Version2.1 2021-01-15T12:24:21Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 25-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE COCC[NH+](Cc1cccc(c1)OC)Cc2ccc(o2)C(c3cccs3)(c4cccs4)O C36156166 RHF 6-31G(d) (6D,7F) COCC[NH+](Cc1cccc(c1)OC)Cc2ccc(o2)C(c3cccs3)(c4cccs4)O C01[X(C25H28N1O4S2)] 174 C1 544 COCC[NH+](Cc1ccc(o1)C(c1cccs1)(c1cccs1)O)Cc1cccc(c1)OC COCC[NH+](Cc1ccc(o1)C(c1cccs1)(c1cccs1)O)Cc1cccc(c1)OC COCC[NH+](Cc1oc(cc1)C(O)(c2sccc2)c3sccc3)Cc4cccc(OC)c4 InChIKey=FRRKUZUFUUGCGO-UHFFFAOYSA-O InChI=1S/C25H27NO4S2/c1-28-13-12-26(17-19-6-3-7-20(16-19)29-2)18-21-10-11-22(30-21)25(27,23-8-4-14-31-23)24-9-5-15-32-24/h3-11,14-16,27H,12-13,17-18H2,1-2H3/p+1 InChI=1/C25H27NO4S2/c1-28-13-12-26(17-19-6-3-7-20(16-19)29-2)18-21-10-11-22(30-21)25(27,23-8-4-14-31-23)24-9-5-15-32-24/h3-11,14-16,27H,12-13,17-18H2,1-2H3/p+1/fC25H28NO4S2/h26H/q+1 COCC[NH+](Cc1cccc(c1)OC)Cc2ccc(o2)C(c3cccs3)(c4cccs4)O C01[X(C25H28N1O4S2)] 174 C01 544 COCC[NH+](Cc1ccc(o1)C(c1cccs1)(c1cccs1)O)Cc1cccc(c1)OC COCC[NH](C[C]1[CH][CH][CH][C]([CH]1)OC)CC1=[CH][CH]=C(O1)[C@@](C1=[CH][CH]=[CH]S1)(C1=[CH][CH]=CS1)O COCC[NH](C[C]1[CH][CH][CH][C]([CH]1)OC)Cc2oc(cc2)C(O)(c3sccc3)c4sccc4 InChIKey=CQDGJZQYJZUGIF-UHFFFAOYSA-N InChI=1S/C25H28NO4S2/c1-28-13-12-26(17-19-6-3-7-20(16-19)29-2)18-21-10-11-22(30-21)25(27,23-8-4-14-31-23)24-9-5-15-32-24/h3-11,14-16,26-27H,12-13,17-18H2,1-2H3 InChI=1/C25H28NO4S2/c1-28-13-12-26(17-19-6-3-7-20(16-19)29-2)18-21-10-11-22(30-21)25(27,23-8-4-14-31-23)24-9-5-15-32-24/h3-11,14-16,26-27H,12-13,17-18H2,1-2H3 3605.1724290113 -2111.6419943 1-A 19355.2429 124 420 544 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -92.05219 -92.04417 -20.73942 -20.69795 -20.68339 -20.66068 -15.82068 -11.42526 -11.42333 -11.42284 -11.41532 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-0.42911 -0.41691 -0.41469 -0.40533 -0.40425 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 0.01640 0.03368 0.03973 0.04886 0.05584 0.09099 0.10351 0.11459 0.11839 0.12435 0.13362 0.13446 0.14771 0.15487 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0.4675 0.6954 0.7587 0.3474 0.3706 0.6482 0.5583 0.2772 0.3523 0.4013 0.1690 0.4492 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 51 52 53 54 55 56 57 58 59 60 6 8 6 6 7 1 6 6 6 6 6 6 6 8 6 6 6 6 6 6 8 6 6 6 6 6 16 6 6 6 6 16 8 1 1 1 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 15.99491 12.00000 12.00000 14.00307 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 31.97207 12.00000 12.00000 12.00000 12.00000 31.97207 15.99491 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 1.00783 1.00783 1.00783 9559.5467 27484.3226 33204.2082 0.99998 -0.00525 -0.00189 0.00525 0.99999 -0.00156 0.00190 0.00155 1.00000 1 0.00906 0.00315 0.00261 0.18879 0.06566 0.05435 13.70 22.80 35.10 38.47 44.10 48.88 60.62 73.60 88.67 