Version2.0 2020-01-31T07:21:49Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 22-Oct-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCN(C1CCCCC1)S(=O)(=O)c2ccc(cc2)C(=O)N(Cc3ccco3)c4nc5ccccc5s4 C10527093 RHF 6-31G(d) (6D,7F) CCN(C1CCCCC1)S(=O)(=O)c2ccc(cc2)C(=O)N(Cc3ccco3)c4nc5ccccc5s4 C01[X(C27H29N3O4S2)] 189 C1 606 CCN(S(=O)(=O)c1ccc(cc1)C(=O)N(c1nc2c(s1)cccc2)Cc1ccco1)C1CCCCC1 CCN(S(=O)(=O)c1ccc(cc1)C(=O)N(c1nc2c(s1)cccc2)Cc1ccco1)C1CCCCC1 CCN(C1CCCCC1)[S](=O)(=O)c2ccc(cc2)C(=O)N(Cc3occc3)c4sc5ccccc5n4 InChIKey=YFBRDWMZSJJPNF-UHFFFAOYSA-N InChI=1S/C27H29N3O4S2/c1-2-30(21-9-4-3-5-10-21)36(32,33)23-16-14-20(15-17-23)26(31)29(19-22-11-8-18-34-22)27-28-24-12-6-7-13-25(24)35-27/h6-8,11-18,21H,2-5,9-10,19H2,1H3 InChI=1/C27H29N3O4S2/c1-2-30(21-9-4-3-5-10-21)36(32,33)23-16-14-20(15-17-23)26(31)29(19-22-11-8-18-34-22)27-28-24-12-6-7-13-25(24)35-27/h6-8,11-18,21H,2-5,9-10,19H2,1H3 CCN(C1CCCCC1)S(=O)(=O)c2ccc(cc2)C(=O)N(Cc3ccco3)c4nc5ccccc5s4 C01[X(C27H29N3O4S2)] 189 C01 606 CCN(S(=O)(=O)c1ccc(cc1)C(=O)N(c1nc2c(s1)cccc2)Cc1ccco1)C1CCCCC1 CCN([S@](=O)(c1ccc(cc1)C(=O)N(c1nc2c(s1)cccc2)Cc1ccco1)O)C1CCCCC1 CCN(C1CCCCC1)[S](O)(=O)c2ccc(cc2)C(=O)N(Cc3occc3)c4sc5ccccc5n4 InChIKey=BURKSVZBPRLSGN-OSWQYVSFSA-N InChI=1S/C26H28F3N3O3S/c1-16(33)31-19-7-9-32(15-19)25-13-18(6-8-30-25)17-2-5-24(21(12-17)26(27,28)29)36-20-3-4-22-23(14-20)35-11-10-34-22/h2-6,8,12,14,18-19,25,30H,7,9-11,13,15H2,1H3,(H,31,33)/t18-,19+,25+/m0/s1 InChI=1/C26H28F3N3O3S/c1-16(33)31-19-7-9-32(15-19)25-13-18(6-8-30-25)17-2-5-24(21(12-17)26(27,28)29)36-20-3-4-22-23(14-20)35-11-10-34-22/h2-6,8,12,14,18-19,25,30H,7,9-11,13,15H2,1H3,(H,31,33)/t18-,19+,25+/m0/s1/f/h31H 4232.2588005395 -2297.0648968 1-A 26590.0266 138 468 606 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922.0961 948.1809 961.7479 967.1232 970.3402 971.4768 972.1690 977.4806 979.7946 1007.8980 1010.2005 1023.1402 1028.0519 1072.2783 1077.2045 1083.1209 1106.3862 1110.3826 1112.3996 1115.1085 1117.4323 1117.6867 1123.1173 1131.2050 1145.5784 1148.1832 1173.5847 1184.4279 1192.6291 1194.7096 1202.5805 1205.3384 1207.5755 1224.5783 1243.9412 1255.4896 1262.8411 1277.1077 1284.7877 1302.8397 1308.0903 1312.9787 1321.8461 1334.5744 1338.8404 1350.1799 1355.8134 1374.2394 1376.6955 1398.8097 1405.2589 1411.7406 1414.3431 1425.1083 1455.7442 1463.9330 1467.5421 1475.6098 1503.0552 1509.5797 1524.1044 1524.4069 1528.5201 1531.9374 1535.4190 1536.7056 1554.3343 1567.7763 1571.5293 1581.6003 1616.8383 1626.4887 1631.7298 1633.6776 1636.4840 1639.6098 1641.8810 1643.7907 1647.2789 1658.5155 1663.9240 1677.2238 1706.6949 1759.0535 1762.1399 1789.6335 1812.2531 1817.5611 1818.6621 1957.2293 3185.0949 3188.7079 3193.2531 3200.4551 3205.6187 3211.4682 3236.4134 3237.0534 3243.1766 3246.3627 3252.6719 3258.5255 3260.8714 3279.2965 3300.6113 3305.3986 3331.8084 3331.8616 3364.8407 3378.7554 3390.7278 3401.0419 3401.1677 3405.2695 3419.1152 3420.0043 3436.4401 3449.6522 3485.0126 4.9741 6.0468 4.8910 4.9448 6.0442 6.3453 5.0534 4.5677 3.9159 6.0542 4.5094 4.2262 3.4143 3.5751 4.0054 7.8481 6.0787 6.2395 6.0601 2.0805 4.6171 4.3311 1.9474 1.8295 6.8119 4.7821 4.3250 3.6265 