Version2.0 2020-01-08T11:17:11Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 18-Nov-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC(C)COc1ccc(cc1)[C@@H]2CC3=C([C@H](Nc4ccccc4N3)c5cccc(c5)[N+](=O)[O-])C(=O)C2 C21231176 RHF 6-31G(d) (6D,7F) CC(C)COc1ccc(cc1)[C@@H]2CC3=C([C@H](Nc4ccccc4N3)c5cccc(c5)[N+](=O)[O-])C(=O)C2 C01[X(C29H29N3O4)] 189 C1 598 CC(COc1ccc(cc1)[C@H]1CC(=O)C2=C(C1)Nc1ccccc1N[C@@H]2c1cccc(c1)[N+](=O)[O-])C CC(COc1ccc(cc1)[C@H]1CC(=O)C2=C(C1)Nc1ccccc1N[C@@H]2c1cccc(c1)[N+](=O)[O-])C CC(C)COc1ccc(cc1)[C@H]2CC(=O)C3=C(C2)Nc4ccccc4N[C@@H]3c5cccc(c5)[N+]([O-])=O InChIKey=PPEIDHXRIRCMLR-ONOMSOESSA-N InChI=1S/C29H29N3O4/c1-18(2)17-36-23-12-10-19(11-13-23)21-15-26-28(27(33)16-21)29(20-6-5-7-22(14-20)32(34)35)31-25-9-4-3-8-24(25)30-26/h3-14,18,21,29-31H,15-17H2,1-2H3/t21-,29-/m1/s1 InChI=1/C29H29N3O4/c1-18(2)17-36-23-12-10-19(11-13-23)21-15-26-28(27(33)16-21)29(20-6-5-7-22(14-20)32(34)35)31-25-9-4-3-8-24(25)30-26/h3-14,18,21,29-31H,15-17H2,1-2H3/t21-,29-/m1/s1 CC(C)COc1ccc(cc1)[C@@H]2CC3=C([C@H](Nc4ccccc4N3)c5cccc(c5)[N+](=O)[O-])C(=O)C2 C01[X(C29H29N3O4)] 189 C01 598 CC(COc1ccc(cc1)[C@H]1CC(=O)C2=C(C1)Nc1ccccc1N[C@@H]2c1cccc(c1)[N+](=O)[O-])C CC(COc1ccc(cc1)[C@H]1CC(=O)C2=C(C1)Nc1ccccc1N[C@@H]2c1cccc(c1)N(O)O)C CC(C)COc1ccc(cc1)[C@H]2CC(=O)C3=C(C2)Nc4ccccc4N[C@@H]3c5cccc(c5)N(O)O InChIKey=OGJKRHREASYUDO-ONOMSOESSA-N InChI=1S/C29H31N3O4/c1-18(2)17-36-23-12-10-19(11-13-23)21-15-26-28(27(33)16-21)29(20-6-5-7-22(14-20)32(34)35)31-25-9-4-3-8-24(25)30-26/h3-14,18,21,29-31,34-35H,15-17H2,1-2H3/t21-,29-/m1/s1 InChI=1/C29H31N3O4/c1-18(2)17-36-23-12-10-19(11-13-23)21-15-26-28(27(33)16-21)29(20-6-5-7-22(14-20)32(34)35)31-25-9-4-3-8-24(25)30-26/h3-14,18,21,29-31,34-35H,15-17H2,1-2H3/t21-,29-/m1/s1 3587.9153298163 -1577.7485853 1-A 29829.0544 128 470 598 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|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 11.6179 16.9970 19.3860 20.7772 39.8138 42.4191 56.9515 57.4844 58.5708 66.6490 86.1409 112.9940 124.8503 129.5087 148.2295 153.3474 165.1064 174.0620 190.9592 212.4104 236.3853 243.2309 259.8153 273.1856 287.3959 307.8816 317.8043 333.5942 345.2686 356.3679 379.4314 411.7045 433.4170 439.5771 458.2886 463.0038 467.5149 472.1471 485.0777 485.8400 506.7841 515.7872 535.2205 550.9792 583.2790 588.8383 601.1829 612.6990 619.4402 626.2920 646.8289 659.9450 673.7680 702.4673 712.8124 731.8788 735.7718 748.9367 775.4023 803.2591 810.7908 813.7216 827.6119 850.7289 857.9434 877.5739 903.1243 907.5993 918.2391 926.2120 928.9546 940.8179 948.3726 965.0432 968.4886 982.2526 1015.2017 1016.6080 1018.4965 1022.0344 1048.8468 1051.1837 1052.7943 1054.7372 1073.5022 1076.8233 1085.6296 1093.0518 1093.3726 1100.8603 1110.0288 1125.3646 1147.0297 1163.0436 1174.4988 1182.3727 1201.3081 1204.8992 1210.6400 1217.3738 1221.5027 1231.2747 1242.0166 1250.0649 1251.7114 1265.8780 