Version2.3 2021-04-03T08:47:39Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 14-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCc1cccc(c1NS(=O)(=O)c2ccc3c(c2)N(C(=O)CO3)Cc4nc(on4)CC)C C64450685 RHF 6-31G(d) (6D,7F) CCc1cccc(c1NS(=O)(=O)c2ccc3c(c2)N(C(=O)CO3)Cc4nc(on4)CC)C C01[X(C22H24N4O5S1)] 162 C1 532 CCc1onc(n1)CN1C(=O)COc2c1cc(cc2)S(=O)(=O)Nc1c(C)cccc1CC CCc1onc(n1)CN1C(=O)COc2c1cc(cc2)S(=O)(=O)Nc1c(C)cccc1CC CCc1onc(CN2C(=O)COc3ccc(cc23)[S](=O)(=O)Nc4c(C)cccc4CC)n1 InChIKey=HOYODFAMUWOXNR-UHFFFAOYSA-N InChI=1S/C22H24N4O5S/c1-4-15-8-6-7-14(3)22(15)25-32(28,29)16-9-10-18-17(11-16)26(21(27)13-30-18)12-19-23-20(5-2)31-24-19/h6-11,25H,4-5,12-13H2,1-3H3 InChI=1/C22H24N4O5S/c1-4-15-8-6-7-14(3)22(15)25-32(28,29)16-9-10-18-17(11-16)26(21(27)13-30-18)12-19-23-20(5-2)31-24-19/h6-11,25H,4-5,12-13H2,1-3H3 CCc1cccc(c1NS(=O)(=O)c2ccc3c(c2)N(C(=O)CO3)Cc4nc(on4)CC)C C01[X(C22H24N4O5S1)] 162 C01 532 CCc1onc(n1)CN1C(=O)COc2c1cc(cc2)S(=O)(=O)Nc1c(C)cccc1CC CCC1=[N][C](=NO1)CN1C(=O)CO[C]2[C]1[CH][C]([CH][CH]2)S(=O)(=O)N[C]1[C]([CH][CH][CH][C]1CC)C CC[C]1[CH][CH][CH][C](C)[C]1N[S](=O)(=O)[C]2[CH][CH][C]3OCC(=O)N(Cc4noc(CC)n4)[C]3[CH]2 InChIKey=HOYODFAMUWOXNR-UHFFFAOYSA-N InChI=1S/C22H24N4O5S/c1-4-15-8-6-7-14(3)22(15)25-32(28,29)16-9-10-18-17(11-16)26(21(27)13-30-18)12-19-23-20(5-2)31-24-19/h6-11,25H,4-5,12-13H2,1-3H3 InChI=1/C22H24N4O5S/c1-4-15-8-6-7-14(3)22(15)25-32(28,29)16-9-10-18-17(11-16)26(21(27)13-30-18)12-19-23-20(5-2)31-24-19/h6-11,25H,4-5,12-13H2,1-3H3 3605.3153591533 -1836.6030497 1-A 14244.2795 120 412 532 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -92.21095 -20.67032 -20.61801 -20.55545 -20.55257 -20.55151 -15.63283 -15.63031 -15.60245 -15.57421 -11.37348 -11.36096 -11.32812 -11.31779 -11.31382 -11.30986 -11.29512 -11.27876 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0.5549 0.5041 0.8309 0.7490 0.8120 0.8055 0.6016 0.8571 0.4728 0.6434 0.6465 0.3832 0.8255 0.8571 0.7944 0.7926 0.8465 0.8571 0.8545 0.8538 0.8513 0.8568 0.8484 0.3068 0.2733 0.6183 0.8115 0.8499 0.8455 0.7388 0.6386 0.8563 0.1224 0.0496 0.3339 0.0430 0.2929 0.8546 0.7213 0.7582 0.1125 0.8300 0.8514 0.8395 0.6172 0.4950 0.6854 0.8025 0.5615 0.8563 0.2526 0.8005 0.3000 0.3336 0.3291 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 6 6 6 6 6 6 6 6 7 16 8 8 6 6 6 6 6 6 7 6 8 6 8 6 6 7 6 8 7 6 6 6 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 12.00000 12.00000 12.00000 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 14.00307 12.00000 15.99491 12.00000 15.99491 12.00000 12.00000 14.00307 12.00000 15.99491 14.00307 12.00000 12.00000 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 1.00783 1.00783 10550.2122 17142.4680 23440.4288 0.99993 0.01128 -0.00416 -0.01131 0.99991 -0.00776 0.00407 0.00780 0.99996 1 0.00821 0.00505 0.00370 0.17106 0.10528 0.07699 12.60 22.64 35.99 42.49 49.03 60.24 75.87 96.18 105.89 124.79 149.89 162.64 173.51 192.26 217.74 232.07 253.13 280.67 290.65 310.48 318.68 360.17 394.16 400.07 425.93 441.48 467.74 518.21 522.99 534.48 551.89 577.02 616.64 626.03 647.97 654.57 694.30 716.60 732.89 761.69 790.38 798.73 