108.08 121.14 139.37 146.87 151.07 171.87 192.89 259.65 270.13 314.58 332.22 334.96 344.10 356.74 380.24 420.30 425.84 440.34 442.57 471.32 476.81 496.34 515.21 523.20 527.21 583.18 591.70 610.89 657.19 710.75 739.46 758.33 805.36 864.59 871.15 895.99 908.25 910.75 938.38 972.08 1001.68 1008.39 1017.96 1102.01 1113.32 1154.16 1160.57 1175.42 1176.61 1184.67 1185.83 1244.44 1276.21 1290.60 1307.38 1339.80 1341.98 1349.91 1379.13 1404.42 1426.96 1438.63 1446.75 1449.74 1456.31 1465.88 1489.40 1526.76 1529.58 1533.97 1553.34 1557.25 1563.52 1592.77 1609.00 1610.97 1622.16 1632.95 1644.90 1658.27 1686.24 1704.36 1740.60 1746.77 1753.51 1789.89 1807.31 1830.30 1841.17 1858.11 1859.31 1860.11 1866.72 1893.38 1896.93 1921.36 1927.96 1939.33 1957.93 1985.51 1990.37 2002.50 2004.38 2011.11 2082.30 2089.18 2108.30 2116.21 2167.12 2178.21 2191.20 2205.84 2213.41 2233.57 2258.45 2297.36 2310.07 2329.60 2340.32 2348.40 2353.48 2354.90 2362.17 2364.34 2365.82 2371.76 2375.21 2379.05 2383.37 2404.81 2431.92 2505.14 2529.92 2538.39 2570.53 2606.99 2625.80 4613.37 4626.76 4635.68 4678.19 4716.70 4721.89 4725.31 4733.63 4736.48 4806.49 4817.78 4822.14 4830.65 4834.94 4862.99 4864.11 4873.73 4898.36 4900.61 4917.49 4926.50 4941.07 4944.87 4951.47 4956.63 5014.65 5288.15 5896.22 0.528914 0.558098 0.559043 0.463056 -2111.113080 -2111.083896 -2111.082952 -2111.178938 3.219386D-04 MUNgauss RevisionA2.0 retrievium 15-Jan-2021 DUDE COCC[NH+](Cc1cccc(c1)OC)Cc2ccc(o2)C(c3cccs3)(c4cccs4)O C36156166 RHF 6-31G(d) (6D,10F) C1 470.145977 |X|Y|Z| 117.462766 65.778181 35.084605 64.719163 25 6 7 8 16 21 1 1 2 |36.858105| |13.527549|73.516695| |8.061769|24.327561|36.858105| |5.218538|14.462260|12.504244|36.858105| |4.715080|12.759204|7.653702|12.706041|53.358707| |5.537405|15.953419|7.585122|9.454020|25.658260|0.500000| |4.168602|10.044385|6.137530|7.609919|17.195397|0.258173|36.858105| |3.676122|8.196428|4.443769|4.986061|10.361049|0.204513|12.626326|36.858105| |4.065280|8.663324|4.256642|4.345024|8.247673|0.192224|7.584578|13.655137|36.858105| |3.295970|6.584548|3.269566|3.329408|5.883803|0.133224|5.047472|7.964999|13.811268|36.858105| |2.700308|5.386906|2.796447|2.942662|5.126114|0.109687|4.443409|6.856125|7.895400|13.708120|36.858105| |2.576864|5.267622|2.846641|3.116995|5.523704|0.111684|5.021050|7.901564|6.828867|7.940167|13.740458|36.858105| |2.904542|6.187942|3.442663|3.924141|7.401489|0.141185|7.607314|13.807420|7.921854|6.905465|7.926656|13.637131|36.858105| |2.193329|4.415990|2.432324|2.677361|4.534380|0.089946|3.957765|5.308790|4.620856|5.209539|7.882401|14.254351|8.242125|73.516695| |1.961795|3.856002|2.100908|2.262747|3.710584|0.075139|3.113509|3.979334|3.779318|4.500776|6.695372|8.004658|5.255865|24.059058|36.858105| |3.562315|8.566453|4.987387|7.614690|17.143303|0.257655|7.626