Version2.1 2020-08-14T11:22:00Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 12-Jul-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE c1ccn2c(c1)nc3c(c2=O)cc(c(=[NH2+])n3CCC[NH+]4CCOCC4)C(=O)N C00788698 RHF 6-31G(d) (6D,7F) c1ccn2c(c1)nc3c(c2=O)cc(c(=[NH2+])n3CCC[NH+]4CCOCC4)C(=O)N C01[X(C19H34N6O3)] 180 C1 488 NC(=O)c1cc2c(n(c1=[NH2+])CCC[NH+]1CCOCC1)nc1n(c2=O)cccc1 NC(=O)c1cc2c(n(c1=[NH2+])CCC[NH+]1CCOCC1)nc1n(c2=O)cccc1 NC(=O)C1CC2C(NC3CCCCN3C2=O)N(CCC[NH+]4CCOCC4)C1=[NH2+] InChIKey=COTYBVZWQONAAU-UHFFFAOYSA-P InChI=1S/C19H32N6O3/c20-16-13(17(21)26)12-14-18(22-15-4-1-2-6-24(15)19(14)27)25(16)7-3-5-23-8-10-28-11-9-23/h13-15,18,20,22H,1-12H2,(H2,21,26)/p+2 InChI=1/C19H32N6O3/c20-16-13(17(21)26)12-14-18(22-15-4-1-2-6-24(15)19(14)27)25(16)7-3-5-23-8-10-28-11-9-23/h13-15,18,20,22H,1-12H2,(H2,21,26)/p+2/fC19H34N6O3/h20,23H,21H2/q+2 c1ccn2c(c1)nc3c(c2=O)cc(c(=[NH2+])n3CCC[NH+]4CCOCC4)C(=O)N C01[X(C19H34N6O3)] 180 C01 488 NC(=O)c1cc2c(n(c1=[NH2+])CCC[NH+]1CCOCC1)nc1n(c2=O)cccc1 O=C1N2CCCC[C@H]2N[C@@H]2[C@@H]1C[C@H]([C]([NH2])=O)[C]([N]2CCC[NH]1CCOCC1)[NH2] N[C]1[C@H](C[C@H]2[C@@H](N[C@@H]3CCCCN3C2=O)N1CCC[NH]4CCOCC4)C(N)=O InChIKey=UBCQCIJFQOMNSH-XSWJXKHESA-N InChI=1S/C19H34N6O3/c20-16-13(17(21)26)12-14-18(22-15-4-1-2-6-24(15)19(14)27)25(16)7-3-5-23-8-10-28-11-9-23/h13-15,18,22-23H,1-12,20H2,(H2,21,26)/t13-,14-,15-,18-/m0/s1 InChI=1/C19H34N6O3/c20-16-13(17(21)26)12-14-18(22-15-4-1-2-6-24(15)19(14)27)25(16)7-3-5-23-8-10-28-11-9-23/h13-15,18,22-23H,1-12,20H2,(H2,21,26)/t13-,14-,15-,18-/m0/s1/f/h21H2 2845.4635890827 -1290.1130942 1-A 15574.9125 106 382 488 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.79592 -20.73619 -20.70177 -15.95873 -15.87940 -15.86299 -15.78405 -15.78311 -15.76393 -11.62874 -11.56825 -11.56082 -11.54401 -11.53888 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1.5064 2.1297 2.5268 2.2604 2.9665 2.8509 3.9567 3.2033 3.0179 1.3438 4.1437 2.1907 3.0587 2.4737 1.7917 1.8678 2.7599 1.9356 1.5966 2.0737 3.0132 2.4635 2.0387 2.2920 1.8531 1.8859 2.2278 2.6338 2.4532 2.9662 2.7509 2.2329 3.0133 1.9585 1.7091 1.9441 2.1431 2.9273 2.7757 2.2379 1.9563 2.6298 2.0886 1.9807 2.0855 2.3592 1.7529 2.2350 1.4345 2.0566 1.2077 3.2470 1.4783 1.4932 1.5123 1.4828 1.6040 1.5220 1.2846 1.2996 1.2577 1.4311 1.2866 1.1681 1.2145 1.3548 1.2655 1.2246 1.3452 1.2486 1.3971 1.2190 1.2937 1.8935 1.6593 1.3215 1.4239 1.5109 1.4617 1.3184 1.6032 2.1054 1.3551 1.3876 1.2874 1.5073 1.0915 1.7663 1.3300 1.3097 1.0963 1.1725 1.0899 1.1136 1.1269 1.2018 1.1346 1.1346 1.1478 1.2174 3.3973 1.2470 1.2808 10.1096 10.3202 1.0841 1.0850 1.0703 1.0729 1.0744 1.0731 1.0709 1.0676 1.0640 1.0833 1.0806 1.0795 1.0975 1.0641 1.0919 1.0971 1.1033 1.0615 1.0638 1.0718 1.1100 1.0954 1.0973 1.0967 1.1127 1.1117 1.0985 1.0930 1.0782 1.0745 1.0486 1.0531 1.1060 1.1004 0.0008 0.0008 0.0010 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23.3438 6.1907 6.3979 6.4464 6.4623 6.4830 6.5006 6.4907 6.5072 6.5231 6.6875 6.7149 6.7493 6.8868 6.6786 6.8809 