Version2.1 2020-08-15T16:00:22Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 09-Jul-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCN(CC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)NCC[NH+]2C[C@H](C[C@@H](C2)C)C C32929500 RHF 6-31G(d) (6D,7F) CCN(CC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)NCC[NH+]2C[C@H](C[C@@H](C2)C)C C01[X(C19H34N3O4S2)] 180 C1 496 CCN(S(=O)(=O)c1ccc(cc1)S(=O)(=O)NCC[NH+]1C[C@@H](C)C[C@@H](C1)C)CC CCN(S(=O)(=O)c1ccc(cc1)S(=O)(=O)NCC[NH+]1C[C@@H](C)C[C@@H](C1)C)CC CCN(CC)[S](=O)(=O)c1ccc(cc1)[S](=O)(=O)NCC[NH+]2C[C@@H](C)C[C@H](C)C2 InChIKey=NNCAFBXRGUYFBC-IRXDYDNUSA-O InChI=1S/C19H33N3O4S2/c1-5-22(6-2)28(25,26)19-9-7-18(8-10-19)27(23,24)20-11-12-21-14-16(3)13-17(4)15-21/h7-10,16-17,20H,5-6,11-15H2,1-4H3/p+1/t16-,17-/m0/s1 InChI=1/C19H33N3O4S2/c1-5-22(6-2)28(25,26)19-9-7-18(8-10-19)27(23,24)20-11-12-21-14-16(3)13-17(4)15-21/h7-10,16-17,20H,5-6,11-15H2,1-4H3/p+1/t16-,17-/m0/s1/fC19H34N3O4S2/h21H/q+1 CCN(CC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)NCC[NH+]2C[C@H](C[C@@H](C2)C)C C01[X(C19H34N3O4S2)] 180 C01 496 CCN(S(=O)(=O)c1ccc(cc1)S(=O)(=O)NCC[NH+]1C[C@@H](C)C[C@@H](C1)C)CC CCN(S(=O)(=O)[C]1[CH][CH][C]([CH][CH]1)[S@@]([O])(=O)NCC[NH]1C[C@@H](C)C[C@@H](C1)C)CC CCN(CC)[S](=O)(=O)[C]1[CH][CH][C]([CH][CH]1)[S]([O])(=O)NCC[NH]2C[C@@H](C)C[C@H](C)C2 InChIKey=FBAOTIJTEFJPNI-IRXDYDNUSA-N InChI=1S/C19H34N3O4S2/c1-5-22(6-2)28(25,26)19-9-7-18(8-10-19)27(23,24)20-11-12-21-14-16(3)13-17(4)15-21/h7-10,16-17,21H,5-6,11-15H2,1-4H3,(H,20,23,24)/t16-,17-/m0/s1 InChI=1/C19H34N3O4S2/c1-5-22(6-2)28(25,26)19-9-7-18(8-10-19)27(23,24)20-11-12-21-14-16(3)13-17(4)15-21/h7-10,16-17,21H,5-6,11-15H2,1-4H3,(H,20,23,24)/t16-,17-/m0/s1/f/h20H 3256.6426705125 -1996.7724121 1-A 19594.6709 116 380 496 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -92.33975 -92.28679 -20.69220 -20.67835 -20.62821 -20.62638 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0.8002 0.3328 0.8367 0.7443 0.8424 0.7780 0.8045 0.8571 0.7306 0.8552 0.8381 0.8021 0.8050 0.8540 0.8402 0.8569 0.8442 0.8569 0.8476 0.8187 0.8235 0.8477 0.7930 0.8571 0.7450 0.7900 0.8565 0.6290 0.6227 0.0632 0.0897 0.5933 0.1446 0.1922 0.3259 0.1137 0.8533 0.2202 0.2126 0.0643 0.5032 0.8316 0.7522 0.8567 0.5032 0.5460 0.2804 0.7943 0.8291 0.8138 0.6778 0.8146 0.8082 0.7847 0.8509 0.7178 0.6162 0.8246 0.3202 0.2235 0.4402 0.4051 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 62 6 6 7 6 6 16 8 8 6 6 6 6 6 6 16 8 8 7 6 6 7 1 6 6 1 6 6 1 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 1 1 1 1 1 1 1 12.00000 12.00000 14.00307 12.00000 12.00000 31.97207 15.99491 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 31.97207 15.99491 15.99491 14.00307 12.00000 12.00000 14.00307 1.00783 12.00000 12.00000 1.00783 12.00000 12.00000 1.00783 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 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 4776.7340 31479.6249 32651.3030 0.99997 0.00135 0.00802 -0.00093 0.99864 -0.05207 -0.00808 0.05207 0.99861 1 0.01813 0.00275 0.00265 0.37782 0.05733 