6.2566 3.1454 5.2835 4.4513 1.9125 2.9396 5.5159 5.3672 3.1849 3.7005 7.3009 3.5890 3.4419 4.4353 5.0803 1.8326 6.7459 5.9548 3.8412 5.1862 4.5437 5.7531 5.0540 3.0081 6.1631 5.6577 7.0405 5.7553 7.8156 6.9662 5.3489 4.6527 3.1273 2.8384 4.5761 1.4576 1.5726 2.9057 1.3794 1.4749 2.5877 5.0057 1.9685 1.3674 4.6725 1.9475 1.4898 1.8989 4.5204 1.3838 1.6521 1.3908 1.4053 3.1392 2.1385 2.3269 1.3607 2.4898 1.5374 1.8017 1.6047 2.7421 1.3203 2.4390 2.3770 1.3619 4.6959 1.4652 1.2719 4.2636 2.0962 1.9638 3.6371 2.9050 1.8332 1.7907 2.6964 1.7302 6.1042 1.8068 2.7534 3.0559 2.6521 1.2614 1.4443 2.2358 3.6762 2.1130 1.8260 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0.1474 0.7450 1.6167 2.5538 2.1944 1.3142 0.3862 2.7646 2.4176 0.9407 0.7500 6.6945 23.9792 0.4357 3.8246 5.6740 5.0798 4.7046 7.2535 10.0991 2.6555 6.6383 4.0688 14.9247 0.3611 10.6173 69.0619 30.1096 1.4996 55.5980 35.4506 110.3529 4.5502 41.1182 7.9185 44.4657 30.5996 41.5697 9.2821 92.5323 31.5584 58.9479 18.0222 58.5768 1.2031 13.4907 31.4402 11.1366 12.2381 30.7629 14.4687 5.2214 29.1036 2.0850 0.6776 28.2094 1.6268 0.0704 18.6271 32.2429 101.1964 2.0898 61.2748 39.1850 38.1275 14.9951 12.9063 0.0647 2.9364 63.2724 4.4246 27.1624 3.8693 0.9189 46.3683 0.5310 2.4594 33.8583 104.2999 1.1361 0.3125 100.1345 9.6261 247.3035 24.8590 6.8992 48.6653 13.8750 0.5635 3.8201 45.0136 88.7784 22.8902 77.8303 60.3588 41.8277 4.8614 1.0888 111.9180 77.8706 5.3196 16.5057 33.2014 147.8253 13.8368 1.8291 3.6625 250.6896 19.6766 0.9502 2.2859 31.0011 170.6510 58.3336 110.2707 14.6520 22.6436 41.8879 11.8364 0.5337 1.1306 2.7653 9.1341 1.5440 4.7547 2.9445 3.9987 6.0006 6.5049 28.2209 7.6879 4.9878 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1600.49 1604.39 1607.74 1608.10 1615.92 1627.55 1648.23 1651.98 1688.53 1704.13 1715.93 1718.92 1730.25 1734.21 1737.43 1761.89 1789.75 1806.37 1816.95 1837.47 1848.52 1874.50 1882.05 1889.08 1901.84 1920.15 1926.29 1942.61 1950.71 1977.22 1980.76 2012.58 2021.85 2031.18 2034.92 2050.41 2094.49 2106.27 2111.47 2123.07 2162.56 2171.95 2192.85 2193.28 2199.20 2204.12 2209.13 2210.98 2236.34 2255.68 2261.08 2275.57 2326.27 2340.15 2347.70 2350.50 2354.54 2359.03 2362.30 2365.05 2370.07 2386.23 2394.02 2413.15 2455.55 2530.89 2535.33 2574.88 2607.43 2615.06 2616.65 2816.02 4582.64 4587.84 4594.38 4604.74 4612.17 4620.59 4656.48 4657.40 4666.21 4670.79 4679.87 4688.29 4691.67 4718.18 4748.84 4755.73 4793.73 4793.81 4841.26 4861.28 4878.50 4893.34 4893.52 4899.42 4919.34 4920.62 4944.27 4963.28 5014.16 0.565097 0.595560 0.596504 0.497282 -2296.499800 -2296.469337 -2296.468393 -2296.567615 3.327922D-04 MUNgauss RevisionA2.0 retrievium 31-Jan-2020 DUDE CCN(C1CCCCC1)S(=O)(=O)c2ccc(cc2)C(=O)N(Cc3ccco3)c4nc5ccccc5s4 C10527093 RHF 6-31G(d) (6D,10F) C1 523.159950 |X|Y|Z| 146.475743 62.115301 35.728210 68.758309 31 6 7 8 16 25 3 1 2 |36.858105| |12.491170|36.858105| |7.571549|12.946777|53.358707| |5.378332|7.436623|17.568744|36.858105| |4.289834|6.012124|10.304476|12.407375|36.858105| |3.334534|4.147326|6.724115|7.543134|12.424549|36.858105| |3.328276|3.857158|5.958824|6.438021|7.521273|12.446069|36.858105| |3.777859|4.179114|6.759321|7.546195|6.446646|7.544981|12.445560|36.858105| |5.384828|6.106353|10.434791|12.430178|7.533164|6.444757|7.516251|12.429969|36.858105| |5.506671|7.142249|15.908532|7.082433|5.188315|3.865763|3.382743|3.777473|4.983261|388.023441| |4.299305|5.006875|10.472450|6.575848|4.707620|3.844393|3.414922|3.957801|4.926078|94.702150|73.516695| |6.081891|6.757248|10.531499|4.984142|3.944843|3.080332|2.814013|3.130131|4.052606|94.713849|13.598905|73.516695| |4.037654|5.372002|9.417854|5.410589|4.980741|3.754136|3.087859|3.184227|3.835722|76.073524|13.121428|13.133166|36.858105| |3.256067|4.147182|7.265603|4.977598|4.912929|3.967434|3.140613|3.156632|3.575223|49.358832|11.583002|8.884248|13.744957|36.858105| |2.739080|3.395838|5.438092|3.827064|4.063937|3.466999|2.758901|2.680820|2.929799|33.578414|7.883520|6.852036|7.955388|13.756956|36.858105| |2.677854|3.296256|4.932763|3.329493|3.559911|3.005498|2.459416|2.380199|2.628386|29.807574|6.586599|6.588858|6.891827|7.930045|13.716216|36.858105| |3.059517|3.806092|5.456326|3.440266|3.566613|2.897313|2.425970|2.386775|2.720937|33.596733|6.849580|7.885890|7.965150|6.865810|7.921614|13.713595|36.858105| |3.844220|4.984929|7.319808|4.209574|4.109040|3.175646|2.676788|2.706475|3.217330|49.335939|8.862094|11.561008|13.730034|7.902432|6.854253|7.925306|13.778578|36.858105| |2.237040|2.658336|3.856203|2.673105|2.889682|2.556136|2.135313|2.043839|2.202413|22.406356|5.126509|5.147627|4.466252|5.016329|7.513468|12.665902|7.702495|5.070952|36.858105| |2.096228|2.432745|3.464851|2.367908|2.502248|2.225371|1.904374|1.843654|1.991859|20.300479|4.647326|4.842209|3.866299|4.100064|5.459634|8.133797|6.653030|4.536500|15.949041|73.516695| |2.049754|2.424664|3.520721|2.533144|2.819249|2.581965|2.141397|2.007901|2.113210|19.697074|4.617485|4.459864|3.714925|4.313448|6.213179|7.663290|5.254536|3.952900|13.793613|15.091368|53.358707| |2.119130|2.544512|3.708805|2.757863|3.218231|2.999564|2.420713|2.205841|2.287971|19.910985|4.678150|4.400752|3.674785|4.331762|5.911869|6.316486|4.631912|3.750011|7.524599|9.465394|17.698201|36.858105| |1.937106|2.287628|3.393159|2.606418|3.026186|2.980312|2.412083|2.182210|2.199603|18.135909|4.426912|3.972668|3.194255|3.874155|4.988085|4.687521|3.587513|3.101059|5.213435|7.238936|10.483021|12.764212|36.858105| |1.746516|2.028481|2.970773|2.306900|2.673203|2.722070|2.257111|2.022728|2.002021|15.608737|3.840698|3.463569|2.632314|3.082702|3.706081|3.536662|2.885574|2.562421|3.908072|5.822268|7.237390|7.360688|14.215513|36.858105| |1.661486|1.908489|2.835799|2.233763|2.540633|2.661639|2.232165|2.014012|1.959797|14.986409|3.783966|3.308590|2.468755|2.927610|3.409897|3.113675|2.569386|2.343960|3.317733|5.059930|5.703405|5.145416|8.572408|13.226467|36.858105| |1.772560|2.047640|3.109077|2.454559|2.755388|2.864481|2.367023|2.166039|2.117612|16.753258|4.299925|3.642402|2.798550|3.454826|4.083001|3.527484|2.829847|2.593624|3.653388|5.467636|6.130973|5.333232|8.779886|8.608686|14.241458|36.858105| |1.961545|2.308235|3.523267|2.737940|3.103364|3.095525|2.494449|2.290932|2.293934|19.245021|4.848993|4.141776|3.381416|4.332433