6.9226 6.9852 6.7254 6.7580 6.8444 7.2249 7.1602 7.1850 7.2105 7.3430 7.3591 7.2836 7.2929 8.5848 8.9982 8.9755 9.0765 10.1158 10.0895 1.6455 2.4438 1.1248 1.0818 6.6753 2.2991 0.9151 9.5262 5.1298 2.9114 3.0860 1.5502 2.1070 2.5506 3.9088 13.1906 15.3702 1.2170 0.1456 4.9325 0.3430 7.7784 15.6713 3.2879 11.6384 9.2107 14.8340 5.4940 233.1208 1.7110 6.4327 7.8061 0.1186 9.6863 2.6973 1.3222 2.2200 12.2936 3.3640 10.4026 192.7900 108.8213 50.0867 14.4951 2.2609 13.7616 9.4108 6.2811 22.5442 4.4722 13.2034 3.0663 5.0180 17.6630 5.1707 12.1981 5.6619 7.3557 8.5051 2.7367 20.3368 3.3778 19.2293 6.1745 10.1445 25.0084 10.7352 3.4692 30.3668 5.0515 38.3641 19.3698 11.5854 19.7589 7.1906 35.4495 4.9069 1.8781 31.3049 30.4659 46.2377 19.2476 9.2007 23.0810 3.5322 12.2916 44.3123 38.8762 10.4747 3.4877 17.2904 6.5078 52.1290 16.1111 20.0784 9.6913 10.7886 113.6842 164.6257 16.4518 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12.00000 12.00000 12.00000 15.99491 14.00307 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 8359.1720 20412.7372 26826.1590 0.99998 -0.00687 -0.00042 0.00686 0.99992 -0.01035 0.00049 0.01034 0.99995 1 0.01036 0.00424 0.00323 0.21590 0.08841 0.06728 24.50 25.55 33.37 48.36 69.66 79.70 100.84 105.11 117.48 130.26 202.59 215.03 234.85 276.17 288.15 322.49 349.71 357.71 372.21 396.47 449.49 481.31 484.22 507.41 538.93 550.21 566.27 598.12 609.73 633.00 676.40 694.80 704.41 722.09 733.10 749.65 753.95 758.37 800.45 824.56 883.92 888.48 909.92 918.56 944.60 974.77 978.76 1052.79 1065.40 1137.91 1165.23 1175.45 1214.57 1246.13 1292.29 1295.34 1305.26 1329.54 1336.95 1354.70 1380.68 1392.26 1412.66 1420.27 1452.37 1483.67 1500.37 1516.76 1522.90 1569.72 1582.79 1589.48 1609.28 1612.00 1643.18 1663.90 1670.35 1682.11 1694.01 1712.51 1732.77 1746.91 1757.77 1772.19 1785.14 1802.24 1810.56 1845.80 1859.62 1877.92 1885.86 1900.04 1904.31 1923.06 1975.97 1998.13 2004.91 2012.36 2019.60 2027.78 2029.14 2058.82 2068.80 2079.81 2097.65 2111.58 2118.05 2119.62 2131.74 2137.25 2155.92 2172.67 2184.96 2196.32 2203.55 2210.37 2214.27 2219.62 2232.28 2235.06 2256.77 2259.38 2274.99 2277.89 2293.36 2301.74 2329.64 2334.05 2341.26 2346.22 2351.00 2355.97 2363.01 2366.30 2367.43 2369.63 2376.98 2385.59 2389.28 2391.84 2457.66 2530.70 2593.99 2687.24 2811.94 2819.10 4479.12 4551.75 4600.07 4600.25 4604.51 4613.43 4614.69 4627.60 4641.17 4657.31 4672.54 4686.92 4695.48 4695.94 4705.52 4708.58 4716.42 4718.21 4724.41 4736.65 4782.20 4792.29 4796.46 4806.24 4815.32 4822.60 4826.55 4841.74 5289.16 5424.38 5484.04 5502.96 5668.76 5675.90 0.598529 0.623453 0.624397 0.540423 -1289.514565 -1289.489642 -1289.488698 -1289.572672 2.816502D-04 MUNgauss RevisionA2.0 retrievium 14-Aug-2020 DUDE c1ccn2c(c1)nc3c(c2=O)cc(c(=[NH2+])n3CCC[NH+]4CCOCC4)C(=O)N C00788698 RHF 6-31G(d) (6D,10F) C1 394.269239 |X|Y|Z| 64.823388 103.298723 26.494868 56.190489 23 6 7 8 18 4 1 |36.858105| |12.473224|36.858105| |7.584611|12.509431|36.858105| |6.583573|7.721414|12.932110|53.358707| |7.534391|6.518477|7.733205|17.846456|36.858105| |12.461978|7.610550|6.556656|10.580169|12.476725|36.858105| |5.012580|4.470374|5.051126|10.640952|12.936404|7.848405|53.358707| |3.848168|3.723284|4.490552|9.215699|7.807835|5.101599|18.086109|36.858105| |3.722301|3.938647|5.006470|10.629672|6.635781|4.608263|10.862501|12.587521|36.858105| |4.495323|5.235449|7.859949|19.186481|7.704491|5.185911|9.147795|7.552555|12.517587|36.858105| |3.819083|4.672380|6.938123|11.487401|5.334427|4.066554|6.436932|5.336832|8.105906|15.920367|73.516695| |2.917576|3.108239|3.875889|6.969614|4.471698|3.393476|6.958820|7.696629|12.551511|7.566128|12.333516|36.858105| |2.527625|2.607039|3.056122|5.284380|3.691133|2.972875|6.132820|6.487343|7.697110|4.957492|8.053736|12.420265|36.858105| |2.608936|2.579565|2.940571|5.147720|3.927143|3.181000|7.176356|7.752244|6.803019|4.426813|6.766225|7.446481|12.485236|36.858105| |2.244393|2.201492|2.446927|4.092016|3.147802|2.678444|5.487703|5.177936|4.630714|3.389339|5.385508|5.118808|7.956138|14.443676|53.358707| |2.054623|2.042988|2.266232|3.714791|2.782994|2.402625|4.656684|4.273906|4.112270|3.108430|5.090097|4.777364|7.637357|9.519608|25.979269|0.500000| |2.186556|2.108481|2.300936|3.804622|3.006364|2.620420|5.265152|4.661726|4.000241|3.045317|4.816228|4.157849|5.708644|9.316919|26.092856|0.315833|0.500000| |3.067124|2.938822|3.338015|6.102029|5.047755|3.936018|10.676069|12.599124|7.727719|4.963978|7.084979|6.581264|7.621876|14.505569|11.243265|0.165973|0.204038|53.358707| |2.944194|2.705364|2.924943|5.088424|4.479874|3.819989|9.256917|7.429083|5.067774|3.815535|5.601220|4.368400|4.957063|7.879132|9.315299|0.140906|0.211406|17.654387|36.858105| |2.709687|2.454389|2.649649|4.416884|3.919758|3.383578|7.218677|5.678919|4.000918|3.249200|4.904040|3.651329|3.990698|5.693034|7.481266|0.119146|0.174836|10.280100|12.368581|36.858105| |2.483832|2.214742|2.310228|3.714046|3.278576|3.043971|5.652517|4.067430|3.128118|2.666724|4.107464|2.857749|3.101060|4.095801|5.697389|0.096720|0.137253|6.743400|7.585869|12.431242|36.858105| |2.265370|2.017279|2.097788|3.272706|2.850442|2.675442|4.598903|3.319824|2.640971|2.335258|3.665094|2.465497|2.614185|3.262530|4.553725|0.080388|0.105661|5.124260|4.914527|7.478045|12.686534|53.358707| |2.427517|2.136385|2.227048|3.459800|3.063399|2.860122|4.851665|3.449452|2.709155|2.435085|3.805272|2.503585|2.586054|3.174698|4.285724|0.075811|0.096364|5.081678|4.685539|7.094406|9.298766|25.671034|0.500000| |1.989499|1.814105|1.911452|2.956342|2.489592|2.297067|3.947535|2.992037|2.447390|2.159034|3.449838|2.374854|2.557271|3.146038|4.563763|0.082033|0.105963|4.672374|4.176323|6.087948|7.538989|17.165702|0.258151|36.858105| |1.819460|1.659416|1.735449|2.623472|2.186262|2.049452|3.336789|2.493243|2.096250|1.901159|3.078061|2.041841|2.153007|2.539849|3.625083|0.067004|0.081518|3.724470|3.172227|4.210624|4.945282|10.435621|0.197435|12.493048|36.858105| |1.740908|1.579102|1.626313|2.438473|2.032156|