0.05527 13.59 17.34 26.92 37.45 43.78 66.34 84.56 103.34 123.85 139.15 146.90 184.57 196.81 219.74 228.07 248.78 288.30 321.75 322.36 330.47 339.07 346.63 353.80 357.60 394.42 442.65 462.79 488.08 500.90 532.25 534.69 568.44 569.05 583.46 593.14 620.09 647.34 656.63 677.83 696.59 704.16 715.86 722.08 733.00 771.20 818.95 837.28 851.00 908.43 939.19 986.61 989.11 995.37 1085.07 1154.08 1192.59 1216.14 1218.32 1226.13 1260.21 1284.35 1347.34 1375.55 1378.48 1387.22 1412.00 1420.49 1451.76 1465.84 1471.14 1480.61 1517.48 1555.24 1570.12 1594.27 1598.54 1608.28 1617.83 1629.28 1631.94 1654.50 1703.77 1705.44 1720.67 1724.23 1730.79 1738.93 1747.62 1748.52 1759.17 1786.38 1805.92 1818.93 1859.57 1873.03 1878.53 1883.37 1888.09 1910.11 1943.95 2009.14 2028.77 2043.67 2066.74 2084.21 2089.47 2097.81 2107.85 2123.55 2135.56 2160.82 2180.45 2181.71 2182.71 2194.47 2212.87 2217.58 2226.94 2232.57 2234.45 2260.34 2262.00 2265.84 2274.74 2279.10 2305.92 2332.07 2347.44 2349.82 2350.00 2351.63 2355.53 2355.91 2361.10 2362.78 2363.06 2365.10 2371.68 2374.51 2379.30 2385.07 2386.04 2392.76 2401.39 2538.71 2584.65 4601.53 4619.39 4623.64 4626.26 4628.20 4633.29 4644.20 4679.25 4681.31 4690.60 4691.48 4692.89 4702.36 4712.26 4713.10 4717.52 4722.77 4723.37 4723.78 4738.48 4754.66 4756.42 4762.18 4771.35 4775.14 4778.97 4809.24 4812.85 4894.86 4909.56 4926.43 4929.85 5122.03 5505.75 0.577557 0.605960 0.606905 0.514238 -1996.194855 -1996.166452 -1996.165508 -1996.258174 3.108033D-04 MUNgauss RevisionA2.0 retrievium 15-Aug-2020 DUDE CCN(CC)S(=O)(=O)c1ccc(cc1)S(=O)(=O)NCC[NH+]2C[C@H](C[C@@H](C2)C)C C32929500 RHF 6-31G(d) (6D,10F) C1 432.199075 |X|Y|Z| 128.821419 34.089995 42.865061 57.311199 16 6 7 16 13 2 1 |36.858105| |12.489858|36.858105| |7.601230|12.957623|53.358707| |5.766308|7.547063|17.607034|36.858105| |4.333304|5.763690|10.359590|12.502525|36.858105| |5.241065|7.074468|16.058512|7.118103|5.437439|388.023441| |3.933473|5.010628|10.516784|6.712328|5.797816|94.853801|73.516695| |4.906399|6.623728|10.481997|5.009131|4.314812|94.832032|13.575654|73.516695| |4.880185|5.231808|9.444366|5.274399|3.943134|75.642232|13.204501|13.192690|36.858105| |3.993213|4.120605|7.382200|4.913464|3.720439|49.173907|11.585291|8.870455|13.719511|36.858105| |3.435963|3.347571|5.468590|3.740899|2.971156|33.510151|7.917832|6.863500|7.956122|13.788388|36.858105| |3.412278|3.212349|4.925682|3.231129|2.617287|29.881268|6.655897|6.652334|6.945249|7.976949|13.714857|36.858105| |3.906403|3.652022|5.398397|3.319551|2.686554|33.520074|6.899348|7.960297|7.956549|6.838607|7.867299|13.749270|36.858105| |4.799546|4.739915|7.225948|4.065635|3.206449|49.278134|8.951666|11.734610|13.756614|7.890059|6.838338|7.976363|13.751982|36.858105| |2.699462|2.511759|3.711526|2.526521|2.128201|21.508872|4.985768|4.976582|4.225767|4.757166|7.009193|10.788432|6.965232|4.739832|388.023441| |2.653286|2.422100|3.449237|2.310138|1.965756|19.658745|4.450616|4.727278|3.702514|3.826557|4.941250|7.339183|6.537118|4.434456|93.832168|73.516695| |2.545221|2.355962|3