450|6.171819|4.881183|3.879165|3.624888|4.059162|5.305729|6.175996|2.826496|36.858105| |3.471822|8.087624|4.438471|6.149918|10.367713|0.204778|5.002851|4.458617|3.995529|3.363172|3.120207|3.319692|3.945968|5.186028|2.485604|12.839131|36.858105| |3.232282|7.130559|3.674576|4.519193|7.457872|0.164409|4.052765|3.957573|3.794593|3.360558|3.119276|3.201682|3.585934|5.028393|2.476072|7.375230|14.206407|36.858105| |2.969234|6.276201|3.284538|3.891313|5.724888|0.123674|3.229722|3.084694|3.002186|2.713076|2.534175|2.579400|2.833083|4.157620|2.097040|5.158963|8.577057|13.263367|36.858105| |3.018184|6.463287|3.559808|4.376473|5.951252|0.122396|3.282247|2.979211|2.823663|2.500024|2.338879|2.421744|2.721585|3.926766|1.964616|5.343190|8.766735|8.599885|14.200160|36.858105| |3.305155|7.476012|4.318209|5.939639|8.020812|0.154237|4.105435|3.534868|3.214321|2.751922|2.568544|2.719370|3.176994|4.359918|2.129990|7.846241|14.087330|8.629197|8.626638|14.172759|73.516695| |2.681150|5.496963|3.107860|3.644405|4.662060|0.094639|2.711761|2.451791|2.337615|2.097753|1.976490|2.041853|2.267288|3.363969|1.706155|3.913450|5.296361|5.127093|7.312991|12.584815|13.830540|36.858105| |2.304885|4.697742|2.738991|3.255949|4.185414|0.082188|2.523866|2.280293|2.130365|1.927994|1.853313|1.947236|2.162456|3.267771|1.657553|3.600453|4.515063|4.203723|5.296085|7.609157|11.185824|12.514341|36.858105| |2.110711|4.222222|2.506679|2.909970|3.650796|0.071190|2.265926|2.037450|1.903535|1.728976|1.667510|1.753555|1.941390|2.965387|1.512250|3.026485|3.543529|3.269971|3.872120|5.068644|8.245914|7.374903|14.113259|36.858105| |1.861340|3.702545|2.202502|2.551294|3.274424|0.063346|2.091160|1.901979|1.764234|1.619621|1.584635|1.680404|1.848134|2.883967|1.476741|2.740980|3.092911|2.874973|3.271407|3.993631|6.762405|5.010119|8.192336|13.277697|36.858105| |1.828287|3.665095|2.158718|2.533399|3.359017|0.064858|2.153141|1.984918|1.829777|1.690907|1.671579|1.785150|1.955978|3.087139|1.579532|2.904992|3.296667|3.102031|3.498733|4.144416|7.011025|4.805755|7.685270|8.248477|14.173687|36.858105| |2.068858|4.222763|2.441909|2.928570|3.985816|0.077619|2.471332|2.291035|2.114542|1.944663|1.911548|2.036044|2.240087|3.477892|1.766304|3.605676|4.416433|4.238643|5.035142|6.129924|9.675169|6.713069|10.943026|7.458664|7.461580|11.061195|388.023441| |2.965795|5.986608|3.447389|3.883721|4.624381|0.094239|2.692401|2.379690|2.289049|2.029879|1.885315|1.933375|2.158842|3.161765|1.604371|3.595686|4.515511|4.184216|5.260633|7.617625|11.269186|12.459922|7.506376|6.329886|4.305857|3.843334|32.606213|36.858105| |2.937323|5.655905|3.163205|3.338838|4.014465|0.083892|2.401501|2.159234|2.124838|1.904521|1.757350|1.775490|1.954074|2.902372|1.489368|3.007790|3.651704|3.553665|4.393724|5.462145|8.169396|7.461623|5.195818|4.770719|3.513554|3.147