1.951437|3.077550|2.248147|1.915224|1.751782|2.841414|1.846243|1.943594|2.273873|3.240243|0.060408|0.073064|3.339229|2.873294|3.625847|4.514300|9.159131|0.167299|7.965671|13.721458|73.516695| |1.895063|1.690618|1.720615|2.579284|2.186639|2.137717|3.306800|2.347103|1.981564|1.823879|2.933178|1.870811|1.949000|2.288610|3.198491|0.059132|0.071973|3.442191|3.022368|3.786125|4.978532|10.416328|0.197386|6.700080|8.219238|24.353689|36.858105| |2.096778|1.857758|1.890022|2.888795|2.489713|2.432625|3.893994|2.733345|2.258700|2.040313|3.236221|2.101514|2.215093|2.677611|3.748010|0.067995|0.086193|4.117238|3.830415|4.922233|7.669201|17.107325|0.258245|7.683011|6.712715|14.179795|12.509759|36.858105| |2.386538|2.488597|2.822580|4.752361|3.271143|2.781763|5.308813|4.920464|6.082199|4.323914|7.239043|7.506968|12.343462|7.841023|8.721641|0.189561|0.139046|7.742207|4.255771|3.348770|2.770434|3.171990|0.063292|2.259182|1.924260|3.154786|1.789442|2.036325|36.858105| |2.432854|2.493017|2.743677|4.630041|3.294536|2.888203|5.502578|4.797685|5.511049|3.996080|6.467830|5.691157|8.025347|7.393041|8.712469|0.180470|0.148549|7.960511|4.677898|3.496904|2.957954|3.308057|0.065287|2.315671|1.957400|3.245794|1.857325|2.144525|15.871433|73.516695| |2.163945|2.302155|2.608082|4.208178|2.815586|2.440506|4.321783|3.836416|4.802103|3.827126|6.862142|6.123139|7.802848|5.217003|6.344021|0.143987|0.106642|5.614693|3.283902|2.732772|2.326151|2.740512|0.054926|1.974439|1.716415|2.827132|1.595847|1.785926|14.278945|15.071740|53.358707| |17.510844|8.843107|6.799046|7.826432|6.747197|8.831979|6.236923|3.642618|3.431766|4.104465|6.320068|2.771199|2.400699|2.486105|2.934004|0.054794|0.058483|3.965654|2.812056|2.679072|2.458597|3.119639|0.069237|2.018445|1.866242|3.162388|1.937886|2.116507|2.226361|3.989832|2.759512|0.500000| |8.839583|17.545294|8.892924|9.394428|5.712603|6.826593|5.828199|3.592144|3.928500|5.078235|8.164812|3.089814|2.626463|2.580069|3.004097|0.057224|0.058662|3.956652|2.676780|2.375523|2.157611|2.645661|0.056488|1.750065|1.593816|2.710153|1.629887|1.801368|2.581396|4.655110|3.263441|0.173543|0.500000| |5.512575|8.805152|17.703042|12.545041|5.674585|4.929807|5.760064|4.015214|4.790081|7.700333|14.643723|3.904190|3.035299|2.817174|3.208917|0.061556|0.061023|4.203188|2.671735|2.411305|2.107743|2.611064|0.056045|1.772664|1.613995|2.689982|1.587207|1.734699|2.850707|4.850537|3.679824|0.139199|0.216150|0.500000| |8.803156|5.516298|4.905019|7.674998|8.896032|17.511764|9.785834|4.707516|3.993454|4.202388|6.036613|3.064753|2.778272|3.067988|3.592758|0.065302|0.073153|5.228098|3.966447|3.631471|3.368619|4.048551|0.089422|2.484028|2.218151|3.782004|2.374115|2.726832|2.586195|4.815942|3.076040|0.214698|0.139503|0.108231|0.500000| |2.763633|3.042250|3.795649|6.451059|3.925766|3.106013|5.735693|5.574533|8.879460|7.096768|13.762873|17.659485|8.808929|5.496407|5.715145|0.114331|0.097167|6.650437|3.559395|3.032922|2.470230|2.947059|0.060970|2.095074|1.831331|2.971955|1.692483|1.881