.501711|2.473564|2.088326|19.619053|4.662251|4.435613|3.695337|4.380250|6.372556|7.317202|5.002031|3.849944|95.322151|13.542967|73.516695| |2.290480|2.205133|3.277720|2.243770|1.945260|19.496294|4.678446|4.596058|3.640108|4.070866|5.501083|6.898379|5.244269|3.959510|82.719592|13.963575|13.852827|53.358707| |2.176642|2.121969|3.111569|2.093205|1.842179|18.808184|4.484482|4.602800|3.400475|3.567259|4.384225|5.476718|4.910160|3.828115|49.807934|11.605731|8.867771|17.814514|36.858105| |1.914132|1.851072|2.661583|1.807915|1.612713|15.651565|3.736756|3.877568|2.706300|2.799412|3.321115|3.992826|3.730702|3.028137|37.241537|9.940075|7.401709|10.517752|12.471049|36.858105| |1.951483|1.849030|2.610222|1.768152|1.569863|15.018269|3.519904|3.740132|2.590109|2.635203|3.113757|3.847308|3.707072|2.963087|37.072795|11.772940|7.404208|8.368330|7.517773|12.663022|53.358707| |2.139248|2.001434|2.827407|1.910001|1.675074|16.198659|3.756635|3.996241|2.861828|2.924535|3.543507|4.572951|4.337472|3.321450|48.030520|17.887132|9.020059|9.696884|7.641386|9.288376|25.518054|0.500000| |1.935859|1.836811|2.550191|1.705933|1.524621|14.664536|3.395825|3.745496|2.474147|2.431069|2.763847|3.392639|3.509218|2.888902|29.163951|9.364646|5.888984|6.099265|5.654628|7.666428|17.231200|0.257622|36.858105| 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|1.864215|1.715496|2.373416|1.635062|1.451179|13.068655|3.045923|3.219848|2.203612|2.250298|2.623464|3.127964|3.005378|2.475988|29.560126|9.637709|6.830089|5.388214|3.868808|4.622310|9.445222|0.211503|5.759270|6.765806|0.138271|8.854774|17.526665|0.500000| |1.744244|1.647737|2.317578|1.595204|1.428052|13.090223|3.101809|3.236068|2.206507|2.273326|2.659211|3.136519|2.966474|2.454400|29.885839|8.895696|6.648411|6.471471|5.089990|7.651284|17.257734|0.258558|7.666540|6.440365|0.137307|7.595694|12.476451|0.248808|36.858105| |1.543123|1.442849|1.999243|1.393626|1.258704|10.986628|2.605636|2.714435|1.798551|1.844738|2.101518|2.389987|2.292086|1.968518|21.343016|6.192278|5.149576|4.183997|3.083731|3.820040|6.743936|0.129493|4.386074|4.866852|0.113572|7.501957|12.448186|0.248073|7.627985|36.858105| |2.189268|1.996812|2.690281|1.788728|1.579816|14.929407|3.362046|3.816715|2.513127|2.416920|2.714911|3.378626|3.654420|3.006187|27.956224|9.910542|5.827555|4.887608|3.849680|4.188441|8.053954|0.182791|7.438646|12.422332|0.249112|7.425018|5.891940|0.179939|4.984041|4.125107|36.858105| |17.565588|8.759852|9.348105|6.182787|4.483668|33.171009|6.635645|7.306705|4.505326|3.960551|3.449123|3.334683|3.632295|4.252234|19.053275|4.613999|4.619803|3.067325|2.103715|1.856757|2.577699|0.057817|1.854170|1.836909|0.048554|1.670402|1.700607|0.051138|1.711370|1.528417|2.094704|0.500000| |17.566515|8.777716|9.214724|5.026006|3.772855|38.622332|7.036268|9.170945|5.727092|4.493589|3.936903|4.068000|4.894804|6.124293|22.192335|5.512854|5.109174|3.517428|2.452242|2.134467|2.981839|0.067471|2.174387|2.146942|0.056733|1.902561|1.914735|0.057681|1.931993|1.686046|2.495225|0.301564|0.500000| |17.554664|8.861538|7