1278.3846 1300.1448 1305.8667 1309.1392 1310.2994 1322.1421 1330.9372 1337.3746 1344.8993 1366.9996 1386.6943 1404.0214 1408.4935 1416.4471 1425.6580 1428.0395 1432.9011 1443.5660 1461.1990 1464.8789 1486.5338 1488.8413 1511.2388 1518.7423 1525.3721 1556.3874 1558.8456 1571.6796 1584.8313 1592.7815 1596.8927 1607.4072 1612.2323 1628.2518 1634.7544 1638.2898 1640.3955 1649.2293 1658.7737 1659.9413 1663.4877 1671.8101 1688.8006 1699.7052 1714.3515 1775.0170 1781.3597 1795.2876 1799.2992 1811.8936 1822.8779 1833.1034 1865.6110 1945.0362 3189.9930 3195.2237 3198.4099 3200.9889 3202.3225 3206.4162 3214.0318 3235.2778 3242.4898 3252.2957 3260.7417 3270.7773 3286.3084 3292.8054 3295.5383 3346.9843 3356.0151 3357.3511 3357.4377 3374.8775 3377.8156 3392.0424 3393.0063 3399.3514 3405.8520 3423.1165 3439.9447 3802.7365 3872.2750 8.1166 3.9067 5.7227 3.7785 5.1518 7.3942 4.5712 5.0772 3.8873 4.8578 5.6119 3.7100 3.7441 4.8485 3.0382 5.1767 5.6303 4.7763 5.3799 3.9381 1.1359 3.7040 2.2692 1.5649 3.5918 5.2565 5.9790 4.5301 3.5117 3.9494 3.7712 4.0915 6.9618 3.2466 3.0804 3.4546 2.9587 3.2162 1.2758 3.7506 2.6664 4.8272 3.3928 3.1672 6.4784 4.0593 3.2435 4.9757 3.9208 4.5594 3.9348 4.4215 5.1170 6.3275 5.1267 3.3390 3.4856 4.0011 2.8310 3.7895 3.4159 3.5737 3.7897 1.3422 4.5455 3.6735 3.6072 3.5492 2.4222 2.8142 1.3162 3.4988 1.6621 1.8462 1.7034 2.8469 1.2879 4.1331 1.2931 2.7781 1.3738 1.5537 1.8484 1.4201 1.4024 1.4133 4.5091 1.3456 5.9017 1.3064 2.6968 1.3572 2.5818 2.4115 4.1013 4.4757 1.7457 2.0124 3.0171 2.3917 2.8163 2.0895 2.0828 2.1779 2.2370 1.9725 1.3995 1.6785 1.4181 2.1631 1.4062 1.7531 2.1776 2.6721 2.5914 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1.2033 1.4224 0.6692 1.8246 0.8808 1.0130 0.9414 1.6183 0.7820 2.5167 0.7903 1.7097 0.8904 1.0115 1.2071 0.9308 0.9522 0.9655 3.1311 0.9472 4.1568 0.9328 1.9578 1.0127 2.0014 1.9219 3.3333 3.6866 1.4843 1.7214 2.6054 2.0883 2.4758 1.8664 1.8930 2.0052 2.0651 1.8623 1.3476 1.6717 1.4248 2.1843 1.4225 1.8055 2.2727 2.8158 2.7617 2.8263 1.7018 1.8633 1.4485 1.8727 2.3070 2.5274 2.6007 1.9963 2.0003 1.7535 1.7741 1.8018 1.7953 1.9727 2.2167 2.8033 1.9325 1.9163 2.0251 2.7388 3.1341 3.7030 1.7148 1.7545 1.6564 1.6588 12.8164 1.6895 1.7245 4.0723 2.9926 1.8890 3.9787 3.9321 3.6037 11.2131 10.4522 10.5281 11.8666 9.4565 10.7037 7.1060 22.9715 26.3503 6.3095 6.2615 6.4441 6.4677 6.3525 6.5236 6.5628 6.8330 6.8213 6.8634 6.9035 6.9413 6.9130 6.9978 7.0371 7.1907 7.2341 7.2382 7.2429 7.3346 7.3263 7.4471 7.4263 7.4516 7.4701 7.5431 7.6322 9.1674 9.5159 0.8943 0.2014 0.4810 0.0143 0.5546 0.0546 0.2610 0.5202 0.1685 0.4219 1.0271 3.4633 0.2723 1.5068 2.5467 2.2089 3.0986 0.4688 3.0139 0.5580 0.3749 4.5293 0.8469 0.8264 0.3395 3.0513 2.4687 1.1188 0.6184 0.6357 1.6509 7.1132 8.4581 2.4259 2.6590 1.1104 0.5858 2.5979 79.7143 6.8662 3.7248 1.9220 0.4285 1.5288 2.1811 17.2514 26.9503 8.4858 