829|7.153068|9.392960|9.365822|0.072530|0.085250|0.111409|0.077130|0.500000| |3.342693|2.985526|3.143916|5.514996|5.120573|4.557156|11.211878|7.201189|5.001268|3.933073|5.665591|4.019662|4.284479|5.981849|6.962697|0.113697|0.152389|12.612398|17.688298|8.747425|6.907668|6.277145|0.125219|3.733573|2.946588|4.877993|2.975034|3.795452|3.878044|7.744245|4.163134|0.087115|0.082518|0.078391|0.134693|0.093422|0.500000| |2.604862|2.428244|2.588161|4.381510|3.686313|3.282795|7.015495|5.578953|4.359374|3.333501|5.045851|3.949248|4.765548|7.501092|10.489757|0.158530|0.271863|12.454589|17.630577|8.754548|6.963907|6.195132|0.114953|4.005217|3.043578|4.989862|2.916624|3.710723|4.381071|9.009085|4.574355|0.068695|0.067783|0.066871|0.094002|0.092119|0.309696|0.500000| |2.417393|2.240847|2.448980|4.025349|3.413096|2.924464|5.989537|5.070117|3.775565|3.052482|4.718104|3.674182|4.162485|5.968419|8.535254|0.134596|0.203137|9.383428|8.810463|17.580851|8.772506|9.051813|0.170653|6.603225|4.418550|6.479997|3.600224|4.442323|3.400419|6.150684|3.803810|0.066737|0.060317|0.062928|0.085194|0.084703|0.172798|0.208178|0.500000| |2.981172|2.659182|2.900997|4.842675|4.459632|3.736173|8.038271|6.143228|4.143420|3.477794|5.189510|3.697911|3.794696|5.056780|6.229634|0.102959|0.135299|9.347890|8.812077|17.525526|8.818742|9.438853|0.214608|5.575524|4.147403|6.270732|3.741898|4.643045|3.129687|5.675286|3.537950|0.083483|0.070087|0.072120|0.112827|0.085106|0.210065|0.172753|0.303554|0.500000| |2.700142|2.354773|2.406411|3.861329|3.493464|3.370639|6.014409|4.025931|3.113428|2.702179|4.127150|2.754084|2.921952|3.759388|5.041069|0.086970|0.117641|6.344449|7.073432|8.815247|17.607104|12.463168|0.221258|5.575654|4.177493|7.189292|4.755077|7.417604|2.670023|5.139542|3.062414|0.073697|0.063893|0.060395|0.106834|0.066748|0.212017|0.177929|0.172843|0.208109|0.500000| |2.241034|2.031221|2.111577|3.369882|2.885017|2.706257|4.911229|3.615737|2.902227|2.458667|3.839036|2.709494|3.029890|4.000584|5.907620|0.101584|0.149688|6.196462|6.754277|8.749999|17.613804|12.445343|0.181885|7.033630|4.660634|7.824786|4.648720|6.992800|2.775128|5.343084|3.176700|0.061079|0.055614|0.054222|0.081630|0.065753|0.166212|0.202576|0.211735|0.172666|0.302672|0.500000| |1.868893|1.718684|1.804334|2.791897|2.320088|2.156165|3.700212|2.821882|2.352288|2.057454|3.305172|2.302954|2.535384|3.130923|4.712719|0.085591|0.112579|4.525051|4.073685|5.530967|7.040588|12.388113|0.181712|17.622589|8.830042|12.677772|5.863950|6.972382|2.278666|4.191841|2.711066|0.052136|0.046496|0.046833|0.064226|0.056761|0.100254|0.114508|0.170379|0.131906|0.145640|0.217092|0.500000| |2.048943|1.884780|2.018754|3.147817|2.636690|2.369062|4.205774|3.299093|2.666218|2.327834|3.717194|2.627681|2.835286|3.516173|5.090267|0.090497|0.116485|5.185138|4.476423|6.832628|6.893406|12.257622|0.224650|17.645595|8.798719|10.177051|5.012244|5.594675|2.436140|4.368773|2.885674|0.057894|0.050293|0.052076|0.070302|0.063654|0.107187|0.116066|0.232287|0.177928|0.