.562517|4.519078|3.718486|29.833466|5.852274|7.451640|3.909159|3.278403|2.917924|2.959552|3.391547|4.003100|17.302556|4.346333|4.080432|2.842614|2.007902|1.795057|2.513816|0.055910|1.854337|1.857512|0.049809|1.670029|1.665303|0.049736|1.662001|1.491561|2.130917|0.301858|0.301488|0.500000| |8.852081|17.595379|12.576789|7.318401|6.471968|39.216496|7.836057|9.269139|4.136231|3.473196|2.883704|2.743915|3.031281|3.745032|15.761571|3.802752|3.754233|2.683548|1.898754|1.676839|2.279029|0.050001|1.663764|1.625053|0.043684|1.472716|1.480868|0.043633|1.509048|1.338398|1.802353|0.209539|0.172969|0.214668|0.500000| |8.825715|17.674095|12.463500|5.647727|4.787301|49.872226|8.605437|14.480896|5.063264|3.846941|3.170519|3.125242|3.669418|4.862928|17.463248|4.269960|4.018045|2.978858|2.148320|1.876202|2.547370|0.055940|1.884380|1.827969|0.049330|1.624910|1.617266|0.047536|1.655941|1.441750|2.038383|0.172600|0.210892|0.212064|0.305025|0.500000| |4.775416|5.633394|12.384936|17.641804|8.871669|49.306285|13.199001|8.268187|5.728902|5.917179|4.323503|3.532024|3.481728|4.175979|19.405473|4.319807|4.811983|3.301964|2.227201|1.903281|2.509322|0.055434|1.755570|1.666302|0.043862|1.530611|1.589695|0.046974|1.662833|1.440605|1.814247|0.143480|0.124427|0.105943|0.145522|0.127131|0.500000| |6.490765|7.326577|12.576218|17.595591|8.824339|38.803685|8.785302|7.471048|4.605192|4.378234|3.529257|3.111400|3.183143|3.770793|17.661027|4.078568|4.383194|2.952256|2.008888|1.753869|2.363993|0.052347|1.674727|1.621910|0.042881|1.491980|1.536891|0.045649|1.578439|1.396852|1.790860|0.220381|0.148876|0.140115|0.206749|0.145842|0.304792|0.500000| |4.487325|6.185072|9.373188|8.780978|17.565716|34.393750|8.510655|7.421792|3.534968|3.238792|2.656982|2.409733|2.520384|3.003606|14.109666|3.313724|3.440066|2.469255|1.734902|1.532942|2.045624|0.044443|1.473211|1.421724|0.038162|1.307546|1.329092|0.038867|1.369504|1.216206|1.541493|0.126037|0.104747|0.110881|0.219855|0.143888|0.173176|0.209370|0.500000| |3.782111|5.040867|9.280848|8.831496|17.608190|41.087496|12.358832|8.174081|3.986606|3.754903|2.965013|2.599160|2.667402|3.202533|15.001169|3.447804|3.649665|2.671251|1.874179|1.633063|2.141641|0.046381|1.529442|1.453084|0.038884|1.335130|1.365184|0.039749|1.426282|1.246950|1.558184|0.104924|0.095092|0.091307|0.148809|0.125139|0.212963|0.173226|0.300773|0.500000| |3.718690|4.516981|7.565799|8.867381|17.549702|30.556166|8.349379|6.213006|3.408674|3.366536|2.769172|2.424737|2.436727|2.817950|14.324602|3.295363|3.573795|2.513122|1.735828|1.530502|2.028732|0.044113|1.439572|1.382612|0.036860|1.283978|1.320909|0.038674|1.368035|1.215841|1.489801|0.110812|0.091144|0.090619|0.139831|0.106126|0.213381|0.213932|0.301792|0.300718|0.500000| |3.692184|3.945691|7.374653|5.422701|4.144796|47.018809|13.177629|8.154682|8.906495|17.765501|8.932186|5.662183|4.938245|5.631113|27.934302|5.703866|6.792041|4.785401|3.100931|2.498452|3.184115|0.071041|2.160262|1.981452|0.051314|1.805086|1.908566|0.056396|2.059954|1.701504|2.132970|0.104258|0.109625|0.084852|0.095