|5.574336|4.687013|3.530399|3.141811|4.857016|6.831007|8.557976|7.832915|14.144090|8.642263|8.628012|14.158081|73.516695| |1.787655|2.063700|2.957570|2.134473|2.342307|2.193410|1.865776|1.755635|1.828945|16.455850|3.910596|3.809132|2.945533|3.314587|4.358032|5.077833|3.968255|3.133808|8.041348|12.848303|18.394502|7.798540|6.267778|5.056959|4.031164|4.111426|9.154042|36.858105| |1.652586|1.882777|2.722923|1.977968|2.136643|2.032384|1.747300|1.657064|1.711960|15.288415|3.711994|3.544680|2.675955|3.043547|3.901802|4.252814|3.385053|2.777756|6.022715|10.305631|11.034345|5.722071|5.526742|4.741310|4.090878|4.239225|8.926171|15.116745|53.358707| |1.490791|1.675493|2.391677|1.737171|1.868034|1.791353|1.565996|1.486354|1.529119|13.288710|3.227155|3.126161|2.257961|2.497600|3.049494|3.318520|2.806167|2.358254|4.401607|8.034847|7.325814|4.304118|4.234387|3.999464|3.522191|3.472625|6.797214|8.721995|18.686570|36.858105| |1.364416|1.515797|2.168711|1.581186|1.681233|1.628780|1.440856|1.376119|1.407216|12.070468|2.969110|2.852120|2.006510|2.212547|2.625570|2.772509|2.394748|2.068408|3.455949|6.351174|5.414818|3.371286|3.469364|3.395024|3.184535|3.149345|5.862778|5.428846|10.535137|13.685138|36.858105| |1.258167|1.386055|1.964281|1.431216|1.518988|1.476294|1.320137|1.261133|1.287328|10.840449|2.659820|2.584262|1.772346|1.921528|2.228843|2.360563|2.097751|1.835242|2.864776|5.318404|4.378209|2.827396|2.880522|2.896151|2.723857|2.636598|4.822647|4.180355|7.031052|7.994179|13.834052|36.858105| |1.249316|1.375788|1.929233|1.401466|1.495510|1.448378|1.298134|1.235197|1.263885|10.553251|2.563205|2.529052|1.722131|1.843009|2.127701|2.291358|2.068189|1.803956|2.787683|5.208195|4.257357|2.783852|2.758902|2.793730|2.552139|2.428598|4.487472|4.069412|6.253196|6.894280|7.894114|13.625843|36.858105| |1.341958|1.489105|2.077192|1.503841|1.619149|1.556186|1.385136|1.311016|1.347786|11.316129|2.718686|2.709196|1.868829|1.993064|2.327928|2.562620|2.308911|1.981532|3.202338|5.992784|4.989309|3.228092|3.086418|3.090254|2.707904|2.560147|4.849951|4.979442|7.109432|7.851898|6.772062|7.883313|13.816522|36.858105| |1.475103|1.656152|2.327516|1.683570|1.823424|1.740903|1.528670|1.443561|1.489331|12.761308|3.057166|3.027856|2.155037|2.330274|2.802195|3.130416|2.733470|2.290801|4.130152|7.658564|6.785765|4.148011|3.869840|3.738806|3.171418|3.033242|5.939925|7.811222|11.035521|13.680727|7.899681|6.924941|8.028208|13.712765|36.858105| |1.669250|1.905144|2.656476|1.908897|2.101859|1.972288|1.707979|1.599965|1.666467|14.453757|3.392856|3.415320|2.501001|2.684377|3.298295|3.875938|3.362401|2.720486|5.411053|9.689507|9.413302|5.591528|4.566720|4.169408|3.310296|3.183386|6.577074|10.818838|10.040215|7.440398|4.886564|4.256336|4.692236|6.705766|10.918241|388.023441| |17.580700|8.788689|9.301820|5.558241|4.277303|3.455377|3.626263|4.328282|6.417193|34.675386|7.373893|8.912960|3.572905|3.012321|2.537894|2.435166|2.700066|3.298579|2.058294|3.419676|2.604887|1.995090|1.854550|1.687099|1.620659|1.727805|3.359604|1.679656|2.128801|1.415136|1.302588|1.203266|1.192127|1.274619|1.396207|11.141630|0.500000| |17.528520|8.872480|7.548236|4.313