141288|0.172445|0.299055|0.500000| |1.675415|1.546852|1.624976|2.444968|2.003728|1.870089|3.038748|2.307242|1.974032|1.790945|2.928759|1.956087|2.075783|2.416164|3.497922|0.065641|0.078199|3.456063|2.868114|3.678413|4.101347|7.595538|0.144100|8.924113|17.644431|16.902983|5.893565|5.008721|1.858150|3.336588|2.275567|0.047655|0.041376|0.042322|0.055521|0.049022|0.073299|0.077556|0.111114|0.099596|0.096935|0.111697|0.215439|0.210215|0.500000| |1.892136|1.717331|1.800215|2.703915|2.264640|2.116162|3.401541|2.526962|2.116487|1.944529|3.147506|2.052024|2.122657|2.474941|3.450277|0.063713|0.076083|3.670279|3.065216|4.064618|4.536945|9.298526|0.206093|8.807631|17.497170|16.534422|7.330483|5.846117|1.881444|3.376876|2.291984|0.054532|0.045421|0.046290|0.063853|0.051123|0.080018|0.079695|0.116329|0.117648|0.110014|0.113245|0.173001|0.213962|0.301397|0.500000| |1.780422|1.591095|1.604031|2.383913|2.004196|1.989340|2.999895|2.115132|1.815396|1.682795|2.721245|1.713581|1.784164|2.070417|2.897538|0.054131|0.064959|3.086509|2.682400|3.211466|4.135072|7.584382|0.144070|5.002862|5.894778|16.887869|17.646821|8.928653|1.660856|3.077381|2.029775|0.050397|0.042813|0.041254|0.061245|0.043432|0.074292|0.072992|0.084812|0.087523|0.113873|0.111365|0.131418|0.109889|0.132157|0.148461|0.500000| |1.980416|1.752860|1.782627|2.653147|2.264333|2.216886|3.367430|2.369324|1.994121|1.858750|2.987143|1.872619|1.919735|2.232784|3.064215|0.056609|0.067886|3.389317|2.923607|3.665049|4.560934|9.276905|0.205825|5.835528|7.329390|16.527127|17.501178|8.804983|1.750296|3.207288|2.130887|0.056939|0.046535|0.045432|0.068890|0.047075|0.080751|0.076591|0.095861|0.105299|0.123907|0.112967|0.134496|0.131294|0.148467|0.220217|0.301395|0.500000| |2.265402|1.973365|1.979682|3.019448|2.642736|2.646675|4.109273|2.786697|2.299379|2.097682|3.305874|2.097677|2.182965|2.622818|3.591406|0.065103|0.081605|4.109477|3.841909|4.699125|7.109099|12.277481|0.225519|5.603219|5.016080|10.163448|8.768584|17.624003|2.023409|3.814880|2.413392|0.063397|0.053152|0.050093|0.084188|0.052311|0.110914|0.101979|0.112507|0.126614|0.229306|0.171987|0.142602|0.126043|0.109939|0.131405|0.209179|0.213071|0.500000| |1.959384|1.756674|1.785894|2.733517|2.320274|2.270142|3.655055|2.597048|2.179618|1.951630|3.111703|2.046013|2.194162|2.659296|3.813172|0.069694|0.089237|4.004898|3.743726|4.596210|7.148191|12.362577|0.181732|6.969160|5.870990|12.687452|8.834737|17.628797|2.045767|3.864911|2.442745|0.054364|0.047771|0.045902|0.069710|0.051109|0.101845|0.105450|0.118435|0.114440|0.187099|0.215456|0.208256|0.142342|0.131506|0.134643|0.215600|0.172978|0.299377|0.500000| |2.099403|2.252939|2.589970|4.113317|2.713992|2.331901|4.069424|3.642167|4.578359|3.792261|7.065689|6.283505|7.268347|4.714829|5.738383|0.129674|0.096849|5.153418|3.011897|2.585105|2.194287|2.626618|0.053001|1.909647|1.674250|2.744020|1.541772|1.708233|9.250415|10.766031|26.059657|0.055153|0.064510|0.075424|0.059904|0.212048|0.077731|0.084013|0.074154|0.069307|0.