566|0.100508|0.199629|0.129504|0.096460|0.117975|0.105783|0.500000| |2.991826|2.914488|4.710103|3.390194|2.764492|27.706281|6.906116|5.748006|5.651831|8.924612|17.745006|8.879504|5.615063|4.936319|47.539978|8.080805|12.773713|7.527613|4.174965|3.241870|4.096234|0.094317|2.611679|2.356181|0.059196|2.172118|2.390930|0.071834|2.641749|2.106468|2.528096|0.085249|0.092472|0.071796|0.071639|0.076213|0.110335|0.089972|0.068409|0.076591|0.073329|0.214910|0.500000| |3.584730|3.287689|4.632051|2.874294|2.387394|27.718769|5.783625|6.959544|5.653447|4.938003|5.617552|8.902472|17.764975|8.909482|47.084517|13.487277|8.249940|6.933024|5.080209|4.018411|5.712644|0.138974|4.122886|3.760720|0.094113|3.041803|3.073828|0.093407|3.257721|2.487467|4.513600|0.091815|0.124268|0.089764|0.077001|0.093482|0.082070|0.077706|0.063279|0.065684|0.060532|0.107338|0.123754|0.500000| |5.058518|5.085298|7.118081|3.848123|3.127899|47.224062|8.266900|13.590305|8.930772|5.632555|4.937836|5.659770|8.907412|17.764285|27.801025|6.899302|5.748891|4.611687|3.411691|2.798739|3.778733|0.085069|2.803005|2.616883|0.069269|2.215059|2.202753|0.065108|2.310682|1.881904|2.975039|0.117544|0.180502|0.120833|0.109968|0.156253|0.104952|0.099545|0.083708|0.086874|0.075514|0.124141|0.107305|0.214128|0.500000| |2.190515|2.134235|3.218433|2.241848|1.955448|19.161451|4.725223|4.442571|3.519367|4.100893|5.541013|6.075835|4.536438|3.637334|60.586351|10.224782|13.159855|25.938503|9.002151|6.151382|6.588520|0.147097|3.697552|3.045679|0.074262|2.833412|3.270462|0.094770|4.073974|2.795889|3.027589|0.060387|0.067692|0.055289|0.053397|0.058455|0.068193|0.059899|0.050269|0.055064|0.051910|0.101462|0.167376|0.117559|0.086317|0.500000| |2.070429|2.057664|3.050624|2.062462|1.836087|18.722759|4.570024|4.583885|3.306079|3.493459|4.147604|4.782520|4.321625|3.590590|38.629074|8.605377|7.547323|12.517940|17.606852|8.975381|7.552522|0.149426|4.574408|3.413456|0.085495|3.012807|3.252165|0.089242|4.190016|2.713374|3.204038|0.055553|0.063990|0.052997|0.051425|0.058046|0.061233|0.054412|0.047867|0.052439|0.048087|0.086198|0.111237|0.119240|0.089490|0.231811|0.500000| |2.378225|2.315386|3.368876|2.216267|1.937451|20.636722|4.793485|5.154517|3.796434|3.800444|4.554832|6.062328|6.017501|4.524085|48.510017|12.442230|8.220768|12.345683|17.602181|8.770841|9.397354|0.204793|6.021208|4.340079|0.106070|3.528673|3.687758|0.104154|4.553914|2.909360|4.259170|0.062922|0.075497|0.060899|0.056916|0.065849|0.064877|0.058925|0.050922|0.054729|0.050200|0.089480|0.113861|0.182494|0.112885|0.183741|0.304865|0.500000| |1.789220|1.732584|2.503155|1.725335|1.546592|14.583548|3.532465|3.568721|2.493580|2.635969|3.138613|3.623177|3.274700|2.712493|34.375193|8.615716|7.391861|9.899582|8.912951|17.654262|12.336594|0.202183|5.737208|4.167194|0.099209|4.032595|4.822142|0.123885|7.772886|3.954655|3.590905|0.048675|0.054897|0.046604|0.043915|0.048417|0.050728|0.046601|0.040720|0.043485|0.041074|0.066480|0.087910|0.095133|0.069296|0.177881|0.211563|0.173792|0.500000| |1.810687|1.767716|2.528391|1.