Version2.1 2021-01-08T19:26:27Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 05-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC[NH+](CC)c1ccc(cc1)CN([C@@H]2CCS(=O)(=O)C2)C(=O)c3c(cnc(n3)S(=O)(=O)C)Cl C54421882 RHF 6-31G(d) (6D,7F) CC[NH+](CC)c1ccc(cc1)CN([C@@H]2CCS(=O)(=O)C2)C(=O)c3c(cnc(n3)S(=O)(=O)C)Cl C01[X(C21H28Cl1N4O5S2)] 177 C1 563 CC[NH+](c1ccc(cc1)CN(C(=O)c1nc(ncc1Cl)S(=O)(=O)C)[C@@H]1CCS(=O)(=O)C1)CC CC[NH+](c1ccc(cc1)CN(C(=O)c1nc(ncc1Cl)S(=O)(=O)C)[C@@H]1CCS(=O)(=O)C1)CC CC[NH+](CC)c1ccc(CN([C@@H]2CC[S](=O)(=O)C2)C(=O)c3nc(ncc3Cl)[S](C)(=O)=O)cc1 InChIKey=KVHOGSSCSMCATI-QGZVFWFLSA-O InChI=1S/C21H27ClN4O5S2/c1-4-25(5-2)16-8-6-15(7-9-16)13-26(17-10-11-33(30,31)14-17)20(27)19-18(22)12-23-21(24-19)32(3,28)29/h6-9,12,17H,4-5,10-11,13-14H2,1-3H3/p+1/t17-/m1/s1 InChI=1/C21H27ClN4O5S2/c1-4-25(5-2)16-8-6-15(7-9-16)13-26(17-10-11-33(30,31)14-17)20(27)19-18(22)12-23-21(24-19)32(3,28)29/h6-9,12,17H,4-5,10-11,13-14H2,1-3H3/p+1/t17-/m1/s1/fC21H28ClN4O5S2/h25H/q+1 CC[NH+](CC)c1ccc(cc1)CN([C@@H]2CCS(=O)(=O)C2)C(=O)c3c(cnc(n3)S(=O)(=O)C)Cl C01[X(C21H28Cl1N4O5S2)] 177 C01 563 CC[NH+](c1ccc(cc1)CN(C(=O)c1nc(ncc1Cl)S(=O)(=O)C)[C@@H]1CCS(=O)(=O)C1)CC CC[NH]([C]1[CH][CH][C]([CH][CH]1)CN(C(=O)[C]1[N][C]([N][CH][C]1Cl)[S@]([O])(=O)C)[C@@H]1CC[S@@](=O)([O])C1)CC CC[NH](CC)[C]1[CH][CH][C]([CH][CH]1)CN([C@@H]2CC[S]([O])(=O)C2)C(=O)[C]3[N][C]([N][CH][C]3Cl)[S](C)([O])=O InChIKey=ZYHNDOUINJAOIO-QGZVFWFLSA-N InChI=1S/C21H28ClN4O5S2/c1-4-25(5-2)16-8-6-15(7-9-16)13-26(17-10-11-33(30,31)14-17)20(27)19-18(22)12-23-21(24-19)32(3,28)29/h6-9,12,17,25H,4-5,10-11,13-14H2,1-3H3/t17-/m1/s1 InChI=1/C21H28ClN4O5S2/c1-4-25(5-2)16-8-6-15(7-9-16)13-26(17-10-11-33(30,31)14-17)20(27)19-18(22)12-23-21(24-19)32(3,28)29/h6-9,12,17,25H,4-5,10-11,13-14H2,1-3H3/t17-/m1/s1 4332.3562013936 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0.8433 0.7375 0.6021 0.4795 0.7857 0.8571 0.7007 0.2529 0.1019 0.0713 0.0749 0.2326 0.5049 0.8326 0.6220 0.1498 0.4868 0.6035 0.4074 0.1293 0.7965 0.8396 0.7608 0.8408 0.8310 0.8311 0.8137 0.8504 0.6991 0.5765 0.8515 0.8345 0.3711 0.2564 0.4504 0.3453 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 61 6 6 7 1 6 6 6 6 6 6 6 6 6 7 6 1 6 6 16 8 8 6 6 8 6 6 6 7 6 7 16 8 8 6 17 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 12.00000 14.00307 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 1.00783 12.00000 12.00000 31.97207 15.99491 15.99491 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 14.00307 12.00000 14.00307 31.97207 15.99491 15.99491 12.00000 34.96885 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 12015.0980 25789.2379 30454.2399 0.99984 0.01749 -0.00345 -0.01757 0.99950 -0.02635 0.00299 0.02641 0.99965 1 0.00721 0.00336 0.00284 0.15021 0.06998 0.05926 16.68 26.86 