058687|0.060710|0.053188|0.057329|0.045509|0.045876|0.039970|0.042210|0.046968|0.047435|0.500000| |2.064436|2.201902|2.444540|3.868949|2.594312|2.308298|3.930675|3.343533|4.094047|3.417070|6.159087|4.779766|5.669893|4.302435|5.421768|0.122347|0.094927|4.860801|2.969916|2.480820|2.162598|2.556974|0.051098|1.835258|1.606674|2.671731|1.512302|1.689563|9.482357|13.575310|25.969099|0.053434|0.064481|0.070715|0.059437|0.148672|0.078339|0.085582|0.069807|0.065420|0.058647|0.060690|0.051678|0.054138|0.043484|0.043687|0.039516|0.041129|0.046774|0.047385|0.310202|0.500000| |17.580339|8.806842|5.511245|6.697753|5.503998|8.860700|5.671690|3.270071|3.170420|3.670745|5.715617|2.552657|2.269110|2.352351|2.806046|0.052746|0.056292|3.714303|2.684628|2.479882|2.335571|2.916275|0.063339|1.876969|1.729585|2.978731|1.834663|2.023865|2.182931|4.001482|2.712646|0.303586|0.214453|0.123300|0.211166|0.067755|0.085015|0.067224|0.061540|0.074596|0.071214|0.059079|0.049262|0.053089|0.044246|0.049769|0.048362|0.053155|0.061229|0.052756|0.053481|0.053400|0.500000| |8.812064|17.570036|8.923066|7.641944|4.886673|5.519637|4.899359|3.119706|3.291426|4.253600|7.173593|2.723627|2.309077|2.269122|2.679581|0.051194|0.052505|3.452536|2.356106|2.179656|1.990265|2.507534|0.054228|1.671617|1.547748|2.626617|1.577313|1.711488|2.211140|3.913413|2.831013|0.215119|0.302828|0.210915|0.123337|0.075052|0.071205|0.059384|0.055887|0.065461|0.058461|0.050965|0.044006|0.048135|0.040248|0.044623|0.041428|0.045568|0.050357|0.044971|0.057034|0.055556|0.209350|0.500000| |6.786932|8.827199|17.510209|12.377141|6.913772|5.718371|6.291799|4.220588|4.447812|6.454049|10.537202|3.625600|2.876891|2.791605|3.195697|0.060348|0.061554|4.305216|2.798247|2.621344|2.283644|2.874815|0.063012|1.934595|1.772617|2.937012|1.744579|1.895558|2.595596|4.444724|3.276843|0.198937|0.173786|0.302746|0.128126|0.097398|0.082371|0.068359|0.067741|0.081198|0.065603|0.057549|0.050269|0.057025|0.046111|0.051591|0.045017|0.050652|0.054966|0.049358|0.067177|0.062315|0.139094|0.216337|0.500000| |6.837261|5.760353|7.023620|12.575749|17.416359|8.876281|12.327709|6.785227|5.521615|6.369828|8.535953|4.111855|3.404624|3.629463|4.044487|0.073111|0.079247|6.232050|4.144546|3.912824|3.264129|3.996187|0.089874|2.576298|2.289332|3.745796|2.265344|2.539467|2.941010|5.172097|3.497667|0.200355|0.132750|0.144310|0.216131|0.100145|0.126399|0.094306|0.095632|0.129712|0.095273|0.078563|0.065554|0.076446|0.058114|0.066990|0.057239|0.066162|0.074523|0.064748|0.069937|0.065503|0.140093|0.129061|0.207423|0.500000| |8.813988|6.828962|5.747297|9.499416|8.966552|17.565609|9.962018|4.904251|4.659721|5.053464|7.113866|3.398288|3.035929|3.237412|3.717139|0.068392|0.074232|5.385232|3.851703|3.263215|2.969987|3.484151|0.074383|2.205696|1.955860|3.335628|2.049343|2.352563|2.943088|5.564922|3.498952|0.173208|0.200473|0.129391|0.301841|0.087436|0.130157|0.094405|0.078593|0.096316|0.091834|0.074893|0.058388|0.062801|0.049804|0.055378|0.053378|0.058228|0.071057|