567|25.616561|14.146885|36.858105| |3.074865|5.736698|3.283065|3.304079|3.828581|0.079603|2.334979|2.074232|2.046797|1.825256|1.675528|1.689639|1.864486|2.758082|1.416146|2.752100|3.163814|3.000653|3.454794|4.131353|6.815197|5.015541|4.012189|3.946383|3.054300|2.708763|21.041908|8.184090|13.255350|36.858105| |3.231291|6.169505|3.742851|3.800549|4.180014|0.084725|2.541299|2.197178|2.131355|1.874836|1.723012|1.756346|1.966281|2.864092|1.457657|2.959459|3.299735|2.988382|3.310674|4.069008|7.231979|4.767757|4.048719|4.084647|3.175516|2.786918|21.278482|7.660600|8.240905|14.195684|36.858105| |3.165517|6.483599|4.061271|4.635084|5.009588|0.097970|2.931463|2.481782|2.338750|2.035768|1.888296|1.959733|2.231802|3.199331|1.607064|3.720985|4.252942|3.632698|4.040782|5.487271|10.375846|6.582124|5.693232|5.550429|4.054140|3.538607|27.768959|10.925553|7.465702|7.462173|11.021962|388.023441| |2.448210|4.861478|2.663589|2.990777|3.946724|0.082203|2.366912|2.207426|2.151321|1.972258|1.862403|1.896541|2.058796|3.141005|1.617950|3.252146|4.284884|4.595986|6.909632|8.310093|9.535689|13.580044|7.955094|5.696505|4.284667|4.208948|40.240441|7.986639|6.882064|4.538597|3.983435|33.419624|73.516695| |17.654853|16.843306|5.845978|4.384871|5.826982|0.144695|3.807293|3.569854|4.144394|3.461586|2.786021|2.590322|2.847160|3.904598|1.986943|3.377864|3.377872|3.282670|3.013022|2.962543|5.604759|2.609867|2.225198|2.021587|1.788241|1.769140|14.346272|2.829653|2.841181|2.908576|2.952768|20.556192|4.337785|0.500000| |17.569105|16.461702|7.172769|4.805360|5.570424|0.127753|3.561470|3.116353|3.334271|2.788954|2.355076|2.274520|2.547660|3.509984|1.778782|3.242362|3.253381|3.030793|2.891624|3.005158|5.749180|2.755065|2.352704|2.178402|1.901811|1.843303|14.701313|3.158392|3.209507|3.491079|3.678410|24.303982|4.473229|0.299772|0.500000| |17.552001|16.429672|7.182420|4.681425|5.842721|0.133951|4.116751|3.650146|4.046263|3.293143|2.698685|2.571897|2.891721|3.893523|1.962049|3.245290|3.056150|2.832364|2.587318|2.630675|5.151239|2.363444|2.082552|1.930486|1.726363|1.698112|13.478770|2.586795|2.550487|2.686361|2.853603|19.931905|3.847243|0.299419|0.298875|0.500000| |7.065777|16.544614|17.533400|8.727714|8.873934|0.173146|6.371650|4.560162|4.330804|3.314440|2.839798|2.901384|3.525435|4.402193|2.133986|4.369321|3.740464|3.163043|2.816350|3.002146|6.364648|2.662514|2.411935|2.240897|2.009047|1.976261|15.627082|2.902786|2.692967|2.810672|3.182872|24.155593|4.124595|0.145465|0.169557|0.209194|0.500000| |7.303892|16.472144|17.544917|8.969245|7.644101|0.153999|4.619839|3.554638|3.435354|2.766900|2.414767|2.454471|2.894797|3.812631|1.880066|4.186627|3.955867|3.334937|3.127088|3.480655|7.300279|3.177458|2.792306|2.603330|2.258734|2.171490|17.204981|3.701622|3.451859|3.750289|4.451667|32.713473|4.818609|0.147431