1.1161 9.2865 15.3870 2.9203 10.4263 3.9680 7.1633 4.6550 30.4559 16.8949 33.7147 13.9693 38.0803 37.4631 12.8757 102.0608 35.6462 7.3800 10.8231 16.0457 8.5462 24.7369 6.0083 0.4695 61.6646 11.4813 0.7963 2.0413 0.3810 31.4905 3.3468 8.6684 1.2372 3.6958 3.4052 6.5397 0.6981 2.2423 23.1434 0.2197 1.6458 0.0963 0.3402 0.1482 0.2484 20.7104 28.0312 86.3195 7.1882 19.3589 7.2262 6.9550 16.1746 29.6581 5.4686 0.9033 15.9398 5.0296 25.9728 30.3858 30.8636 11.4038 2.8764 4.3268 0.0626 30.3468 7.1609 58.5131 108.5724 45.4770 50.1495 116.0163 273.9002 276.9648 79.4409 66.4678 6.0310 7.5366 11.3931 11.4800 1.8216 17.8216 62.8692 91.4868 7.0163 1.8114 56.2603 30.0294 10.0541 37.9632 1.8935 9.2708 0.9579 2.9227 370.4640 5.1340 16.0091 33.3463 168.9342 64.0204 129.7381 170.1773 461.5695 18.8212 59.9587 70.7559 101.3968 8.1763 96.5846 152.6178 326.3645 323.7826 6.5185 38.6521 9.7016 10.9876 28.1431 23.7082 23.0270 27.0880 30.3743 25.4968 95.4904 71.4866 6.9915 13.9604 35.3607 15.5045 3.9422 26.5932 17.9385 20.7186 10.2029 28.8666 10.5589 12.9947 14.4434 1.6212 1.0035 6.9222 46.0777 2.4091 1.3785 1.0864 1.7821 4.0408 6.6331 5.0675 1.8611 2.1405 0.9291 2.9005 0.2526 1.1378 1.6854 0.7556 2.7623 2.2198 0.8084 1.1599 2.3844 0.2630 1.5841 3.2129 0.9603 0.1876 2.7580 2.5534 2.0347 1.3794 0.1486 0.6007 0.6929 1.6038 2.9748 1.4365 1.2730 0.6698 0.2882 1.9877 0.6008 2.3687 2.7854 1.1690 0.7116 1.1736 3.8405 1.7091 3.5221 0.7071 0.6624 1.9327 2.3294 8.0636 4.6522 2.8292 12.5199 3.8688 1.6471 0.8549 7.0859 0.7628 2.0987 2.0615 1.8177 2.7470 1.7727 5.0322 3.0825 5.7827 20.3630 3.0243 22.8181 0.7283 3.8711 2.3304 1.6530 2.6891 5.9617 2.5242 3.8109 4.6377 1.0614 10.7008 1.2394 1.1629 1.0513 25.6334 0.2753 21.1920 0.1124 0.1922 0.6319 6.8449 17.0469 3.0179 4.5841 2.0746 1.5619 26.5931 5.5302 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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 8607.6242 47409.4436 51974.1533 0.99995 -0.00970 0.00396 0.00969 0.99995 0.00293 -0.00399 -0.00290 0.99999 1 0.01006 0.00183 0.00167 0.20967 0.03807 0.03472 16.72 24.45 27.89 29.89 57.28 61.03 81.94 82.71 84.27 95.89 123.94 162.57 179.63 186.33 213.27 220.63 237.55 250.44 274.75 305.61 340.11 349.95 373.82 393.05 413.50 442.97 457.25 479.97 496.76 512.73 545.92 592.35 623.59 632.45 659.38 666.16 672.65 679.31 697.92 699.02 729.15 742.10 770.06 792.74 839.21 847.21 864.97 881.54 891.24 901.09 930.64 949.51 969.40 1010.69 1025.58 1053.01 1058.61 1077.55 1115.63 1155.71 1166.55 1170.76 1190.75 1224.01 1234.39 1262.63 1299.39 1305.83 1321.14 1332.61 1336.56 1353.63 1364.50 1388.48 1393.44 1413.24 1460.65 1462.67 1465.39 1470.48 1509.06 1512.42 1514.74 1517.53 1544.53 1549.31 1561.98 1572.66 1573.12 1583.89 1597.08 1619.15 1650.32 1673.36 1689.84 1701.17 1728.41 1733.58 1741.84 1751.53 1757.47 1771.53 1786.98 1798.56 1800.93 1821.32 1839.31 1870.62 1878.85 1883.56 