809.24 846.55 876.86 887.30 930.61 937.01 946.87 968.23 1004.21 1049.57 1079.63 1108.81 1139.73 1148.92 1181.00 1185.95 1216.24 1232.09 1236.22 1276.63 1290.67 1331.32 1344.75 1353.91 1382.85 1434.71 1460.86 1474.33 1480.44 1494.30 1533.73 1550.33 1557.10 1602.46 1608.56 1609.47 1633.42 1634.46 1654.88 1668.20 1685.47 1702.81 1703.63 1712.95 1736.53 1745.37 1748.34 1756.80 1784.77 1805.56 1809.98 1859.33 1883.14 1900.95 1931.46 1986.55 1988.70 1991.18 1994.51 2033.24 2044.75 2060.22 2091.19 2094.69 2109.78 2140.22 2153.43 2184.64 2200.55 2213.99 2247.85 2251.60 2253.14 2262.92 2265.72 2305.16 2323.77 2335.96 2351.88 2352.58 2356.26 2360.67 2362.21 2362.56 2367.18 2372.28 2379.42 2386.05 2429.00 2535.36 2571.40 2579.33 2580.38 2593.11 2649.01 2848.70 4611.85 4621.32 4628.06 4631.24 4632.30 4656.50 4694.72 4715.89 4727.71 4731.94 4734.66 4735.98 4758.00 4761.58 4770.03 4821.82 4826.11 4832.97 4845.14 4868.45 4886.52 4908.65 4955.58 5467.98 0.478453 0.506419 0.507363 0.415295 -1836.124597 -1836.096631 -1836.095687 -1836.187755 3.087976D-04 MUNgauss RevisionA2.1 retrievium 03-Apr-2021 DUDE CCc1cccc(c1NS(=O)(=O)c2ccc3c(c2)N(C(=O)CO3)Cc4nc(on4)CC)C C64450685 RHF 6-31G(d) (6D,10F) C1 456.146742 |X|Y|Z| 90.417662 68.763088 36.613175 61.058858 24 6 7 8 16 17 4 2 1 |36.858105| |12.426645|36.858105| |7.483484|12.563925|36.858105| |6.027081|7.619587|13.667359|36.858105| |4.289998|5.037998|7.896091|13.835609|36.858105| |3.724711|4.426478|6.830766|7.964318|13.750307|36.858105| |3.974385|4.948408|7.811906|6.844461|7.908540|13.763085|36.858105| |5.299979|7.434234|13.674349|7.966269|6.893449|7.954883|13.577209|36.858105| |4.824469|6.502936|7.799128|5.137003|4.533667|5.134873|7.766338|13.234557|53.358707| |4.193526|4.769544|5.159319|3.875354|3.564754|4.020255|5.510508|6.967683|15.752687|388.023441| |3.292717|3.754306|3.952618|3.139311|2.969219|3.372833|4.454228|5.100672|10.664520|94.520239|73.516695| |3.940457|4.190949|4.830040|3.889961|3.745304|4.331816|5.777511|6.392419|10.261303|94.793291|13.591821|73.516695| |4.871790|4.997021|4.600866|3.512555|3.078155|3.215921|3.971702|5.107967|9.464390|76.498750|13.084481|13.147156|36.858105| |4.536749|4.785536|4.079973|3.162631|2.744186|2.813821|3.387356|4.313360|7.904206|49.555508|11.040314|8.793892|13.756411|36.858105| |4.223045|4.096462|3.400236|2.766623|2.403796|2.409664|2.782591|3.412423|5.664481|33.758039|7.759126|6.833921|7.998105|13.809366|36.858105| |4.172197|3.725792|3.160569|2.649221|2.318202|2.304113|2.606850|3.124324|4.916613|30.048809|6.661717|6.637067|6.952425|7.968046|13.778181|36.858105| |4.401216|3.804057|3.372177|2.836839|2.503782|2.504800|2.839955|3.378127|5.210558|33.710023|7.017393|7.986849|7.946417|6.816874|7.875238|13.688365|36.858105| |4.780996|4.354418|4.047707|3.278646|2.903276|2.976258|3.503079|4.262089|6.824492|49.723446|9.194951|11.858379|13.746337|7.882669|6.860738|7.970317|13.731623|36.858105| |3.773538|3.175259|2.888957|2.542378|2.283795|2.264734|2.491480|2.854687|4.194368|26.138153|5.598833|6.636295|5.128822|4.527633|5.160687|7.905601|13.470929|7.738001|53.358707| |3.148091|2.698