41.09 47.23 51.80 58.34 79.48 89.11 109.06 111.59 125.80 133.03 142.60 177.23 192.32 211.54 232.62 243.78 271.91 280.64 289.25 309.85 330.10 345.48 367.26 396.41 397.83 404.46 415.07 455.28 480.85 507.55 528.72 530.46 557.52 563.56 582.18 599.85 627.63 654.96 661.65 677.96 692.01 705.74 717.75 740.10 777.16 785.97 792.71 860.02 880.92 898.53 915.97 942.75 994.08 1047.35 1068.72 1082.51 1128.87 1130.45 1171.35 1202.35 1225.33 1238.56 1243.56 1253.85 1278.86 1314.22 1322.72 1329.52 1356.30 1371.16 1379.53 1417.27 1422.57 1480.14 1511.31 1545.90 1564.54 1578.23 1580.50 1582.00 1586.22 1589.56 1595.55 1599.09 1613.55 1621.55 1665.79 1695.11 1699.54 1726.15 1728.33 1753.37 1772.42 1785.24 1808.87 1812.61 1833.24 1836.58 1860.12 1870.37 1886.59 1899.32 1916.96 1937.80 1957.26 1982.67 2022.25 2024.62 2043.07 2053.51 2066.43 2071.34 2109.94 2119.68 2133.53 2139.57 2145.13 2166.46 2191.88 2193.15 2210.58 2231.52 2244.46 2262.05 2268.05 2277.32 2285.02 2286.93 2292.70 2302.65 2317.38 2324.30 2343.99 2345.35 2348.51 2351.93 2359.96 2365.39 2367.71 2387.50 2398.77 2433.61 2510.05 2577.63 2588.43 2610.60 2805.35 4632.37 4637.25 4671.10 4699.28 4705.66 4716.03 4718.47 4720.91 4731.82 4738.95 4741.63 4764.41 4778.39 4790.17 4795.43 4800.39 4811.65 4815.65 4817.56 4826.39 4830.84 4831.47 4846.61 4884.14 4892.50 4905.46 4911.55 5321.68 0.528553 0.559337 0.560281 0.462862 -2657.253431 -2657.222647 -2657.221703 -2657.319121 3.267416D-04 MUNgauss RevisionA2.0 retrievium 08-Jan-2021 DUDE CC[NH+](CC)c1ccc(cc1)CN([C@@H]2CCS(=O)(=O)C2)C(=O)c3c(cnc(n3)S(=O)(=O)C)Cl C54421882 RHF 6-31G(d) (6D,10F) C1 515.118967 |X|Y|Z| 68.417909 109.403106 45.943781 70.060849 20 6 7 16 16 3 1 |36.858105| |12.547021|36.858105| |7.547053|12.545112|53.358707| |7.226714|9.339892|25.722282|0.500000| |4.941571|7.604305|17.129683|0.259931|36.858105| |3.794765|4.934639|10.280689|0.199954|12.539443|36.858105| |6.288713|7.629285|17.577710|0.263686|7.618494|6.299740|36.858105| |5.313945|5.424444|10.526765|0.216522|5.392493|5.263058|13.813447|36.858105| |4.150016|4.084780|6.937805|0.138233|4.043331|4.075936|7.972572|13.719995|36.858105| |3.764340|3.804007|6.111433|0.114409|3.756149|3.688795|6.881172|7.910666|13.752088|36.858105| |4.073966|4.390939|6.951111|0.120676|4.347939|4.028244|8.008257|6.895308|7.964403|13.680653|36.858105| |5.138792|6.183530|10.493488|0.161988|6.158788|5.142071|13.770105|7.918612|6.863278|7.891444|13.817771|36.858105| |2.972897|2.948176|4.502939|0.086349|2.911729|2.910284|4.446431|4.980419|7.447806|12.553960|7.650585|5.043947|36.858105| |2.744412|2.626144|3.943493|0.078226|2.533277|2.551259|3.706430|4.377278|6.389225|7.513875|5.065441|3.873459|12.986352|53.358707| |2.316969|2.251226|3.403950|0.068433|2.258710|2.339069|3.076129|3.