1885.23 1902.27 1914.92 1924.18 1935.01 1966.81 1995.14 2020.07 2026.51 2037.95 2051.20 2054.63 2061.63 2076.97 2102.34 2107.63 2138.79 2142.11 2174.34 2185.13 2194.67 2239.29 2242.83 2261.30 2280.22 2291.66 2297.57 2312.70 2319.64 2342.69 2352.05 2357.13 2360.16 2372.87 2386.61 2388.29 2393.39 2405.36 2429.81 2445.50 2466.57 2553.85 2562.98 2583.02 2588.79 2606.91 2622.71 2637.43 2684.20 2798.47 4589.69 4597.21 4601.80 4605.51 4607.43 4613.32 4624.27 4654.84 4665.22 4679.33 4691.48 4705.92 4728.26 4737.61 4741.54 4815.56 4828.56 4830.48 4830.60 4855.70 4859.92 4880.39 4881.78 4890.91 4900.26 4925.10 4949.31 5471.29 5571.34 0.573223 0.602688 0.603632 0.507912 -1577.175362 -1577.145897 -1577.144953 -1577.240673 3.210465D-04 MUNgauss RevisionA2.0 retrievium 08-Jan-2020 DUDE CC(C)COc1ccc(cc1)[C@@H]2CC3=C([C@H](Nc4ccccc4N3)c5cccc(c5)[N+](=O)[O-])C(=O)C2 C21231176 RHF 6-31G(d) (6D,10F) C1 483.215807 |X|Y|Z| 60.575511 36.288848 157.615708 70.235485 27 6 7 25 2 |36.858105| |12.440784|36.858105| |7.534851|12.450331|36.858105| |7.622808|12.502362|7.542431|36.858105| |5.115777|8.007362|6.557908|13.554417|73.516695| |3.906392|5.202517|4.589074|7.974813|25.139090|36.858105| |3.151761|4.067767|3.867317|5.245678|14.575675|13.694376|36.858105| |2.622354|3.188241|3.052563|3.979048|9.416741|7.932930|13.820529|36.858105| |2.522112|2.953549|2.771084|3.759315|8.149409|6.776180|7.868611|13.667263|36.858105| |2.871562|3.327407|3.016047|4.495703|9.239896|7.937032|6.922179|8.029234|13.746267|36.858105| |3.626777|4.381893|3.799725|6.682818|13.979367|13.738958|7.955097|6.902073|7.849397|13.718088|36.858105| |2.107628|2.391681|2.275658|2.901689|5.968937|4.399267|5.002975|7.533909|12.540229|7.481200|4.973283|36.858105| |1.983758|2.263510|2.188835|2.681109|5.590817|4.003209|4.843289|7.452504|9.007053|5.605526|4.195040|17.533093|0.500000| |1.984583|2.207904|2.058931|2.644445|5.276696|3.729470|4.035436|5.371134|7.530373|5.975736|4.266201|12.461093|0.249606|36.858105| |1.718008|1.880276|1.776856|2.190718|4.280674|2.891521|3.107824|3.914393|4.889062|4.155229|3.219712|7.464566|0.188901|12.547264|36.858105| |1.623305|1.769215|1.697498|2.044809|3.970237|2.651908|2.844845|3.541332|4.339290|3.731388|2.936629|6.568852|0.174649|7.595455|14.120982|36.858105| |1.438506|1.552012|1.500077|1.759869|3.377392|2.194551|2.340048|2.802317|3.241408|2.881989|2.383081|4.359801|0.122179|4.827418|7.451096|12.582882|36.858105| |1.407099|1.523189|1.487594|1.717885|3.311823|2.143407|2.309083|2.764680|3.127880|2.747307|2.295903|4.152926|0.121169|4.240148|5.831823|9.177320|17.637649|0.500000| |1.362322|1.468232|1.415338|1.648246|3.166759|2.034531|2.183264|2.582900|2.890983|2.568011|2.171575|3.731881|0.107626|4.313743|6.487990|7.678119|12.998387|0.260445|53.358707| |1.348918|1.443811|1.377968|1.618686|3.082849|1.968218|2.082546|2.424021|2.719040|2.476299|2.113335|3.391663|0.094655|4.158