703|2.441117|2.186368|1.978770|1.955147|2.124659|2.399211|3.514957|21.254526|4.768194|5.292264|3.972611|3.806299|4.574309|6.826038|7.894802|5.177191|18.959242|36.858105| |2.747032|2.366541|2.177490|1.992368|1.825932|1.800418|1.928510|2.136702|3.073816|18.301747|4.151269|4.652087|3.229215|3.078790|3.556712|4.783954|5.401687|4.055556|11.458100|15.945989|73.516695| |2.997545|2.645994|2.344409|2.078016|1.871010|1.851886|2.026704|2.307426|3.453891|20.619014|4.775424|4.903497|3.919295|4.097472|5.409867|8.216461|6.961364|4.658148|10.636745|12.584242|14.365057|36.858105| |3.538346|3.122206|2.663196|2.309138|2.038728|2.006253|2.217390|2.590997|3.942776|23.132698|5.303350|5.279891|4.660031|5.272863|8.101082|14.131642|8.038939|5.257165|9.486008|7.833805|9.703715|13.586390|73.516695| |3.649242|3.039544|2.882811|2.607768|2.382118|2.358992|2.549881|2.848746|4.023343|24.818707|5.220871|6.776104|4.399781|3.697108|3.882741|5.095985|7.615263|6.454964|17.857309|7.875968|12.384296|5.035280|8.152699|36.858105| |4.385254|3.413174|3.220126|2.977739|2.672425|2.565786|2.707312|3.046408|4.110931|23.913960|4.909989|6.555617|4.094202|3.469989|3.574970|4.443791|6.023110|5.572071|10.574698|5.602472|9.168946|4.095384|7.162614|12.708609|36.858105| |4.508318|3.366696|3.049753|2.866814|2.528135|2.368408|2.459516|2.785576|3.730357|20.765217|4.360367|5.448113|3.563506|3.212872|3.430951|4.239199|5.136970|4.488313|8.637249|5.324951|8.940237|4.086959|7.283651|7.545719|13.916575|53.358707| |4.805136|3.506249|3.234853|3.160232|2.774861|2.530848|2.559286|2.871086|3.699428|19.862872|4.148211|5.271861|3.242559|2.916470|3.009414|3.500955|4.097510|3.879325|6.256096|3.934711|6.703106|3.239777|5.920426|5.430152|9.254278|20.262514|36.858105| |4.808399|3.627658|3.550795|3.533998|3.162772|2.887661|2.887421|3.184022|3.988767|21.474380|4.397769|5.948390|3.357670|2.904835|2.878760|3.267268|3.944320|4.021823|5.833895|3.531289|5.987448|2.918808|5.326081|5.382616|9.147173|11.983234|14.500082|73.516695| |4.503170|3.552347|3.530498|3.353978|3.054335|2.916383|3.021682|3.334539|4.313906|24.620378|4.957626|7.089890|3.914208|3.233740|3.173393|3.697267|4.815044|5.048853|7.367337|4.133474|6.893761|3.267103|5.847368|7.826628|14.914091|11.656451|8.807522|24.642492|53.358707| |4.347142|3.242962|2.959152|2.991494|2.622555|2.339534|2.315502|2.572769|3.277648|17.027302|3.636792|4.424044|2.714944|2.532581|2.625888|2.951015|3.242785|3.076408|4.771439|3.195013|5.536579|2.781944|5.138740|3.854512|5.388961|10.382660|12.762833|14.028938|7.247059|36.858105| |3.307968|2.646801|2.513595|2.603894|2.372064|2.132029|2.075604|2.236591|2.836510|14.798767|3.213095|3.901290|2.288095|2.131118|2.189429|2.432915|2.670289|2.569330|3.976865|2.724946|4.884495|2.374823|4.270791|3.291466|4.331058|7.354693|7.579996|11.137229|6.097017|12.423232|36.858105| |3.141226|3.727494|4.970586|4.436066|5.031203|7.611700|12.602797|7.471012|8.913537|38.943339|8.742130|10.427519|3.705224|3.174163|2.602095|2.430431|2.640609|3.252839|3.169600|2.006496|3.253916|1.924131|3.691992|2.375172|2.433789|2.980239|2.233095|4.434207|3.637580|2.014792|1.833836|