|0.217086|0.178803|0.301954|0.500000| |4.232123|10.313473|8.760428|17.612084|12.321448|0.182830|7.179347|4.618648|3.860528|3.037444|2.769204|3.009797|3.826391|4.697694|2.222181|6.679623|5.179042|3.864703|3.399893|3.869645|9.238376|3.355661|3.149538|2.889798|2.583541|2.557473|20.432166|3.554636|3.039246|3.042882|3.572812|31.450198|4.885161|0.100039|0.111057|0.111298|0.215788|0.204469|0.500000| |4.813298|12.499322|8.900731|17.699356|12.431195|0.219453|5.607821|4.159085|3.751413|2.999475|2.683801|2.819015|3.431581|4.382318|2.114682|7.439181|7.245832|5.117212|4.610339|5.556921|14.285120|4.551291|3.912350|3.416384|2.894305|2.844553|23.896966|4.971180|4.075396|3.939765|4.590443|43.115716|6.337519|0.115909|0.129980|0.115219|0.173772|0.225144|0.301233|0.500000| |4.755519|11.267449|7.228812|7.426090|12.396287|0.217118|17.664281|8.904817|6.935986|4.686169|3.995385|4.282599|5.844332|6.128257|2.810520|5.608866|4.159122|3.482276|2.894142|2.966716|6.420851|2.522769|2.336535|2.131157|1.959524|1.988582|15.958478|2.575927|2.339883|2.326814|2.549821|20.300580|3.942642|0.116087|0.110335|0.137154|0.240430|0.144791|0.196084|0.147076|0.500000| |3.486100|7.997821|5.173305|6.746330|12.389283|0.181910|17.626866|8.817050|5.579593|4.189080|3.970412|4.748630|7.273424|7.072918|3.087790|7.234438|4.664208|3.716728|3.030895|3.145752|7.066485|2.645575|2.536680|2.301941|2.155498|2.228499|17.922288|2.607960|2.300230|2.237857|2.461353|20.539134|4.070021|0.088336|0.086010|0.096341|0.150930|0.115474|0.206679|0.143814|0.301991|0.500000| |5.174336|11.002404|4.964799|4.686388|8.422240|0.213898|7.004157|8.845093|17.698124|8.926924|5.626514|4.927899|5.631233|6.514626|3.124998|4.625959|3.953798|3.756842|3.040003|2.880854|5.790443|2.399361|2.149936|1.925107|1.763477|1.808393|14.838600|2.398557|2.252215|2.191901|2.279956|17.490678|3.927023|0.148924|0.111780|0.142963|0.139598|0.108833|0.111369|0.111628|0.200188|0.140618|0.500000| |3.272724|6.255981|3.032648|2.992468|5.046660|0.116456|4.107439|5.655562|8.950511|17.727226|8.947554|5.657720|4.969661|7.465239|3.901983|3.331940|3.022228|3.094725|2.564957|2.347151|4.492236|1.992599|1.818495|1.636472|1.529261|1.589000|12.947812|1.940543|1.847322|1.776109|1.806313|13.712212|3.376322|0.098495|0.076948|0.091026|0.085035|0.072527|0.075434|0.076155|0.110381|0.096262|0.215603|0.500000| |2.409102|4.688763|2.434290|2.533605|4.254129|0.091099|3.554757|4.947615|5.645670|8.940818|17.770579|8.876490|5.629013|12.475897|7.400647|3.059836|2.728252|2.782542|2.315151|2.126107|4.072195|1.819944|1.712965|1.548527|1.479265|1.561942|12.620714|1.732986|1.628569|1.552460|1.585260|12.244788|3.087012|0.069662|0.059105|0.066959|0.068515|0.059473|0.066594|0.065227|0.090981|0.090390|0.124311|0.217285|0.500000| |2.660678|5.661440|3.276294|3.852641|6.966632|0.125623|6.980424|8.867976|5.619