601205|4.864195|5.245929|3.904793|3.155746|7.640941|17.585169|36.858105| |2.312749|2.296459|3.549503|0.071191|2.393813|2.533252|3.230205|3.782855|5.118996|5.524920|4.110631|3.316843|7.675626|12.720058|17.677644|0.500000| |2.196481|2.101814|3.166168|0.065197|2.095708|2.186109|2.773707|3.318247|4.251743|4.108138|3.176527|2.724626|5.000696|10.145340|12.173529|0.247605|36.858105| |1.891215|1.810318|2.674228|0.054919|1.796602|1.863040|2.279892|2.625868|3.189313|3.173814|2.602897|2.268241|3.836611|7.071054|7.530906|0.165641|12.425705|36.858105| |1.761806|1.718981|2.539365|0.051396|1.738025|1.807140|2.166855|2.422590|2.926605|3.069218|2.584012|2.217801|3.868851|6.560248|7.270521|0.174435|7.292956|10.703976|388.023441| |1.598256|1.555252|2.262509|0.045695|1.555847|1.602458|1.900813|2.084764|2.453512|2.587628|2.250982|1.956857|3.184216|5.175944|4.945140|0.121006|4.946369|7.112566|94.680988|73.516695| |1.711512|1.694609|2.538618|0.051500|1.763936|1.868287|2.156504|2.409576|2.877348|2.980192|2.530652|2.195091|3.631288|5.742708|6.234070|0.178834|6.251763|7.297569|94.108594|13.589548|73.516695| |2.016388|1.968828|2.912111|0.058080|1.969312|2.022390|2.558973|2.853410|3.601219|4.025042|3.286981|2.690636|5.736434|10.287071|12.351361|0.248200|7.507585|7.352665|76.025515|12.687653|13.034304|36.858105| |2.755902|2.545733|3.683328|0.073535|2.333569|2.296448|3.352816|3.883732|5.197544|5.710243|4.294797|3.461064|7.641823|19.020151|7.889169|0.162013|6.335329|4.967580|30.734239|6.494953|6.404337|6.149959|36.858105| |2.408742|2.220730|3.180394|0.064181|2.047405|2.027839|2.792573|3.195063|4.027936|4.230938|3.385722|2.845089|5.354828|11.526208|7.076198|0.141987|6.661635|5.887622|34.009181|7.402032|6.656243|6.301957|15.930670|73.516695| |3.272909|2.907306|4.058101|0.080260|2.491873|2.368496|3.691112|4.153603|5.242026|5.728097|4.623477|3.825018|6.320762|10.364835|4.971439|0.116817|4.335980|3.601098|22.865184|5.075957|4.988164|4.193542|12.515552|14.586876|36.858105| |3.368261|2.858383|3.887476|0.078636|2.363258|2.229687|3.376904|3.814477|4.436961|4.386724|3.730639|3.335826|4.438836|7.117524|3.938402|0.094829|3.793486|3.254597|19.952265|4.522031|4.394187|3.387903|7.492874|11.606472|13.699730|36.858105| |3.746495|3.053258|3.953170|0.079336|2.382170|2.187730|3.319427|3.559524|3.851376|3.839412|3.522644|3.293753|3.693857|5.403260|3.121669|0.078089|2.985049|2.631819|16.679824|3.854280|3.749034|2.776405|5.031610|8.005370|8.048289|13.722060|36.858105| |4.088556|3.354164|4.205846|0.081945|2.530937|2.270756|3.537060|3.584691|3.801961|3.990754|3.899622|3.666053|3.757433|5.113487|2.935291|0.074942|2.704587|2.391483|15.704962|3.643322|3.569877|2.654106|4.495032|6.927900|7.009283|8.049797|14.472657|53.358707| |3.934024|3.428943|4.430232|0.084188