.172915|0.500000| |8.797002|17.629371|12.391793|5.728088|4.891495|7.269033|7.324775|4.870094|5.363940|0.091655|3.958530|6.591726|3.055403|5.557853|4.200213|3.860794|3.543427|3.507249|3.747937|4.112511|4.103181|20.685565|4.640949|6.178017|2.422741|2.101054|1.876367|1.858820|1.653341|1.611372|1.742480|1.977946|2.068104|2.399768|0.212875|0.172653|0.208522|0.306214|0.500000| |4.808530|5.713521|12.413609|17.694917|8.842294|7.342384|4.794080|3.943593|5.586735|0.095799|5.341342|10.894740|4.489991|4.221400|2.769330|2.619338|2.313731|2.170727|2.252206|2.526897|2.618443|13.317374|3.037363|3.761885|1.710498|1.538673|1.437554|1.459257|1.348505|1.348167|1.457988|1.596373|1.601136|1.751563|0.106812|0.145223|0.124267|0.150358|0.127589|0.500000| |6.283909|7.566323|12.594861|17.612988|8.836778|5.895569|4.312835|3.407663|4.486196|0.078461|3.858357|7.061416|3.256580|3.814180|2.640991|2.547339|2.324587|2.209918|2.267693|2.468203|2.709017|14.103393|3.235732|4.060209|1.785998|1.590118|1.476599|1.499768|1.378097|1.377642|1.498152|1.653151|1.658642|1.832768|0.138658|0.205536|0.142115|0.230084|0.150120|0.303922|0.500000| |3.621876|4.517685|7.578169|8.871239|17.565583|4.502448|3.423968|2.931718|4.096006|0.073615|3.640760|6.328111|3.330540|3.330223|2.258511|2.108924|1.930538|1.881586|1.983873|2.175321|2.325620|11.874536|2.784710|3.301048|1.509429|1.374181|1.281312|1.286980|1.192752|1.185709|1.268698|1.379928|1.394778|1.523181|0.088591|0.105688|0.089355|0.140661|0.108277|0.212444|0.213800|0.500000| |4.297780|6.107128|9.406411|8.773118|17.562194|5.168400|3.994881|3.260312|4.326527|0.076599|3.672653|6.420170|3.158696|3.699377|2.561280|2.354905|2.169973|2.152137|2.303679|2.523043|2.647917|13.463807|3.164302|3.773453|1.670800|1.510535|1.391026|1.385723|1.271003|1.253535|1.340142|1.471551|1.505097|1.668141|0.106398|0.117558|0.102325|0.209771|0.149234|0.172875|0.209858|0.301730|0.500000| |3.717155|4.976024|9.292408|8.814488|17.586332|6.039874|4.349937|3.708630|5.278528|0.092360|4.879545|8.903190|4.253266|4.055378|2.669071|2.405487|2.155617|2.109241|2.278664|2.575264|2.555610|12.741588|2.969951|3.521161|1.605278|1.463391|1.356045|1.351776|1.246318|1.230166|1.310182|1.429734|1.459845|1.603595|0.089584|0.101960|0.094855|0.143429|0.126182|0.212102|0.173171|0.301280|0.300787|0.500000| |6.332650|7.306415|9.542226|4.551003|3.802887|8.742165|17.873405|9.045760|7.829996|0.127750|5.040666|7.647121|3.610847|9.719377|7.266706|6.207531|4.930205|4.512062|4.867417|6.051746|4.791119|22.670129|4.845948|6.651687|2.710385|2.343714|2.090982|2.071974|1.831531|1.777050|1.919830|2.190291|2.308373|2.684434|0.148652|0.135829|0.209920|0.146342|0.252751|0.115530|0.113899|0.087672|0.105386|0.106193|0.500000| |2.634284|2.845801|4.840248|3.420497|3.129072|4.431684|4.072271|4.732071|9.507314|0.203304|8.924590|8.297209|17.557379|5.307642|3.038991|2.766355|2.309289|2.120375|2.237076|2.644027|2.499312|12.072558|2.734182|3.235241|1.609451|1.494533|1.419075|1.431521|1.341879|1.334225|1.412284|1.514404|1.529168|1.629732|0.064040|0.072198|0.077901|0.071464|0.076808|0.109342|0.081835|0.080564|0.076193|0.097103|0.092575|0.500000| |2.773156|3.122255|5.572925|4.240090|4.038996|4.910112|4.039967|4.246955|7.801135|0.147289|9.008760|10.326750|17.666557|4.614453|2.753841|2.493657|2.132794|1.999399|2.126570|2.481926|2.382610|11.637550|2.663792|3.143330|1.529452|1.415046|1.336645|1.344823|1.257704|1.250036|1.325461|1.425126|1.439957|1.544460|0.066895|0.076968|0.079049|0.080233|0.082536|0.140958|0.097140|0.104672|0.093730|0.131733|0.091792|0.299942|0.500000| |2.527824|2.856