036|3.743633|2.992248|3.004698|3.286434|4.372626|30.884577|6.200225|8.637317|3.497199|2.872874|2.497477|2.497361|2.869370|3.491935|2.127638|3.576261|2.663426|2.020824|1.837890|1.669265|1.578230|1.666321|3.267725|1.721721|2.159335|1.442345|1.319512|1.223827|1.222538|1.316205|1.439205|11.606873|0.301223|0.500000| |17.630862|8.821471|9.244856|4.731601|3.738462|2.977274|2.936754|3.358486|4.594085|41.973939|8.144005|13.408619|4.130120|3.270295|2.733006|2.677946|3.091443|3.947549|2.232349|3.759076|2.749187|2.052378|1.877560|1.687305|1.611926|1.729705|3.405616|1.768251|2.238214|1.483421|1.362534|1.255408|1.242521|1.330003|1.461331|11.683188|0.301044|0.300734|0.500000| |8.873681|17.604109|12.358407|5.722499|5.157682|3.658624|3.303611|3.447602|4.609345|49.134081|8.237862|12.771045|5.948004|4.336445|3.632031|3.682337|4.504471|6.148674|2.931774|4.796934|3.559162|2.702240|2.369077|2.080743|1.932350|2.069045|4.200479|2.210616|2.715986|1.771549|1.590724|1.452771|1.447364|1.576453|1.760275|14.570854|0.173297|0.214874|0.211937|0.500000| |8.865137|17.629075|12.568888|7.402651|6.952072|4.673296|4.380638|4.505674|6.424935|38.602009|7.464442|8.763965|4.593340|3.799603|3.220684|3.130684|3.515062|4.324652|2.576726|4.159552|3.271579|2.582628|2.328399|2.083851|1.950142|2.069035|4.123639|2.049804|2.532926|1.662071|1.500414|1.376058|1.371814|1.489323|1.653253|13.591981|0.210893|0.214864|0.173628|0.305840|0.500000| |4.408819|5.578949|12.640374|17.644015|8.929313|6.958940|5.797555|6.986619|9.003871|51.685149|14.696517|8.614625|5.582006|5.543576|4.090331|3.396481|3.399619|4.108106|2.716113|4.262054|3.508428|2.785048|2.687651|2.365545|2.332404|2.616440|5.171509|2.171086|2.771520|1.776922|1.625720|1.463062|1.420553|1.515297|1.701228|13.569971|0.126314|0.100136|0.114958|0.129879|0.147082|0.500000| |3.901441|5.523219|9.465731|8.819101|17.557600|8.807071|5.485333|4.836608|5.493045|38.801270|8.585823|7.223611|6.052498|6.274974|5.180486|4.412446|4.302948|4.884190|3.449792|5.159664|4.568184|3.903553|3.577707|3.051128|2.847854|3.131292|6.512829|2.699628|3.306658|2.087549|1.855820|1.660120|1.631512|1.778259|2.029727|16.890878|0.103813|0.095904|0.097717|0.143864|0.166341|0.214202|0.500000| |4.591188|6.557264|9.277456|8.792716|17.524759|8.874478|6.797845|5.673054|6.787937|32.520318|7.058442|6.638851|4.402355|4.140684|3.585494|3.315513|3.424499|3.909163|2.749008|4.284632|3.649555|3.055913|2.818339|2.525050|2.361479|2.502270|4.983963|2.251692|2.772438|1.800543|1.616938|1.472557|1.462940|1.591557|1.781535|14.717543|0.125709|0.115250|0.106588|0.155663|0.245557|0.174146|0.303390|0.500000| |3.038247|3.697884|6.250007|6.809940|8.841737|17.498756|8.853594|6.791975|5.661170|27.540811|7.254330|5.391230|3.808230|4.246799|3.678977|3.069085|2.881037|3.133588|2.607689|4.017159|3.603190|3.061624|3.135036|2.847877|2.861305|3.163001|6.015681|2.247265|2.869605|1.845097|1.686044|1.518403|1.476300|1.576577|1.769876|14.100676|0.087178|0.075204|0.077584|0.092284|0.109786|0.206049|0.214448|0.173970|0.500000| |2.958618|3.641393|5.563311|5.496350|8.832085|17.539709|8.808306|5.492264|4.834476|23.697785|5.785814|4.872216|3.402728|3.637032|3.349754|2.962