0.061983|0.067212|0.068324|0.214440|0.139509|0.132288|0.174918|0.500000| |4.728166|3.980218|4.302518|8.014522|9.657908|7.251398|25.917732|9.405061|5.805717|5.075792|6.859966|4.246625|3.937073|4.800824|5.278815|0.090621|0.107216|9.712539|7.423218|6.311441|4.955012|5.417018|0.119265|3.276255|2.741393|4.488597|2.759631|3.309058|3.410698|6.330226|3.828779|0.125220|0.104241|0.100442|0.217964|0.098576|0.264787|0.149181|0.136070|0.208589|0.151035|0.113824|0.083767|0.096235|0.068120|0.078088|0.068750|0.078622|0.098396|0.084497|0.073938|0.071584|0.112124|0.091709|0.114524|0.237225|0.178143|0.500000| |3.632112|3.506813|4.327772|8.259006|6.917647|4.552574|12.293674|17.476409|8.861645|6.681565|9.013030|7.111908|5.805834|6.636050|6.497902|0.111046|0.120007|12.423382|6.245575|5.675560|3.982908|4.629059|0.100539|3.130382|2.628664|4.131268|2.402644|2.746291|4.226734|7.061305|4.704566|0.099706|0.091144|0.107430|0.119682|0.144754|0.160129|0.132642|0.147095|0.185112|0.106502|0.096723|0.080278|0.098434|0.067715|0.075222|0.059558|0.068172|0.076802|0.071480|0.094319|0.083438|0.085347|0.083614|0.119932|0.196742|0.115737|0.220762|0.500000| |3.638988|3.851834|4.572511|9.193384|5.915680|4.564903|9.974263|9.057344|17.538881|9.096760|11.879492|8.848505|7.172745|6.522812|6.263180|0.115064|0.111816|9.789377|5.048301|3.784407|3.063985|3.466047|0.071490|2.340765|2.002930|3.298070|1.928656|2.216698|6.918229|12.162481|7.137578|0.090456|0.111948|0.123244|0.109534|0.208504|0.143616|0.126427|0.097980|0.104936|0.086074|0.080475|0.063392|0.069645|0.052379|0.055612|0.049491|0.053466|0.063092|0.060114|0.130557|0.127948|0.088311|0.088993|0.109120|0.131051|0.137667|0.149885|0.175319|0.500000| |2.832911|2.991604|3.786921|6.562656|4.308854|3.232479|6.461249|7.070140|8.846990|6.714323|11.341715|17.567595|8.806652|6.400741|6.401804|0.121439|0.108318|8.020939|4.091593|3.656139|2.832912|3.405952|0.071436|2.444187|2.116066|3.359111|1.901541|2.111021|5.506715|7.855620|6.546738|0.076671|0.080451|0.105031|0.082227|0.304700|0.103313|0.100920|0.104375|0.105900|0.074906|0.073745|0.065013|0.076317|0.056515|0.059663|0.048098|0.053254|0.058132|0.056588|0.143260|0.108143|0.068484|0.073884|0.102870|0.116674|0.087105|0.113986|0.217002|0.173397|0.500000| |2.250819|2.319480|2.703747|4.487486|3.149853|2.585928|5.042179|5.052327|5.596635|4.090212|6.955023|8.806670|17.560026|8.984871|10.264406|0.225956|0.150617|7.968062|4.223586|3.658125|2.888671|3.402081|0.068493|2.516283|2.135293|3.400846|1.890243|2.118765|8.795866|10.829837|9.743408|0.060215|0.064415|0.075140|0.067959|0.202112|0.100618|0.114801|0.110477|0.096695|0.074393|0.079160|0.069606|0.078290|0.057976|0.058372|0.048055|0.051639|0.057307|0.058472|0.206813|0.145704|0.056529|0.058040|0.072137|0.083222|0.072471|0.093277|0.136749|0.142591|0.221651|0.500000| 1288.574357 -8658.679807 3409.777426 -175.248919 -4135.576943 2845.463794 -1290.113149 2.001194 BD731FFFFFFFFFDD 43E652EA4130E948 436AB488ADAFBE8B 42659D34127B3FFF 4092EFFFFFFFFFFF 43AAED5648C386E7