378|6.087634|6.036356|7.702525|0.159473|18.495628|36.858105| |1.236803|1.312871|1.255091|1.456236|2.747083|1.727118|1.811156|2.061864|2.273103|2.111461|1.843013|2.721221|0.075845|3.214021|4.239530|4.265723|5.366475|0.123271|10.640078|13.698438|36.858105| |1.211352|1.277818|1.214048|1.411703|2.643378|1.648512|1.711823|1.920390|2.106522|1.990074|1.759531|2.451586|0.067494|2.920984|3.646425|3.493312|4.010938|0.094702|6.997672|7.871603|13.780905|36.858105| |1.287172|1.356941|1.277181|1.505868|2.815186|1.759717|1.816495|2.033389|2.244562|2.138240|1.889089|2.587645|0.070190|3.191159|3.897642|3.507981|3.733766|0.087366|6.181254|6.817960|7.967058|13.762110|36.858105| |1.415512|1.503259|1.407294|1.688186|3.180078|2.017023|2.089882|2.377028|2.671129|2.521922|2.184974|3.143969|0.084243|4.115574|5.200978|4.321407|4.316730|0.097853|7.034444|7.919604|6.938117|7.976050|13.785808|36.858105| |1.456312|1.561243|1.472514|1.765640|3.365987|2.166494|2.280066|2.664196|3.037438|2.781365|2.350070|3.781981|0.102528|5.078163|7.542607|6.107757|6.142669|0.130187|10.725767|13.688678|7.964352|6.852710|7.892858|13.708013|36.858105| |1.620169|1.757809|1.649986|2.019564|3.906123|2.574960|2.741354|3.310172|3.896982|3.457522|2.819969|5.130068|0.136131|8.015593|13.940314|7.830234|6.182983|0.133904|9.127552|7.772613|5.148034|4.552464|5.182246|7.948995|13.540423|53.358707| |1.374921|1.464378|1.413639|1.654059|3.117402|1.999994|2.080056|2.420742|2.805458|2.614415|2.197593|3.557154|0.095612|3.898722|5.352375|7.446653|12.441214|0.251442|10.392686|6.297574|5.158468|3.989922|3.640202|3.994774|5.133123|6.518600|36.858105| |1.409891|1.489081|1.423397|1.689285|3.145053|2.013936|2.053032|2.358701|2.775968|2.677306|2.252288|3.425644|0.088513|3.899399|5.143643|6.245310|7.415721|0.157102|7.704333|5.661880|4.853680|4.078837|3.894509|4.302553|5.194719|6.524328|13.705346|36.858105| |1.329571|1.389342|1.330231|1.562989|2.872654|1.812609|1.825099|2.051757|2.375824|2.344613|2.022024|2.804274|0.072726|3.096891|3.769254|4.326712|4.956466|0.117389|5.669279|4.264682|4.054266|3.616633|3.421174|3.564358|3.952295|4.926549|7.867149|13.737163|36.858105| |1.234889|1.288715|1.244914|1.436254|2.639353|1.650682|1.670016|1.864614|2.117911|2.075792|1.816429|2.470283|0.065421|2.638083|3.149357|3.672043|4.388397|0.111453|5.123754|3.693064|3.657260|3.229205|2.949101|2.979159|3.287738|4.103941|6.777006|7.928747|13.791429|36.858105| |1.212382|1.273911|1.239549|1.416122|2.626206|1.645364|1.686890|1.898029|2.135437|2.050326|1.790414|2.525099|0.068304|2.645836|3.208435|3.897506|5.027972|0.134816|5.757803|3.872724|3.799442|3.195248|2.842416|2.880374|3.285110|4.117378|7.951268|6.977322|8.047301|13.779446|36.858105| |1.271114|1.348107|1.312708|1.506244|2.826003|1.788983|1.859267|2.129515|2.406945|2.257313|1.941238|2.942399|0.080673|3.085683|3.918050|5.095264|7.580936|0.206997|7.878544|4.801690|4.413447|3.488