|2.688032|2.420116|3.911844|3.899763|4.326045|4.943071|4.919117|4.320226|4.726979|6.076110|3.330787|0.085169|2.921005|2.548545|17.139777|3.939036|3.892176|3.011854|5.232247|7.570298|8.471732|7.254797|8.559562|19.806578|36.858105| |3.498333|3.164407|4.328860|0.082887|2.660479|2.470482|3.990264|4.182926|5.097349|6.233658|5.572946|4.437370|6.606738|8.616474|4.286777|0.106485|3.575716|3.040724|20.470206|4.610780|4.573859|3.790005|7.788153|10.020719|14.410667|8.111295|7.112575|11.077932|14.620338|53.358707| |3.919018|3.646690|4.529669|0.082789|2.832715|2.475075|3.875087|3.525483|3.694330|4.364859|5.044056|4.645727|4.041772|4.793034|2.785204|0.074048|2.420346|2.147186|14.961757|3.474490|3.479311|2.592248|3.741465|5.626600|4.891169|4.307667|4.923506|9.792084|10.559879|9.746476|388.023441| |3.285380|3.243690|4.243756|0.077069|2.761448|2.470568|3.716136|3.378622|3.667181|4.648206|5.609745|4.725986|4.554751|5.082519|2.971573|0.079915|2.490298|2.216651|15.935727|3.697767|3.718965|2.829146|3.788711|5.659607|4.556604|3.755880|3.926103|6.850270|7.250531|9.061773|94.610653|73.516695| |5.228128|4.847195|5.571313|0.098944|3.370645|2.805888|4.594259|3.913986|3.810111|4.272156|5.178924|5.454638|3.641835|4.308191|2.552270|0.069208|2.266678|1.991932|13.732100|3.166177|3.250164|2.324324|3.267154|4.947394|4.151929|3.867037|4.495720|8.478454|7.344321|7.387604|94.040716|13.662249|73.516695| |3.181219|2.928435|3.578398|0.067067|2.308708|2.041070|2.891991|2.692376|2.784457|3.132792|3.440774|3.275515|3.040412|3.815843|2.323756|0.061320|2.075238|1.900667|13.274516|3.159382|3.070000|2.233935|3.053856|4.863846|3.838601|3.643326|4.337812|8.281148|6.753951|6.714240|76.609022|12.924397|12.927421|36.858105| |2.880098|2.470072|3.416892|0.071146|2.116932|2.045808|2.873532|3.337577|3.800270|3.532829|2.982311|2.740456|3.608556|6.086744|3.758207|0.089941|4.044202|3.550410|20.316527|4.615104|4.454213|3.221967|6.001765|11.147234|6.899818|11.075034|7.122199|6.621009|4.387339|6.537727|22.088856|5.006057|5.180307|2.766518|448.794386| |17.638888|8.792991|9.100732|0.172325|4.450221|3.571229|6.819331|5.960782|4.842170|4.447792|4.771090|5.809627|3.446428|4.312191|2.592556|0.071085|2.427366|2.069751|13.658344|3.085457|3.282462|2.236838|3.224954|4.906261|3.996859|4.098128|4.639101|7.091373|5.031285|5.926259|34.090923|6.864376|11.585984|3.674144|26.689159|0.500000| |17.590944|8.983994|7.538639|0.147047|4.134114|3.231097|4.732818|4.098465|3.409998|3.202023|3.481610|4.214828|2.635166|3.342733|2.095014|0.057716|1.992388|1.745020|11.615204|2.663927|2.809861|1.857395|2.504345|3.953938|2.983810|3.117876|3.584324|5.427961|3.719687|4.370841|27.237962|5.592844|9.208668|3.275283|21.499397|0.303060|0.500000| |17.544356|8.786741|9.361431|0.214878|4.632517|3.753496