36.858105| |17.546805|8.794182|5.474198|4.598720|3.485454|3.097245|3.305915|4.247734|5.626737|26.528175|5.430168|6.090881|4.583636|4.601803|4.596095|4.552734|4.505328|4.527170|5.260344|3.321819|5.106305|3.252724|7.060164|3.574868|4.207954|6.235704|4.684369|7.703692|5.522851|4.387509|3.271331|2.729095|0.500000| |17.587934|8.774042|6.805467|5.414031|4.124898|3.739341|4.089970|5.407771|6.907164|34.052434|6.385497|8.298368|5.844595|4.979485|4.580691|4.753149|5.442944|6.190804|6.240658|3.614691|5.518654|3.320377|6.885407|4.514141|5.575446|7.309115|5.540074|10.259616|7.853680|4.528276|3.434219|3.287865|0.301144|0.500000| |17.554337|8.754360|6.739677|6.497245|4.565654|3.748138|3.768576|4.706259|5.517218|25.204001|5.072585|6.188769|3.899431|3.614322|3.427146|3.463174|3.694880|3.946092|4.565796|2.856063|4.555162|2.678858|5.437088|3.380074|4.210466|6.064902|5.155099|9.321298|6.136008|4.954936|3.735054|2.958051|0.301300|0.302180|0.500000| |8.863116|17.645034|8.895661|5.626632|4.192829|3.964978|4.694795|7.148707|10.527648|39.492315|7.811601|7.916629|6.096737|6.236911|5.000317|4.243453|4.174220|4.838451|4.527548|2.828142|4.335993|2.842134|6.117799|3.071195|3.307165|4.383415|3.220326|5.833541|4.543276|2.934291|2.415526|3.745631|0.214952|0.209465|0.173146|0.500000| |8.869947|17.527484|8.969389|7.026470|4.733684|4.031432|4.283026|5.813335|6.973069|27.356405|5.726846|6.075438|3.981844|4.009397|3.577049|3.242403|3.214970|3.528739|3.755464|2.417372|3.820329|2.403686|5.017186|2.639083|2.951783|4.073516|3.149392|5.677339|4.149480|3.046772|2.519714|3.310478|0.212379|0.173250|0.212452|0.304324|0.500000| |6.277084|7.140066|8.919872|17.709287|8.957859|5.660117|4.936751|5.658650|5.669024|23.537436|4.877725|5.866737|3.167393|2.927541|2.643798|2.559256|2.707424|3.022747|3.356315|2.147893|3.501147|2.044433|4.041321|2.526086|2.938225|3.979178|3.297868|6.417393|4.461919|3.245568|2.806488|3.547727|0.135703|0.146445|0.211154|0.142909|0.204601|0.500000| |3.701133|4.114465|5.627355|8.943150|17.712371|8.918029|5.636487|4.962214|4.913320|21.184800|4.530412|5.597407|2.643804|2.390943|2.139963|2.085174|2.242500|2.542078|2.838476|1.830239|3.036528|1.727500|3.314892|2.191575|2.469867|3.221209|2.630146|5.315954|3.845808|2.543779|2.354137|4.107090|0.086070|0.098390|0.112984|0.096542|0.111680|0.216005|0.500000| |3.093628|3.541984|4.930260|5.662866|8.926232|17.719254|8.949313|5.650376|5.664581|24.699837|5.390475|6.767141|2.801302|2.473360|2.147025|2.066713|2.243297|2.629463|2.803005|1.797033|2.970844|1.700730|3.236973|2.159284|2.324355|2.919717|2.287026|4.632040|3.589862|2.128329|1.978443|7.099209|0.073440|0.086829|0.087139|0.090257|0.091670|0.124510|0.215463|0.500000| |4.008735|5.352939|6.130788|4.425310|4.053323|4.659405|6.799797|9.165172|25.922903|62.109177|14.377219|10.543566|5.665523|5.241090|3.829527|3.255084|3.338396|4.168271|3.715113|2.346295|3.676240|2.345962|4.743979|2.597497|2.620854|3.283177|2.387288|4.517868|3.702151|2.152733|1.885886|6.479203|0.099298|0.113344|0.095985|0.177657|0.127308|0.102210|0.091929|0.108909|0.500000| |4.103974|4.672130|4.041449|3.121349|2.727023|2