233|4.847260|3.417239|3.355175|4.433998|4.069028|4.727368|9.510394|0.203623|8.924538|8.299379|17.557120|5.299194|3.034312|2.647278|2.237626|2.117476|2.301804|2.754160|2.497355|11.923253|2.732386|3.169973|1.563909|1.459863|1.375023|1.369878|1.278594|1.259924|1.323688|1.421918|1.452929|1.559599|0.062200|0.068073|0.073066|0.072852|0.078993|0.104589|0.080084|0.085165|0.082418|0.110067|0.092385|0.300754|0.299984|0.500000| |2.936311|3.113722|4.608436|2.785007|2.543569|4.322541|5.800457|9.447338|10.554906|0.237922|4.993329|5.646747|4.033807|26.014733|9.111183|6.362545|4.483131|4.000767|4.492364|6.395960|4.217840|18.432392|4.012085|4.803669|2.400089|2.219002|2.039523|1.995227|1.805284|1.734982|1.814933|1.999482|2.119909|2.336394|0.074415|0.073503|0.092278|0.074587|0.093975|0.078008|0.069648|0.062603|0.068067|0.075624|0.144856|0.111495|0.092622|0.111204|0.500000| |3.616410|3.377199|4.566122|2.717110|2.354703|3.904162|5.204090|5.718602|5.959008|0.114961|3.547186|4.627677|2.900749|9.759234|8.921109|17.723408|8.945670|5.647870|4.961504|5.651892|5.682106|25.806419|5.138725|7.089422|3.477732|3.003537|2.733361|2.764779|2.416013|2.333880|2.530185|2.921939|3.109648|3.552252|0.093674|0.088740|0.124324|0.078936|0.100124|0.074981|0.071737|0.058564|0.063951|0.066104|0.157636|0.081873|0.072030|0.075296|0.171129|0.500000| |3.214547|2.921613|3.672569|2.252013|2.005982|2.897368|3.577281|3.568659|3.955410|0.077050|2.524109|3.421848|2.150974|5.677393|5.655413|8.958487|17.775143|8.893873|5.641562|4.954662|9.688050|44.591480|7.650719|11.651647|6.277456|4.829105|4.075801|4.029494|3.223896|2.977341|3.230158|3.997455|4.735943|6.163561|0.090410|0.078536|0.104906|0.071001|0.088129|0.060590|0.061347|0.050526|0.056044|0.055349|0.115309|0.059784|0.055181|0.057037|0.104485|0.216303|0.500000| |2.783911|2.920166|3.648008|2.231325|2.132559|2.877565|3.550821|3.556505|3.946649|0.077054|2.513113|3.401177|2.143253|5.676814|5.658749|4.961527|5.639488|8.900499|17.722998|8.943735|9.865501|33.448725|7.669566|7.712175|3.565953|3.294308|2.719578|2.443696|2.088222|1.906677|1.954561|2.220588|2.547352|3.034497|0.078903|0.066852|0.082298|0.073694|0.095945|0.058170|0.059087|0.052852|0.061741|0.060449|0.113691|0.056955|0.054941|0.059523|0.104558|0.107677|0.123969|0.500000| |3.015723|3.350689|4.491044|2.667798|2.554187|3.832761|5.084940|5.645609|5.918714|0.115019|3.507612|4.558149|2.878101|9.755311|8.921028|5.648708|4.950558|5.639405|8.930528|17.724748|5.709678|22.940897|5.133530|5.818501|2.711144|2.500318|2.190074|2.056916|1.814075|1.701688|1.762631|1.971407|2.167472|2.487061|0.080583|0.072475|0.090261|0.082130|0.111020|0.070251|0.067875|0.062007|0.072423|0.074979|0.152093|0.074990|0.071373|0.081235|0.172183|0.124238|0.107563|0.215873|0.500000| |2.547097|2.509144|3.078489|1.931239|1.820298|2.354960|2.792273|2.744346|3.143888|0.061754|2.056436|2.812216|1.791191|4.250914|4.063682|4.289398|5.772693|9.307142|7.503353|4.866855|25.934181|61.388880|14.339557|10.600308|5.654974|5.239125|3.858788|3.251057|2.639299|2.325438|2.357978|2.738642|3.342765|4.190863|0.074567|0.062196|0.075597|0.064195|0.079023|0.050697|0.052499|0.045953|0.052534|0.050570|0.089180|0.048463|0.046551|0.049076|0.080130|0.098223|0.144862|0.227053|0.114998|0.500000| |2.018743|1.914760|2.397816|1.556896|1.458444|1.816316|2.068747|2.059254|2.464095|0.049195|1.642991|2.234784|1.473471|3.122964|2.758639|3.103862|3.968498|4.447509|3.577511|2.906151|8.453813|47.083006|11.836581|8.008718|8.795034|17.750893|9.005653|5.605219|4.144315|3.289046|3.126587|3.592513|4.904408|5.623810|0.059009|0.051238