|5.658269|5.305065|4.068530|3.515345|3.618967|4.392208|2.812782|3.629710|2.285397|0.063370|2.215540|1.903219|12.437229|2.813246|3.030434|1.973026|2.681016|4.216328|3.123415|3.292941|3.586858|5.040998|3.494006|4.359036|23.601921|5.068756|7.327906|2.773472|23.613412|0.298801|0.302120|0.500000| |8.829180|17.627970|12.411410|0.223528|7.374877|4.796993|5.629536|4.371658|3.400093|3.164045|3.569683|4.735415|2.541432|3.128868|2.014044|0.057200|1.902983|1.658202|11.217972|2.552447|2.779440|1.779930|2.232970|3.522540|2.506190|2.491780|2.658138|3.914453|2.894773|3.657162|21.902169|4.942417|7.012024|2.589262|17.746936|0.172872|0.216687|0.209206|0.500000| |8.821449|17.661834|12.325593|0.182034|6.872380|4.530836|7.028581|4.848129|3.896051|3.863265|4.748563|6.875872|3.019991|3.577866|2.240248|0.063465|2.054770|1.781314|12.196008|2.771166|2.998019|1.984759|2.544091|3.929095|2.920004|2.810493|3.022132|4.675503|3.615120|4.476605|29.364082|6.556084|10.307657|3.248511|19.087334|0.213115|0.211736|0.172617|0.301215|0.500000| |4.801582|7.333888|12.420363|0.224732|17.629002|8.837023|5.622971|4.362671|3.381360|3.138739|3.544180|4.714331|2.520072|3.053400|2.019515|0.058911|1.900379|1.649894|11.313858|2.553808|2.864720|1.780475|2.101930|3.323645|2.253602|2.177427|2.223175|3.204944|2.449705|3.251625|18.392067|4.419797|5.491248|2.169755|15.850279|0.114360|0.116131|0.127888|0.239183|0.177007|0.500000| |4.545896|6.929258|12.361833|0.182280|17.653853|8.788026|6.981298|4.801389|3.840279|3.792405|4.666794|6.798448|2.967117|3.434992|2.240145|0.065968|2.042601|1.763057|12.300535|2.765357|3.114458|1.979158|2.319492|3.606942|2.482773|2.319756|2.349349|3.462588|2.751802|3.692346|21.447117|5.331024|6.418251|2.438071|16.422917|0.117642|0.109387|0.112961|0.180230|0.205284|0.302114|0.500000| |3.581646|4.460687|9.151729|0.172739|8.770175|17.617056|6.876716|5.922649|4.738942|4.329220|4.704240|5.833020|3.349786|3.902372|2.631438|0.080681|2.417288|2.033441|14.134226|3.099295|3.680197|2.248966|2.514228|3.905934|2.549821|2.350282|2.266399|3.196571|2.549952|3.623733|18.402352|4.687597|5.109190|2.101307|17.208709|0.097648|0.084471|0.097327|0.114589|0.117779|0.172674|0.210480|0.500000| |3.743452|4.608354|9.325347|0.212734|8.789138|17.552832|5.646880|5.239216|3.992315|3.449719|3.582008|4.384957|2.757838|3.388901|2.304277|0.069017|2.203481|1.874041|12.738337|2.819068|3.296718|1.977284|2.258200|3.574455|2.319796|2.219390|2.168509|3.011148|2.318934|3.225231|16.444634|4.047852|4.628576|1.930326|16.679834|0.096772|0.088212|0.107771|0.127113|0.112326|0.210315|0.172316|0.300129|0.500000| |3.228853|4.125367|7.537328|0.146436|8.964237|17.586964|4.741563|4.069045|3.357757|3.143444|3.447959|4.222031|2.579891|3.095892|2.118626|0.063767|1.983378|1.716642|11.968535|2.673