.824469|3.437603|4.368364|8.383054|47.147916|11.870400|8.044086|8.897118|17.751284|8.930305|5.659548|4.925708|5.622334|4.910557|3.150013|4.680850|3.411702|7.556836|3.070367|2.936090|3.755844|2.566794|4.571858|3.812469|2.285658|1.949549|3.266657|0.114913|0.118789|0.092650|0.174477|0.112479|0.079780|0.065879|0.069089|0.167769|0.500000| |3.714869|3.671666|3.036491|2.520727|2.200784|2.194594|2.500079|3.014763|4.909629|27.769682|6.698962|5.707404|5.655617|8.876600|17.747252|8.998666|5.640790|4.948614|5.728402|4.001725|5.723660|4.987324|13.241162|3.269943|3.057927|4.115435|2.688910|4.523121|3.723919|2.417602|2.035339|2.351851|0.115064|0.106901|0.085788|0.123143|0.092926|0.067736|0.054968|0.054741|0.095476|0.213055|0.500000| |4.470162|4.055292|4.024796|3.352852|3.044289|3.159893|3.693048|4.320699|6.539332|47.995364|8.660517|14.118291|8.990287|5.649386|4.952764|5.644123|8.854131|17.799069|9.487154|4.690233|6.908986|3.989522|7.503506|7.138329|6.164543|6.212531|4.037515|7.887745|8.172597|3.125471|2.658388|3.448645|0.112903|0.163280|0.107150|0.119013|0.091712|0.084921|0.074132|0.078025|0.110025|0.124431|0.107566|0.500000| |2.689583|2.447741|2.208628|1.955612|1.781637|1.785810|1.966889|2.216905|3.362643|20.467791|4.875870|4.850825|3.815816|4.003815|5.137347|7.054742|6.128562|4.418328|8.805021|8.956678|11.939077|17.526733|16.500839|4.478678|3.566418|4.672527|2.812147|4.638684|4.012867|2.433089|2.121256|1.899438|0.079543|0.082448|0.066955|0.073635|0.061882|0.052978|0.045678|0.045832|0.064159|0.093980|0.133353|0.106127|0.500000| |2.739665|2.415489|2.138466|1.924309|1.736810|1.706713|1.845220|2.083016|3.071277|17.854753|4.169523|4.268233|3.254489|3.431189|4.403333|5.943398|5.125235|3.739180|7.930325|9.016405|13.421894|17.692925|16.864318|4.245730|3.646131|5.191126|3.066431|4.823428|4.011362|2.716122|2.341961|1.748950|0.083468|0.082392|0.069245|0.071188|0.062039|0.053141|0.044932|0.043745|0.058436|0.082125|0.119184|0.091800|0.300190|0.500000| |3.084477|2.611444|2.488725|2.295933|2.124471|2.101916|2.241627|2.457713|3.450690|20.906544|4.546751|5.668947|3.568560|3.125500|3.331905|4.281257|5.689462|4.813109|12.703149|7.872702|15.184699|4.854232|7.358019|17.676177|9.037276|9.060490|4.886000|8.358549|8.479135|3.631059|3.231031|2.112371|0.085109|0.101573|0.081126|0.073037|0.064385|0.062345|0.055040|0.054133|0.063028|0.073917|0.080586|0.143887|0.121405|0.118718|0.500000| |3.472106|3.002108|2.947126|2.654882|2.468929|2.497669|2.730751|3.005323|4.266907|27.387902|5.707633|7.886143|4.651031|3.719399|3.716723|4.621599|6.905723|6.935987|12.342808|5.978284|9.557200|4.286982|7.100655|17.634807|8.979567|7.649143|4.572546|8.758984|10.173638|3.370474|2.960685|2.585648|0.091767|0.119710|0.089246|0.084619|0.071834|0.070076|0.062719|0.063791|0.076161|0.086414|0.086427|0.246522|0.112316|0.100453|0.302903|0.500000| |5.030387|3.662771|3.314578|3.429109|2.936048|2.548276|2.490221|2.787726|3.475992|17.545706|3.724997|4.521479|2.755785|2.580049|2.630772|2.874106|3.114545|3.036741|4.383318|2.899320|4.923062|2.594962|4.914969|3.458798|4.683425|8.150987|9.063916|12.671844|6.616487|17.