978|3.087000|3.218465|3.883401|4.901320|13.725291|7.993707|6.882884|7.866686|13.788442|36.858105| |1.123860|1.177621|1.153604|1.296951|2.399445|1.488052|1.526845|1.699066|1.877317|1.804460|1.601318|2.173271|0.059535|2.232190|2.621370|3.101135|3.844556|0.108893|4.649109|3.126103|3.157138|2.722402|2.415047|2.405469|2.681419|3.391145|5.117380|4.547794|5.145646|7.787204|13.060500|7.791263|53.358707| |1.082274|1.126949|1.103348|1.236363|2.270653|1.398642|1.423684|1.567829|1.727054|1.680871|1.506348|1.964741|0.053463|2.018916|2.321415|2.672985|3.168735|0.088302|3.905587|2.712854|2.777163|2.479984|2.227729|2.198466|2.390323|3.031146|4.080958|3.915886|4.687112|7.092836|8.375511|5.427499|21.710725|73.516695| |1.099383|1.156651|1.138962|1.269431|2.361519|1.462800|1.514012|1.687855|1.844592|1.752390|1.559190|2.138109|0.059518|2.168775|2.541796|3.021927|3.792699|0.112629|4.667312|3.039358|3.058367|2.602418|2.294296|2.288871|2.574785|3.277899|4.675705|3.921177|4.104055|5.424299|8.369639|7.088431|21.714266|16.025797|73.516695| |1.713252|1.877724|1.822081|2.188654|4.265615|2.882874|3.090102|3.892287|4.899683|4.178118|3.222910|7.573785|0.194477|6.588200|7.784436|12.918815|7.624495|0.208941|6.920682|4.151845|3.255717|2.769643|2.774494|3.272303|4.164535|6.910382|5.924124|5.120633|3.895730|3.439475|3.672264|4.621419|4.102619|4.658559|5.257081|36.858105| |1.602379|1.744315|1.714048|2.004719|3.868503|2.555547|2.720504|3.304339|3.933049|3.476462|2.810775|5.331103|0.145149|4.655065|5.387392|8.161788|7.001482|0.222890|6.327396|3.719920|3.045915|2.576837|2.516746|2.860914|3.541991|5.450550|6.047955|4.916093|3.919837|3.648105|4.068212|5.196669|4.607469|5.144516|5.990531|15.849542|73.516695| |1.979636|2.202430|2.126862|2.641778|5.232074|3.695560|3.950817|5.210929|7.458494|6.080779|4.285220|12.477030|0.249417|7.681144|6.588569|7.393697|4.874782|0.132061|5.171767|3.349792|2.715623|2.410013|2.484837|2.945185|3.558180|6.115611|4.141124|3.945749|3.211303|2.834560|2.914438|3.419845|3.371483|3.952243|4.303566|12.575756|14.371228|36.858105| |17.560320|8.791251|6.899505|5.522236|7.474596|3.300606|2.783317|2.345425|2.237971|2.488674|3.039556|1.902510|0.050266|1.798597|1.575543|1.494204|1.336021|0.036406|1.731181|1.259623|1.161046|1.139037|1.206842|1.319043|1.353427|2.034444|1.278246|1.306631|1.236429|1.154298|1.135604|1.188209|1.439980|1.814288|1.843961|1.570510|2.627045|1.792172|0.500000| |17.538402|8.738729|5.471773|6.935499|8.445343|3.784003|3.044377|2.572500|2.512369|2.891132|3.630562|2.109587|0.054793|2.021798|1.747143|1.637303|1.449619|0.039140|1.874880|1.374256|1.261524|1.242283|1.328001|1.462207|1.493451|2.259917|1.388790|1.433678|1.353049|1.250599|1.221712|1.278767|1.536505|1.934721|1.956915|1.711616|2.830386|1.970791|0.301920|0.500000| |17.523388|8.758209|6.798431|6.871429|8.292572|3.730861|3.003404|2.544064|2.489693|2.867875|3.595169|2.093357|0.054438