977|3.110794|1.865236|2.056710|3.266243|2.106894|1.986710|1.956313|2.769438|2.163934|2.997282|15.949999|4.019227|4.476581|1.885529|14.727875|0.084257|0.079033|0.088326|0.115918|0.108905|0.215706|0.211597|0.301944|0.302521|0.500000| |5.183764|5.093232|9.672625|0.237123|5.080424|5.149980|8.889668|17.695626|8.919522|5.638512|4.961897|5.628222|4.061105|5.198941|3.283447|0.095143|3.182958|2.539470|16.337013|3.528720|4.083152|2.619599|3.488363|5.282777|3.687679|3.564319|3.342261|4.443932|3.398719|4.869208|21.652284|5.116667|6.006115|2.424262|26.454385|0.151932|0.111481|0.157533|0.119856|0.120224|0.119980|0.119572|0.151728|0.155789|0.110891|0.500000| |3.604478|3.447409|5.647953|0.117613|3.412619|3.532658|5.672323|8.944177|17.743136|8.910486|5.651506|4.949052|6.841135|9.687121|5.643827|0.161988|5.257617|3.706433|23.065955|4.730964|5.649224|3.915244|5.721364|8.013765|5.311235|4.612468|3.804400|4.859962|3.929908|6.404109|23.060895|5.698918|5.803355|2.546625|33.985360|0.114511|0.084317|0.101585|0.082346|0.090419|0.081894|0.089208|0.111789|0.099385|0.082780|0.216539|0.500000| |3.523813|3.788876|5.656048|0.099235|3.740867|3.466284|5.690814|4.966347|5.657321|8.897907|17.743827|9.000216|7.150144|6.395103|3.705272|0.107367|2.960869|2.496876|18.134822|4.009157|4.414298|3.286456|4.058334|5.790827|4.329724|3.455441|3.303090|5.091717|4.853727|7.451406|38.626594|12.296724|9.247483|3.678005|22.099167|0.112730|0.087049|0.086606|0.088086|0.117514|0.087233|0.115077|0.110267|0.085418|0.085666|0.107723|0.124112|0.500000| |4.915978|6.374479|9.589302|0.144498|6.345029|4.919819|8.850107|5.625649|4.949858|5.639843|8.983231|17.746777|4.132136|4.442081|2.732597|0.079364|2.380380|2.031035|14.289592|3.200622|3.539853|2.407432|2.985954|4.471698|3.308794|2.941838|2.984948|4.617523|3.947749|5.292051|32.990831|8.484552|10.142093|3.341003|19.557650|0.146899|0.117366|0.113450|0.138800|0.224837|0.137855|0.222262|0.147235|0.113312|0.117586|0.123520|0.107507|0.218680|0.500000| |2.655345|2.700671|4.188899|0.080560|2.815719|2.900447|4.025246|4.431618|6.196816|8.997654|6.517816|4.548964|17.621333|12.628480|7.828466|0.261413|4.936680|3.848596|29.325900|5.907551|7.221016|6.121150|5.769351|8.041281|4.702792|3.577856|3.056184|4.222457|3.759467|6.596832|24.248675|6.947486|5.575863|2.665341|24.710488|0.083081|0.065809|0.070340|0.065787|0.076859|0.067632|0.080072|0.094382|0.075947|0.072403|0.102913|0.162956|0.176978|0.106451|0.500000| |2.891940|2.864093|4.219900|0.079737|2.750643|2.681476|4.047432|4.238784|5.665884|8.976377|7.368777|4.835302|17.664785|12.318672|5.987359|0.159347|4.160791|3.432087|25.324320|5.447264|5.820810|5.281968|7.032319|9.071717|6.422435|4.395930|3.780156|5.457141|5.339208|10.532101|33.465911|10.173849|7.074336|3.465556|27.525908|0