558734|8.820072|2.124303|0.138369|0.138090|0.172604|0.089170|0.096909|0.106883|0.079387|0.063752|0.063251|0.065373|0.067474|0.085240|0.063645|0.069892|0.088590|0.086447|0.500000| |4.086835|3.083297|2.739074|2.716352|2.374462|2.139974|2.143019|2.397450|3.117527|16.252335|3.516973|4.141421|2.642315|2.526382|2.687719|3.046660|3.247756|2.977875|4.808326|3.341396|5.810561|2.958890|5.477625|3.711265|4.899560|9.929182|9.128509|10.341424|6.110230|17.615150|8.782432|1.883849|0.121292|0.115953|0.124152|0.079071|0.081508|0.081605|0.063720|0.054184|0.057383|0.063292|0.069647|0.081949|0.070789|0.081925|0.098664|0.088460|0.301861|0.500000| |3.256935|2.649112|2.590366|2.737033|2.535688|2.269466|2.178166|2.313105|2.888463|15.028633|3.247661|4.027246|2.273472|2.087604|2.106986|2.318169|2.577162|2.544991|3.798397|2.555569|4.559721|2.222865|3.998520|3.210816|4.225501|6.600330|6.840964|12.037755|6.389594|8.764307|17.584822|1.917894|0.086640|0.094698|0.103417|0.066589|0.069683|0.081638|0.070631|0.058791|0.053202|0.053266|0.054116|0.074511|0.055857|0.060190|0.086817|0.082446|0.210782|0.172401|0.500000| |3.037999|2.480832|2.345541|2.453771|2.239745|2.001519|1.935947|2.078535|2.634582|13.576746|2.979997|3.537530|2.084002|1.970706|2.027955|2.220714|2.383169|2.293986|3.489397|2.431544|4.354099|2.172838|3.932714|2.803787|3.522875|5.850872|5.533579|8.415449|4.905368|8.830318|17.575151|1.713165|0.084562|0.085045|0.095787|0.062860|0.066952|0.074423|0.062395|0.051813|0.049107|0.050620|0.053032|0.065181|0.054180|0.060139|0.076672|0.070787|0.212700|0.211575|0.301302|0.500000| |2.949150|2.400033|2.283275|2.328632|2.144818|1.964414|1.931851|2.072375|2.669057|14.170475|3.102840|3.745681|2.204971|2.055958|2.133001|2.402324|2.646442|2.505510|4.057451|2.838658|5.230265|2.435943|4.278825|3.402289|4.370423|7.424549|6.849081|9.959273|5.913932|8.771542|17.568874|1.733264|0.081822|0.086407|0.089384|0.061970|0.063177|0.068499|0.058861|0.050983|0.049504|0.052055|0.055152|0.072144|0.060427|0.067303|0.096042|0.084012|0.172756|0.210210|0.300965|0.301466|0.500000| |3.084131|3.512085|4.486335|3.960771|4.347879|6.032316|8.846130|6.477191|8.491396|44.040687|9.713104|13.395687|4.001863|3.299048|2.697372|2.555150|2.837711|3.575483|3.412047|2.137270|3.462962|2.027957|3.851528|2.582632|2.601511|3.117538|2.310546|4.627436|3.902628|2.048633|1.867465|17.601633|0.074762|0.092491|0.080135|0.099176|0.085150|0.090127|0.101040|0.158969|0.163008|0.092192|0.066839|0.108413|0.055935|0.050813|0.063508|0.079801|0.059271|0.053128|0.054308|0.048066|0.049400|0.500000| |2.992181|3.627711|4.592354|3.965517|4.262569|5.803616|8.797670|6.755807|9.387206|39.601616|9.799545|9.435680|3.723100|3.297686|2.667051|2.433456|2.585281|3.153872|3.064919|1.959956|3.164442|1.911148|3.694742|2.248005|2.273163|2.812989|2.084651|4.057426|3.321245|1.893605|1.717369|17.550075|0.073664|0.085790|0.077088|0.104988|0.090844|0.090345|0.098636|0.149856|0.217949|0.097489|0.067628|0.090095|0.052740|0.048263|0.055746|0.067413|0.055348|0.049750|0.049402|0.044808|0.045245|0.302496|0.500000| 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