494|4.969607|5.663494|8.970211|17.720554|13.618942|4.892461|5.310744|3.864610|3.416137|2.746619|2.694056|5.660986|2.267105|2.207954|1.994723|1.920162|2.042830|16.469714|2.148835|1.925727|1.837781|1.954448|15.983590|3.624890|0.071422|0.066096|0.073564|0.093322|0.077794|0.109003|0.094110|0.148890|0.220750|0.123412|0.107822|0.124288|0.500000| |1.950329|3.781156|2.053348|2.167851|3.508932|0.071598|2.979537|3.797791|3.737708|4.568607|6.700007|7.052118|4.777063|16.423685|17.581709|2.593934|2.289429|2.275681|1.947176|1.832938|3.523693|1.604279|1.551613|1.423874|1.385969|1.470075|11.611806|1.525229|1.426370|1.366492|1.406662|10.914665|2.710152|0.054983|0.048980|0.054765|0.058546|0.051085|0.059097|0.055949|0.076619|0.081213|0.086690|0.112798|0.221293|0.120831|0.500000| |1.793121|3.514053|1.938711|2.098178|3.377051|0.067573|2.802193|3.416427|3.180732|3.613524|4.893387|5.892527|4.428350|16.980588|17.670311|2.606645|2.308158|2.288019|1.966471|1.857332|3.569908|1.629401|1.601589|1.470001|1.448745|1.554977|12.241553|1.528507|1.416986|1.347658|1.388961|10.907776|2.748310|0.050156|0.045607|0.049810|0.054687|0.048658|0.057901|0.054816|0.070574|0.078969|0.074971|0.088867|0.145063|0.122279|0.299914|0.500000| |1.955873|3.834871|2.059666|2.216777|3.644595|0.075015|2.960348|3.773736|3.716191|4.550641|6.689493|7.011250|4.744362|16.418451|17.578283|2.812103|2.535129|2.589282|2.188176|2.016657|3.836740|1.742634|1.683190|1.525919|1.486847|1.596180|12.808268|1.626469|1.514066|1.429914|1.460387|11.431396|2.965163|0.055621|0.049315|0.053824|0.057412|0.051348|0.059729|0.058227|0.074060|0.080182|0.086138|0.112460|0.222808|0.119919|0.298397|0.299967|0.500000| |3.237201|7.457852|4.168475|5.614548|12.398889|0.216380|7.466229|7.327444|5.509782|4.484046|4.341965|5.061887|6.797751|7.538951|3.336062|17.678087|9.049647|6.871342|4.657610|4.479132|10.309011|3.371871|3.153028|2.679163|2.485239|2.676172|23.419085|3.058224|2.630429|2.410849|2.546940|21.955229|5.201872|0.087421|0.080861|0.083495|0.106285|0.097709|0.142547|0.147398|0.147570|0.196362|0.134710|0.103380|0.099563|0.185260|0.083209|0.084292|0.092596|0.500000| |3.181449|7.393485|4.617040|7.200073|12.360524|0.181788|6.765257|5.221177|4.066152|3.330143|3.208274|3.683622|4.809189|5.842576|2.676041|17.617551|8.935226|5.657581|4.458690|4.922808|13.032997|3.834330|3.733437|3.201844|2.948250|3.130705|26.930790|3.539846|2.913194|2.693184|2.960120|27.238925|5.546317|0.082414|0.082299|0.082126|0.115534|0.111569|0.205103|0.195580|0.143877|0.209166|0.106999|0.080178|0.076439|0.144486|0.068193|0.069962|0.072845|0.300616|0.500000| |3.107751|6.701808|3.368127|3.971780|6.840879|0.155853|3.982533|4.181071|4.142756|3.798371|3.537985|3.553823|3.847366|5.517963|2.734436|6.378777|8.823973|17.782437|8.460075|5.854207|10.444844|4.027162|3.440003|2.781041|2.509426