.093602|0.072547|0.074609|0.068647|0.083453|0.066782|0.079429|0.084211|0.069889|0.066929|0.097339|0.142023|0.224373|0.115219|0.305680|0.500000| |2.362930|2.214199|3.310879|0.068805|2.148755|2.214856|2.896591|3.535293|4.518976|4.177035|3.207569|2.790813|4.822985|9.979879|8.640950|0.183966|17.664045|8.840166|38.266790|7.313459|8.239029|5.779107|7.139118|13.617311|4.945262|4.499389|3.405491|4.061327|3.157008|5.243469|18.009599|4.517854|4.237355|2.169758|41.044421|0.073121|0.059364|0.066792|0.055469|0.059593|0.054325|0.057716|0.067309|0.062510|0.055370|0.095596|0.161097|0.081765|0.067344|0.124133|0.112543|0.500000| |2.155033|2.087841|3.197429|0.066428|2.140611|2.279868|2.780331|3.360206|4.220980|3.930045|3.071146|2.685885|4.512595|8.087458|8.809663|0.239580|17.611300|8.857699|44.286210|7.692154|11.333332|5.904406|4.896399|8.693728|3.674085|3.291689|2.679547|3.344201|2.636398|4.279698|15.943629|4.100102|3.806162|1.922193|28.172929|0.065269|0.054043|0.060885|0.052849|0.056297|0.053867|0.057497|0.070412|0.064405|0.057510|0.091139|0.146854|0.078653|0.065145|0.129242|0.103236|0.302855|0.500000| |1.879919|1.778826|2.588619|0.053068|1.727414|1.766908|2.195032|2.504570|3.011444|3.021104|2.508853|2.192396|3.640411|6.753309|6.322970|0.135945|8.720726|17.626837|57.768343|12.207793|9.682545|6.585186|5.254536|12.354756|3.817112|3.510034|2.804577|3.419083|2.650239|4.296066|15.614675|3.994150|3.581827|1.969484|31.473385|0.057429|0.048530|0.052438|0.045236|0.048731|0.044282|0.047199|0.053116|0.049299|0.045240|0.067244|0.095807|0.067319|0.054841|0.098084|0.093293|0.220986|0.174568|0.500000| |1.770248|1.698614|2.511528|0.051973|1.700455|1.776528|2.107862|2.422612|2.863904|2.790246|2.330877|2.073295|3.233139|5.611621|5.541743|0.135088|8.650840|17.620767|57.282154|10.917225|12.067612|5.350730|3.954703|8.059792|3.059176|2.854732|2.363396|2.925239|2.257341|3.574461|13.726806|3.518689|3.225512|1.725660|25.571036|0.053225|0.045495|0.049874|0.043583|0.046184|0.043651|0.046115|0.053550|0.050024|0.045705|0.066200|0.092220|0.061911|0.051900|0.091011|0.080778|0.194020|0.222179|0.298685|0.500000| |1.957174|1.941599|2.878900|0.056874|1.976217|2.035942|2.527157|2.754218|3.426064|3.958598|3.343600|2.712897|5.664872|8.569325|8.628152|0.224599|5.549237|5.357627|57.280511|10.940452|12.206113|17.611698|5.011158|8.627034|3.721473|3.011069|2.547853|3.399903|2.869748|4.841630|18.251494|5.116866|4.088714|2.207945|22.462592|0.059971|0.050182|0.052794|0.048855|0.054871|0.049478|0.055741|0.063287|0.054710|0.052546|0.069559|0.099855|0.095337|0.068112|0.183250|0.150325|0.124600|0.134551|0.134443|0.119324|0.500000| |2.009827|1.938823|2.817067|0.056056|1.890378|1.910586|2.458814|2.710896|3.372810|3.792997|3.162460|2.599558|5.323212|9.660119|8.679289|0.175