|0.060006|0.049681|0.057370|0.041622|0.042955|0.037598|0.041528|0.040234|0.063570|0.040658|0.038628|0.040142|0.061016|0.078509|0.119909|0.098378|0.071468|0.167703|0.500000| |1.736619|1.630556|2.080720|1.374971|1.284032|1.577467|1.763609|1.775147|2.176126|0.043888|1.463456|1.977917|1.335044|2.663890|2.255730|2.555642|3.056320|3.095401|2.602240|2.273128|4.994443|27.901314|6.691748|5.691161|5.645988|9.036490|17.722264|8.822071|7.041640|4.693943|3.929739|4.144121|5.585539|4.926273|0.050133|0.045065|0.051710|0.042478|0.047759|0.037234|0.038071|0.033451|0.036185|0.035409|0.052956|0.037291|0.035112|0.036275|0.053030|0.068051|0.095345|0.070049|0.056888|0.096557|0.216682|0.500000| |1.608543|1.490968|1.923383|1.287978|1.195277|1.453601|1.598800|1.609832|2.006373|0.040569|1.364164|1.843465|1.258157|2.376789|1.951079|2.221440|2.533274|2.431414|2.089322|1.904812|3.654114|20.648064|4.829498|4.631253|3.948706|4.699538|7.040548|8.838227|17.717904|8.992784|5.619335|4.928278|5.596222|4.151254|0.046078|0.042496|0.047962|0.038930|0.042870|0.035215|0.035861|0.031392|0.033412|0.032852|0.047345|0.035478|0.033255|0.033974|0.047616|0.061536|0.079954|0.055435|0.048107|0.069661|0.111311|0.213265|0.500000| |1.594021|1.455811|1.889056|1.278123|1.176439|1.419557|1.538999|1.540572|1.940376|0.039136|1.334816|1.811250|1.238303|2.234371|1.794630|2.050233|2.262100|2.104953|1.831155|1.713911|3.042700|17.371184|3.998596|4.149790|3.141735|3.291013|4.145890|5.622205|9.012317|17.724731|8.834466|5.654609|4.930831|3.605663|0.045438|0.042783|0.047579|0.038062|0.041194|0.035196|0.035836|0.031090|0.032677|0.032166|0.045199|0.035147|0.032923|0.033166|0.044711|0.058446|0.071586|0.048110|0.043488|0.057498|0.078957|0.111332|0.216598|0.500000| |1.870308|1.662233|2.143593|1.448912|1.313028|1.597553|1.723137|1.698285|2.127985|0.042445|1.474570|2.022469|1.356785|2.426612|1.943358|2.261927|2.475517|2.234633|1.925607|1.820112|3.163838|18.587615|4.145470|4.697048|3.297230|3.125978|3.595826|4.917648|5.645666|8.828697|17.727581|9.004984|5.620077|4.150498|0.053443|0.050617|0.056301|0.043248|0.046474|0.039944|0.041012|0.034693|0.036362|0.035592|0.050843|0.038550|0.036215|0.035919|0.047921|0.065826|0.079878|0.049884|0.045853|0.058627|0.073991|0.089628|0.124036|0.214111|0.500000| |2.420073|2.087118|2.627423|1.738861|1.553465|1.946522|2.132612|2.058096|2.511186|0.049317|1.730012|2.402243|1.555492|2.939072|2.419959|2.919709|3.316512|2.913530|2.415121|2.247932|4.137423|25.829633|5.420263|6.896541|4.705385|3.923294|4.144053|5.586571|4.927762|5.625256|8.992584|17.710953|8.833149|7.061369|0.070347|0.064383|0.074180|0.053604|0.058629|0.047419|0.049462|0.040603|0.043248|0.041828|0.064528|0.043829|0.041406|0.040910|0.056724|0.084622|0.112413|0.061515|0.055472|0.074055|0.089542|0.095678|0.107097|0.124102|0.216204|0.500000| |2.942480|2.536776|3.083197|1.975518|1.766994|2.283385|2.586574|2.449050|2.877096|0.055785|1.951092|2.730024|1.711249|3.553049|3.102479|3.858420|4.898472|4.360912|3.342625|2.946973|6.530030|47.916705|8.610423|13.814256|9.012296|5.604042|4.928250|5.585451|4.146631|3.932925|4.688821|7.027314|8.801021|17.745814|0.088157|0.074638|0.091101|0.064297|0.073595|0.052797|0.055864|0.045427|0.049887|0.047590|0.081686|0.047477|0.045237|0.045200|0.066799|0.105010|0.176233|0.083924|0.070550|0.109665|0.123880|0.107112|0.095712|0.089674|0.111142|0.212877|0.500000| 1780.111919 -10928.425524 4192.455690 -214.642659 -5170.500575 3388.217251 -1782.283324 2.001220 3D53B0000000001E 44DBF3C1BF5ECCE3 445D350923E9D938 4204FD45A7FFFFFF 34B53BCE697D39BF 440CC0DB1A792308