711299|1.542498|14.929002|3.574321|3.757808|2.519311|2.558255|2.933745|3.444629|3.347361|2.815171|29.485953|7.889198|6.033638|7.648033|8.818882|17.625740|12.344430|0.184910|7.701599|4.791758|0.118956|4.205161|4.393565|0.110449|6.313726|3.503210|3.899897|0.048483|0.055736|0.047469|0.044658|0.050202|0.049728|0.045939|0.040915|0.043598|0.040591|0.064026|0.078883|0.100470|0.073846|0.133857|0.221338|0.206255|0.302093|0.500000| |1.762951|1.691360|2.352305|1.582668|1.429598|13.543076|3.173637|3.470946|2.239413|2.207602|2.474519|2.940089|3.014288|2.562253|24.630689|7.361834|5.150474|5.346392|5.014354|7.154986|12.469946|0.181777|17.601036|8.814148|0.225149|6.815344|5.731912|0.133489|7.021169|4.225577|5.471912|0.046959|0.054371|0.047062|0.042869|0.048306|0.045232|0.043025|0.038416|0.040013|0.037593|0.055238|0.065644|0.095262|0.069494|0.093561|0.120492|0.141876|0.156850|0.234853|0.500000| |2.095425|1.998981|2.775951|1.830649|1.629805|16.204694|3.712664|4.193018|2.758791|2.656705|2.994008|3.750122|4.048154|3.306662|30.582059|9.766194|5.943784|6.339222|6.207268|7.190020|12.374193|0.223908|17.612443|8.757722|0.211307|5.501075|4.874996|0.129128|5.607595|3.548944|6.979909|0.055135|0.065950|0.055558|0.049882|0.057482|0.052204|0.049610|0.043758|0.045563|0.042431|0.064782|0.076814|0.136302|0.089953|0.105567|0.139156|0.207491|0.144210|0.206405|0.301321|0.500000| |1.585375|1.494341|2.049609|1.400899|1.270444|11.418425|2.677976|2.894610|1.854472|1.844544|2.057695|2.385612|2.406822|2.081697|20.214602|6.085641|4.543460|4.041086|3.275234|4.187136|7.749548|0.135375|6.787737|8.833574|0.223631|17.506844|8.875760|0.174028|6.843660|6.975703|5.479908|0.042784|0.048392|0.042876|0.038323|0.042207|0.039830|0.038687|0.034334|0.035169|0.033733|0.046820|0.055607|0.074965|0.056621|0.073236|0.080186|0.090307|0.108705|0.116814|0.199189|0.138822|0.500000| |1.688960|1.563958|2.121655|1.449491|1.306012|11.638458|2.699594|2.941798|1.895094|1.875950|2.092871|2.444776|2.487353|2.142663|20.664361|6.443524|4.698766|3.870287|2.994290|3.553606|6.635168|0.130868|5.522597|8.834808|0.208817|17.573945|8.843065|0.214169|5.524611|6.846642|7.022185|0.045715|0.051773|0.045960|0.040075|0.043970|0.041012|0.040418|0.035411|0.035854|0.034691|0.047433|0.056301|0.078361|0.058439|0.069868|0.072443|0.084414|0.092101|0.094585|0.139500|0.123289|0.303929|0.500000| |1.738063|1.642976|2.331792|1.620694|1.448115|13.141458|3.141533|3.204351|2.227234|2.343257|2.785431|3.233814|2.946569|2.435081|32.095034|8.947420|7.494361|7.112064|5.119258|7.174639|12.419573|0.225747|5.613409|4.845444|0.108328|5.508489|8.787202|0.216343|17.619688|6.904268|4.166335|0.047769|0.053301|0.045732|0.041865|0.045516|0.047287|0.044584|0.038376|0.040148|0.038711|0.059306|0.078595|0.087541|0.062782|0.127498|0.118256|0.121294|0.235756|0.155450|0.144138|0.126926|0.139833|0.123414|0.500000| |1.612768|1.538442|2.163376|1.491493|1.347726|12.255939|2.925695|3.049108|2.031881|2.084477|2.395136|2.763775|2.643743|2.240326|25.020524|7.113696|5.631771|5.579325|4.590818|7.101424|12.401478|0.181481|6