|1.958588|1.704160|1.624305|1.441233|0.039219|1.844844|1.338402|1.227920|1.199908|1.270727|1.394992|1.439065|2.173882|1.386589|1.424868|1.349711|1.255671|1.230474|1.285396|1.554247|1.959168|1.982259|1.729235|2.891855|2.001807|0.302034|0.301161|0.500000| |8.897428|17.524140|8.905206|9.009817|13.217852|4.938464|4.049913|3.159650|2.872511|3.157018|4.052034|2.340219|0.062103|2.187710|1.863185|1.738318|1.528238|0.041597|1.986236|1.440481|1.311324|1.280461|1.363863|1.511040|1.562754|2.394344|1.434135|1.455395|1.354244|1.255553|1.243057|1.318552|1.564096|1.952569|2.010036|1.822723|2.998402|2.119029|0.212419|0.212947|0.173231|0.500000| |5.480743|8.773394|17.594377|6.880367|13.089756|5.095102|4.487895|3.422819|2.994753|3.171262|3.963507|2.432654|0.065751|2.167563|1.861231|1.778372|1.565744|0.043318|2.011598|1.430288|1.297041|1.248811|1.311034|1.448810|1.526075|2.340344|1.461984|1.460987|1.356693|1.270768|1.272647|1.356313|1.611366|2.004439|2.085885|1.915737|3.197738|2.247523|0.140817|0.122457|0.139357|0.212938|0.500000| |6.876265|8.795431|17.547009|5.491175|8.743553|3.690476|3.249952|2.644341|2.409790|2.582699|3.141111|2.025705|0.054560|1.854956|1.621766|1.552571|1.385831|0.038222|1.790795|1.283952|1.176738|1.141744|1.199023|1.312928|1.367167|2.067583|1.309699|1.317589|1.236961|1.162521|1.158089|1.222450|1.473935|1.845811|1.903379|1.654291|2.782254|1.900732|0.206724|0.140648|0.168248|0.213310|0.301351|0.500000| |6.837001|8.778260|17.518814|6.795917|10.160586|4.326595|3.623589|2.942665|2.732728|3.010772|3.760457|2.260502|0.060042|2.029425|1.761224|1.699190|1.503713|0.041519|1.916367|1.366265|1.245163|1.201403|1.259446|1.385260|1.453519|2.211251|1.426158|1.437620|1.348935|1.265295|1.258679|1.328655|1.596862|1.998447|2.056697|1.843154|3.104473|2.157056|0.170153|0.139439|0.201921|0.173459|0.301245|0.301587|0.500000| |6.846184|8.831073|6.899560|17.519946|16.523316|7.111428|4.800764|3.823604|3.748353|4.614340|6.799345|2.919143|0.074172|2.621710|2.188187|2.071415|1.782912|0.048472|2.247444|1.613715|1.451924|1.402156|1.488413|1.664959|1.749504|2.715525|1.689501|1.729190|1.607011|1.479018|1.455777|1.542959|1.815682|2.264629|2.316321|2.253284|3.697183|2.742719|0.140136|0.168296|0.202401|0.174847|0.171439|0.140528|0.203747|0.500000| |7.084177|8.837252|5.493252|17.533640|16.557235|7.072026|4.775558|3.803184|3.727855|4.588047|6.759434|2.906884|0.073646|2.733664|2.251668|2.073535|1.780641|0.047822|2.279390|1.662354|1.496522|1.460756|1.571666|1.768142|1.832114|2.855194|1.679581|1.732580|1.603773|1.463057|1.432520|1.520160|1.777497|2.216435|2.262240|2.187125|3.532012|2.624448|0.143343|0.212977|0.173683|0.214402|0.140148|0.123149|0.139919|0.300652|0.500000| |3.107769|4.090100|4.047254|4.862617|13.477228|8.958789|17.735013|8.897926|5.607981|4.978940|5.667114|4.080082|0.114946|3.410412|2.742444|2.536716|2.138609|0.059115|2.753787|1.929046|1.694742|1.605