553|2.817763|2.987620|2.581316|3.975014|3.635170|3.197068|3.204943|2.977647|2.874915|3.019621|5.759801|2.275845|2.850384|1.851276|1.675153|1.521098|1.499515|1.618737|1.811390|14.687193|0.083802|0.075813|0.073664|0.092512|0.115378|0.141781|0.212348|0.215693|0.303626|0.500000| |2.809478|3.163726|4.824399|4.835636|5.484094|8.817845|17.538708|8.815693|5.482146|20.630794|5.317924|4.366213|2.703366|2.805083|2.520451|2.247466|2.187776|2.368720|1.988296|3.164659|2.748086|2.285958|2.328288|2.219317|2.230784|2.348561|4.299253|1.780724|2.289277|1.516014|1.403978|1.289877|1.266007|1.344235|1.476812|11.614868|0.084562|0.071530|0.070296|0.077341|0.097459|0.129529|0.123128|0.139572|0.214913|0.211498|0.500000| |3.430413|3.935071|5.660105|5.643027|6.776203|8.853821|17.495134|8.849783|6.765439|22.451989|5.462655|4.811946|2.898136|2.874985|2.566604|2.348902|2.352878|2.587602|2.057024|3.282395|2.804862|2.327963|2.285571|2.152766|2.097797|2.189208|4.114162|1.805027|2.286438|1.516058|1.391981|1.282643|1.269925|1.359844|1.494181|11.933592|0.104113|0.088173|0.082167|0.093488|0.130031|0.133214|0.139305|0.200201|0.173780|0.214672|0.303372|0.500000| |3.379625|3.719932|6.275711|6.805616|5.654952|6.786874|8.851655|17.503667|8.850474|26.865053|7.504422|5.477551|3.193371|3.258956|2.745615|2.388512|2.358665|2.661984|2.050992|3.285717|2.746409|2.204618|2.214132|2.049115|2.072918|2.260270|4.216239|1.766674|2.290437|1.504549|1.399723|1.278182|1.243760|1.313541|1.448505|11.321324|0.105204|0.081398|0.086584|0.087596|0.106754|0.206768|0.126604|0.131237|0.199775|0.139331|0.214912|0.173735|0.500000| |3.527918|3.679850|5.599254|5.500318|4.838206|5.493106|8.810464|17.542565|8.838514|23.023208|5.996287|4.980239|2.737616|2.689318|2.329151|2.103955|2.122822|2.386619|1.834960|2.975295|2.456450|1.967076|1.949392|1.828525|1.824593|1.942379|3.614148|1.598275|2.061791|1.371309|1.276627|1.177366|1.155525|1.222575|1.336411|10.465409|0.115237|0.087130|0.087403|0.085270|0.109975|0.142307|0.106602|0.127036|0.139383|0.123148|0.211386|0.214705|0.303690|0.500000| |6.140649|6.704587|9.399599|8.813883|6.790092|5.663801|6.779262|8.863703|17.516381|31.510690|7.305694|6.818929|3.527180|3.215579|2.709601|2.502369|2.633926|3.095659|2.119727|3.430590|2.768973|2.203962|2.094787|1.919156|1.857880|1.979280|3.812659|1.770026|2.241581|1.480948|1.360156|1.251077|1.236300|1.322785|1.455647|11.639881|0.213478|0.142506|0.134836|0.136193|0.216856|0.175008|0.139520|0.199981|0.131202|0.126755|0.139281|0.199335|0.173940|0.215664|0.500000| |5.588170|5.654426|9.670935|8.871454|5.503043|4.842199|5.481548|8.797443|17.567027|36.176850|9.374928|7.607044|3.678992|3.381836|2.755398|2.480061|2.587447|3.086323|2.084942|3.391661|2.697221|2.106259|2.028646|1.848223|1.820870|1.975346|3.788470|1.729030|2.219941|1.461699|1.353408|1.240062|1.214257|1.288634|1.419127|11.195309|0.195829|0.122255|0.139298|0.120382|0.150954|0.217596|0.123575|0.139557|0.126983|0.106641|0.123060|0.138980|0.214930|0.211615|0.302573|0.500000| |3.144091|3.900545|7.147413|5.330029|5.046204|4.284293|3.381188|3.459411|3.826486|47.173490|13.341210|8.206200|8.920907|17.759172|8.911892|5.642025|4.952555|5.