|2.718103|25.391460|3.417513|3.026299|2.619829|2.595307|21.587184|6.765362|0.089731|0.079478|0.076646|0.082696|0.083849|0.095541|0.117936|0.094738|0.099968|0.111223|0.097233|0.087844|0.098936|0.069329|0.069250|0.081016|0.189217|0.136017|0.500000| |2.701168|5.496579|2.846806|3.232428|4.704608|0.102529|2.777887|2.713927|2.698310|2.503585|2.351129|2.358326|2.525351|3.841426|1.974528|4.046630|5.846953|8.447248|17.845142|8.845350|10.463037|6.367795|4.742790|3.581623|3.070035|3.281547|32.639946|4.692840|4.197571|3.272496|3.035030|25.062961|13.012499|0.077423|0.073633|0.065801|0.068947|0.076181|0.079679|0.103424|0.070295|0.072559|0.076022|0.066901|0.060674|0.067743|0.051109|0.051588|0.057721|0.105732|0.099515|0.193171|0.500000| |2.142052|4.230533|2.525879|2.863954|3.504216|0.068727|2.183014|1.951082|1.837138|1.664303|1.593560|1.664772|1.842111|2.803581|1.433515|2.807827|3.234280|2.983596|3.497917|4.509966|7.433991|6.564499|8.903718|17.767633|8.617196|5.745207|37.690990|6.864959|5.384096|4.598666|4.807384|44.910298|9.327647|0.056669|0.062319|0.054386|0.062641|0.074398|0.078955|0.093496|0.057870|0.061266|0.052103|0.043985|0.041142|0.052310|0.037738|0.038633|0.040091|0.068858|0.081897|0.071150|0.090691|0.500000| |1.728702|3.400105|2.032345|2.316073|2.955089|0.057176|1.920005|1.748635|1.625572|1.497930|1.468610|1.555955|1.704326|2.682914|1.380331|2.424085|2.665267|2.482875|2.769536|3.289505|5.670488|4.006651|5.714799|8.593238|17.755410|8.911451|37.719084|3.675382|3.129752|2.820982|2.951989|25.669263|6.306056|0.046042|0.049237|0.044883|0.052041|0.058241|0.065784|0.071848|0.050432|0.055171|0.045174|0.039397|0.038222|0.049275|0.036132|0.037754|0.038476|0.061562|0.072532|0.061204|0.072936|0.202430|0.500000| |1.683248|3.355096|1.972951|2.297876|3.088633|0.059578|2.021319|1.884090|1.733385|1.616339|1.614379|1.731815|1.882778|3.030755|1.558738|2.664488|2.942439|2.794642|3.062935|3.473750|5.989273|3.826527|5.406838|5.690514|8.772732|17.785106|55.465948|3.164826|2.675792|2.351350|2.418144|21.175037|6.187653|0.045367|0.046901|0.043776|0.050772|0.054787|0.064906|0.070222|0.051833|0.058500|0.047251|0.042173|0.042115|0.054958|0.040206|0.042949|0.043712|0.069580|0.079978|0.069593|0.080746|0.122745|0.203565|0.500000| |2.723081|5.157544|2.809064|2.938206|3.662587|0.077559|2.221596|2.041069|2.031696|1.846816|1.708157|1.712604|1.860470|2.808356|1.453185|2.769566|3.384748|3.451989|4.390469|5.077692|7.253994|6.730931|4.737032|4.281517|3.271156|2.993728|24.576900|8.950246|17.781407|8.590112|5.739155|37.748671|13.638974|0.074927|0.081732|0.065918|0.067381|0.083340|0.074239|0.096920|0.059942|0.058889|0.059648|0.050146|0.044290|0.050680|0.038658|0.038406|0.041291|0.068716|0.073669|0.083071|0.123545|0.129368|0.081182|0.071462|0.500000| 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