.985979|5.707457|0.131871|6.822532|8.770720|0.173912|17.579100|6.916156|4.233299|0.043851|0.049243|0.042837|0.039330|0.043128|0.043109|0.040844|0.035967|0.037552|0.035896|0.052974|0.066185|0.079864|0.059139|0.101089|0.110902|0.113953|0.209028|0.185156|0.211195|0.143528|0.201205|0.139664|0.300784|0.500000| |1.517178|1.410212|1.938794|1.352993|1.223743|10.554141|2.493670|2.612781|1.713930|1.747149|1.971148|2.231268|2.163502|1.875949|19.455233|5.665105|4.733724|3.698425|2.707673|3.220707|5.573249|0.110803|3.832764|4.508209|0.108360|6.854159|8.823621|0.214198|5.530945|17.582906|4.020814|0.041803|0.045922|0.040993|0.036448|0.039108|0.038662|0.037861|0.032971|0.033552|0.032872|0.044867|0.054681|0.065328|0.050156|0.069004|0.066695|0.072412|0.090791|0.083126|0.101668|0.088707|0.173053|0.204867|0.141333|0.140833|0.500000| |1.530786|1.432346|1.997794|1.403490|1.266566|10.955974|2.615191|2.681102|1.798296|1.869414|2.146720|2.412716|2.265454|1.945336|21.894703|6.144875|5.465196|4.303350|3.063927|3.724972|6.247778|0.123286|3.843253|4.034086|0.095060|5.461725|8.753795|0.213938|6.944466|17.559595|3.598388|0.042401|0.046328|0.040914|0.036965|0.039529|0.040515|0.039117|0.033866|0.034830|0.034119|0.048131|0.060630|0.067221|0.051182|0.081196|0.075318|0.078745|0.111368|0.092846|0.102359|0.089218|0.141509|0.140309|0.206587|0.171268|0.302334|0.500000| |1.445603|1.363265|1.890400|1.317913|1.198372|10.431898|2.486726|2.589966|1.691368|1.729721|1.951397|2.197717|2.120692|1.843252|19.189836|5.448321|4.598532|3.871697|2.929878|3.695858|6.227211|0.114236|4.209872|4.515406|0.110358|6.793506|8.759730|0.173579|6.875978|17.545051|3.663362|0.039655|0.043669|0.038879|0.035230|0.037985|0.037808|0.036550|0.032200|0.033104|0.032158|0.044544|0.054311|0.063646|0.049210|0.072688|0.073054|0.076522|0.107297|0.097653|0.119533|0.094510|0.207355|0.167906|0.168361|0.204724|0.301914|0.300931|0.500000| |2.299475|2.075096|2.818953|1.885915|1.649060|15.567375|3.507393|3.907181|2.676382|2.618212|3.014920|3.826972|4.011862|3.191170|33.514375|12.997544|6.955436|5.524750|4.120703|4.377750|8.565843|0.219137|6.567800|8.649394|0.173070|6.632002|6.347740|0.221425|5.348073|4.354553|17.593181|0.061780|0.073285|0.061543|0.051855|0.058134|0.053502|0.052693|0.044440|0.044992|0.043316|0.063766|0.078354|0.137028|0.085474|0.093652|0.093122|0.124272|0.105924|0.107666|0.135037|0.170439|0.135637|0.173381|0.129296|0.119255|0.116820|0.108891|0.103257|0.500000| |2.099205|1.901586|2.531127|1.691837|1.502916|13.822516|3.115219|3.540479|2.278043|2.186091|2.417031|2.924253|3.154475|2.683788|23.558119|7.863657|5.123907|4.100290|3.161394|3.416360|6.190822|0.136231|5.466001|8.841711|0.216729|6.798245|5.215043|0.158944|4.180571|3.947674|17.577435|0.055955|0.065823|0.057512|0.048058|0.053850|0.047355|0.047379|0.040976|0.041002|0.039488|0.054190|0.062956|0.105111|0.074648|0.072473|0.075295|0.095358|0.084229|0.089870|0.123572|0.142198|0.143123|0.210473|0.099555|0.101803|0.112552|0.094869|0.097548|0.302639|0.500000| 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