636620|4.081267|6.097963|5.064361|3.836870|3.664411|2.989806|2.941933|3.537352|7.597268|2.970262|3.812402|2.326637|2.097881|1.828414|1.742122|1.862218|2.154810|17.239283|0.083173|0.076214|0.087586|0.107801|0.100208|0.181572|0.170808|0.113127|0.134600|0.105901|0.084454|0.083492|0.102696|0.080762|0.092299|0.101227|0.500000| |2.423702|2.932135|4.667563|3.440120|3.704554|3.353400|2.670839|2.565213|2.712621|27.787688|6.909428|5.754447|5.659312|8.940966|17.751507|8.896431|5.637597|4.945187|6.906462|8.993415|9.026578|6.467158|6.055441|4.305551|4.058894|5.173544|13.606012|4.704030|5.944777|3.313924|2.861225|2.385400|2.241555|2.432278|2.955150|24.121151|0.063500|0.061766|0.066928|0.085124|0.078636|0.103872|0.127835|0.090377|0.101509|0.091440|0.069142|0.068419|0.073952|0.062178|0.069374|0.070867|0.215304|0.500000| |2.841071|3.421486|4.677257|2.965934|3.081641|2.555881|2.186863|2.146140|2.429610|27.754494|5.746958|6.896289|5.655985|4.951637|5.647377|8.932549|17.748498|8.921873|7.213775|12.782268|6.739850|4.237438|3.268427|2.695668|2.379782|2.563230|5.564076|3.950840|4.531567|2.828733|2.401429|2.127507|2.126655|2.398690|2.823258|25.081807|0.069460|0.075893|0.079883|0.113538|0.088789|0.080419|0.099966|0.084440|0.069913|0.069880|0.055187|0.059683|0.058543|0.053766|0.066392|0.064490|0.107586|0.124190|0.500000| |4.301394|5.416488|7.239413|3.965168|3.760417|2.917972|2.540473|2.604043|3.150177|47.133554|8.177922|13.265651|8.913417|5.636639|4.946438|5.639469|8.915712|17.762024|4.133692|6.934236|4.528460|3.171732|2.667927|2.264277|2.080583|2.267022|4.757406|2.747938|3.343577|2.135930|1.892263|1.702067|1.684916|1.845741|2.100437|17.577695|0.098704|0.110116|0.125817|0.200723|0.125603|0.104527|0.117759|0.102914|0.078699|0.076114|0.062338|0.069269|0.070290|0.064719|0.086107|0.085192|0.124189|0.107469|0.214482|0.500000| |2.033164|2.422294|3.439347|2.553381|3.003512|2.817821|2.312241|2.087839|2.159381|18.055347|4.202329|4.063979|3.220840|3.607547|4.567117|5.057918|4.093039|3.365350|6.039154|8.391888|12.393568|17.573411|9.087587|6.997516|4.679841|4.469600|10.237565|7.111625|6.977387|4.181829|3.258329|2.813211|2.858213|3.404192|4.325183|44.600703|0.053176|0.054550|0.054344|0.071638|0.069206|0.070367|0.098797|0.081497|0.078175|0.084864|0.060855|0.062777|0.057319|0.052198|0.058623|0.055078|0.089775|0.132138|0.109023|0.081569|0.500000| |2.400066|2.963370|4.368490|3.252408|3.905147|3.516968|2.749785|2.491275|2.617667|23.207687|5.351144|5.007325|4.443070|5.316618|7.321421|7.543310|5.453849|4.465401|7.294793|8.998902|12.512074|17.667204|8.964750|5.818466|4.491435|4.847951|12.484961|5.718524|6.129031|3.524076|2.874860|2.457919|2.421652|2.761940|3.414619|31.657895|0.062418|0.063065|0.064088|0.087711|0.083842|0.090552|0.138180|0.101957|0.098879|0.103778|0.070886|0.073223|0.068762|0.060871|0.069827|0.066152|0.126654|0.205869|0.131380|0.101976|0.303939|0.500000| |1.673186|1.931845|2.779756|2.145492|2.491075|2.530699|2.132010|1.902904|1.885405|14.446981|3.518100|3.247933|2.406454|2.735376|3.225243|3.190599|2.686356|2.385268|3.568057|5.459116|6.482556|6.381190|8.835809|17.794319|8.439266|5.858002|10.461478|4.766038|5.937121|