247|6.259106|6.551459|57.705352|12.270467|9.713758|17.652316|6.838160|13.609878|4.599740|3.679276|2.988122|3.870430|3.230928|5.589431|19.384886|5.268812|4.251406|2.383536|27.706652|0.062338|0.051849|0.054390|0.048637|0.054515|0.047755|0.052928|0.058369|0.051855|0.048975|0.069180|0.100504|0.088935|0.065146|0.145530|0.146258|0.149328|0.134374|0.189220|0.134032|0.298755|0.500000| |3.577526|2.871119|3.667421|0.074734|2.227532|2.047372|2.970818|3.175023|3.322378|3.225296|2.998799|2.887387|3.087184|4.525126|2.734460|0.069049|2.693065|2.418293|15.221064|3.552488|3.442954|2.457634|4.075168|6.815486|5.680874|8.891245|17.741554|12.666951|5.958625|6.911232|28.875971|5.844422|6.899552|3.824074|54.380676|0.118412|0.097548|0.097576|0.070832|0.077871|0.058631|0.060545|0.058204|0.056914|0.051150|0.085417|0.092379|0.078222|0.073785|0.073088|0.086721|0.085417|0.068029|0.071755|0.061356|0.062777|0.073015|0.500000| |2.767944|2.566450|3.222576|0.061004|2.102604|1.895514|2.628509|2.502008|2.647525|3.002811|3.209524|2.963625|3.038829|3.878182|2.376896|0.062052|2.112709|1.960806|13.803625|3.320712|3.157331|2.333832|3.152912|5.101814|3.899582|3.645186|4.200735|7.578754|6.303207|6.747044|57.529276|12.054197|9.621229|17.624420|22.333863|0.088125|0.078039|0.068599|0.063598|0.077805|0.054792|0.061414|0.054600|0.049989|0.048842|0.062828|0.068333|0.096429|0.082718|0.074249|0.097788|0.061071|0.053857|0.056930|0.049208|0.064070|0.070296|0.102477|0.500000| |3.014725|2.864146|3.470133|0.064531|2.286898|2.008937|2.749925|2.509636|2.555326|2.871454|3.233647|3.146963|2.765040|3.422198|2.124647|0.056810|1.899107|1.746726|12.325093|2.941416|2.880998|2.054577|2.667675|4.276865|3.219274|3.046176|3.517538|6.284705|5.074537|5.470670|58.483880|11.748369|11.838645|17.601717|19.294685|0.093873|0.087249|0.072660|0.071287|0.089958|0.060085|0.067986|0.057143|0.052391|0.052052|0.062940|0.064632|0.097418|0.092072|0.068802|0.086973|0.054649|0.049353|0.049908|0.044346|0.057064|0.060265|0.088435|0.298678|0.500000| |3.331693|2.957515|3.543828|0.067257|2.260415|1.990896|2.808824|2.641256|2.689688|2.927000|3.144925|3.070667|2.801721|3.605473|2.209033|0.058108|2.013683|1.846590|12.698169|3.024424|2.936265|2.104420|2.926205|4.718679|3.729668|3.748434|4.738639|9.242451|6.411839|6.194396|57.440851|9.627601|11.957590|17.651411|23.026332|0.106669|0.097729|0.081035|0.073118|0.089456|0.059677|0.065379|0.056370|0.052837|0.050981|0.067142|0.069021|0.090239|0.086218|0.068255|0.086210|0.059145|0.051914|0.053368|0.046845|0.057141|0.062287|0.120163|0.296335|0.297978|0.500000| 2654.898001 -14901.662623 5521.263818 -264.637751 -6990.138554 4332.356513 -2657.782041 2.001086 4061FFFFFFFFFFFE 45182B065038184C 4496D491C5A38396 41B786B2DFFFFFFC B7F399AAD7874900 433EEE86F91114D5