3.907835|3.305413|2.906812|2.888641|3.251663|3.860177|30.972948|0.044863|0.044817|0.044757|0.055213|0.055501|0.060283|0.077927|0.066679|0.072087|0.077601|0.058310|0.057290|0.053026|0.048179|0.050772|0.048326|0.073112|0.099886|0.071152|0.059390|0.195434|0.141777|0.500000| |1.538341|1.746517|2.578840|2.037387|2.296821|2.441109|2.093167|1.889771|1.820206|13.544255|3.437109|3.015520|2.181114|2.537102|2.872348|2.650289|2.245780|2.074953|2.807613|4.395473|4.663226|4.037833|5.842611|8.435453|17.805264|8.834213|10.450451|3.394627|4.762532|3.162192|2.959456|2.598529|2.437177|2.540128|2.883109|20.788287|0.041917|0.040730|0.041453|0.048865|0.049686|0.058967|0.070060|0.059736|0.072660|0.073292|0.058848|0.054820|0.054075|0.048017|0.048078|0.047150|0.071428|0.092516|0.058358|0.051837|0.106310|0.100423|0.192837|0.500000| |1.738697|1.990437|3.056498|2.426534|2.660609|2.794838|2.340436|2.173663|2.108790|16.634466|4.370922|3.606519|2.724428|3.380946|3.855597|3.253255|2.652445|2.481212|3.281804|5.015597|5.209754|4.270158|6.037531|5.819028|8.620147|17.838483|16.495743|3.522593|5.060094|3.106194|2.911683|2.456939|2.238567|2.317442|2.696015|19.707295|0.047359|0.045163|0.047379|0.055428|0.055474|0.073076|0.082733|0.066426|0.087475|0.080187|0.064981|0.059479|0.063961|0.054228|0.054228|0.055120|0.099318|0.135470|0.066485|0.060517|0.100918|0.112490|0.123133|0.195221|0.500000| |1.360264|1.508323|2.177429|1.592589|1.681411|1.635843|1.447982|1.389652|1.417216|12.208076|3.037191|2.873057|2.022279|2.253766|2.664704|2.747312|2.356317|2.056735|3.343388|6.072551|5.146023|3.228337|3.414200|3.314324|3.238559|3.293867|6.034066|4.840682|9.542341|8.917095|17.739049|8.877675|5.609186|4.901161|5.634178|28.883584|0.036178|0.036367|0.037847|0.043765|0.041317|0.045853|0.051489|0.044581|0.047428|0.046474|0.039280|0.038633|0.039509|0.035783|0.037838|0.037988|0.059967|0.081855|0.064748|0.052085|0.084434|0.077626|0.087180|0.083828|0.086555|0.500000| |1.185874|1.298059|1.841591|1.344415|1.418056|1.384994|1.247057|1.195866|1.216877|10.166545|2.510610|2.429259|1.642663|1.776904|2.032380|2.124829|1.905174|1.689523|2.514062|4.653603|3.770375|2.477498|2.554501|2.585957|2.496945|2.429075|4.365544|3.435781|5.664434|5.668187|8.959320|17.723417|8.895534|5.633768|4.979530|24.412542|0.031608|0.032034|0.032929|0.037634|0.035757|0.038266|0.042772|0.038147|0.039656|0.039520|0.033961|0.033624|0.033749|0.031117|0.032820|0.032675|0.047363|0.060388|0.053468|0.043738|0.068094|0.060846|0.071731|0.067222|0.063960|0.213774|0.500000| |1.172991|1.283406|1.791676|1.301894|1.384989|1.345194|1.214993|1.157753|1.182685|9.759640|2.372197|2.350206|1.573995|1.671135|1.901817|2.037908|1.866762|1.647271|2.423993|4.525595|3.636771|2.426660|2.409150|2.460699|2.274487|2.158698|3.947702|3.328680|4.965913|4.963427|5.636853|8.889305|17.720882|8.964592|5.684387|27.339291|0.031154|0.031983|0.032406|0.037423|0.035590|0.036577|0.041675|0.037770|0.037988|0.038670|0.032987|0.033108|0.032341|0.030215|0.032220|0.031620|0.044072|0.055285|0.053441|0.043083|0.069566|0.059609|0.071118|0.061154|0.055764|0.123692|0.215447|0.500000| 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