854|1.695666|1.929175|2.090977|3.360811|1.903607|1.866411|1.671204|1.543699|1.566505|1.721671|1.947758|2.376488|2.536295|2.723390|4.348176|3.333183|0.077852|0.082188|0.081016|0.116721|0.136715|0.095806|0.102252|0.120600|0.120091|0.500000| |2.335079|2.801988|2.742069|3.330434|7.625894|5.655388|8.993771|17.699717|8.901162|5.680301|4.965857|7.006035|0.230759|5.095591|3.922288|3.590544|2.881701|0.080212|3.666814|2.488836|2.110599|1.948680|2.044564|2.380280|2.698401|4.542358|2.434935|2.323576|2.011387|1.844111|1.901393|2.155009|2.327732|2.789325|3.048977|3.890344|5.930843|4.898066|0.059052|0.063487|0.062817|0.078136|0.085860|0.067375|0.073250|0.088836|0.088405|0.215852|0.500000| |2.676315|2.980996|2.698810|3.912498|7.471714|5.667860|4.976767|5.671895|8.905225|17.702706|8.998361|6.895645|0.139706|6.107424|4.377903|3.959850|3.036099|0.079059|3.618530|2.588470|2.205706|2.082820|2.245850|2.658126|2.923977|4.920555|2.822385|2.967780|2.600299|2.264466|2.203110|2.408194|2.608910|3.182135|3.271841|4.437488|6.518089|6.404661|0.064710|0.075739|0.075320|0.078163|0.077162|0.065128|0.075841|0.114315|0.113741|0.107954|0.124235|0.500000| |4.045553|4.657596|3.875446|7.390925|12.464829|8.870248|5.640610|4.971050|5.628012|8.953419|17.762839|4.076082|0.096511|3.685944|2.897139|2.668220|2.207348|0.058847|2.742032|1.980613|1.747823|1.682990|1.810190|2.074661|2.198083|3.518482|2.079665|2.162452|1.972259|1.771405|1.727883|1.848619|2.109371|2.612225|2.667202|2.904467|4.581472|3.726013|0.091642|0.114745|0.114024|0.115599|0.107067|0.088982|0.108664|0.225902|0.225201|0.124217|0.107808|0.219327|0.500000| |2.077747|2.284172|2.095942|2.771804|5.393200|3.800221|3.868341|4.828576|6.934464|6.573054|4.606093|8.814190|0.174705|17.510467|8.964420|6.207141|4.256927|0.102918|5.156725|3.812658|3.042829|2.841189|3.164955|4.073789|4.731448|9.373294|3.713902|3.942231|3.193325|2.665728|2.599630|2.949031|2.974630|3.557965|3.720336|5.645537|7.454419|6.779877|0.051915|0.059399|0.057186|0.062483|0.060500|0.052307|0.057601|0.076794|0.081187|0.089955|0.120640|0.208249|0.113841|0.500000| |2.000494|2.241319|2.075927|2.662818|5.386584|3.774428|4.192606|5.525441|6.868489|5.399685|4.127979|8.869323|0.219251|17.542999|8.941732|5.762011|4.127055|0.102618|5.415132|3.947046|3.105606|2.879531|3.199985|4.149313|4.929235|10.482572|3.352037|3.333807|2.720436|2.354475|2.366721|2.730517|2.764176|3.284770|3.532974|4.956925|6.737050|5.565851|0.050541|0.056841|0.054160|0.062670|0.060985|0.052157|0.056081|0.071725|0.076937|0.099940|0.149874|0.143736|0.098424|0.303783|0.500000| |1.278106|1.373321|1.331737|1.528492|2.926889|1.860506|1.994891|2.327737|2.556534|2.289016|1.968009|3.201216|0.093246|3.546824|4.873173|5.754679|9.374931|0.239524|25.970241|9.592430|7.626434|4.924058|4.107039|4.347066|5.874744|6.796568|6.845825|4.971011|3.909728|3.733378|4.383314|6.040103|4.974500|5.368914|6.728858|4.321332|7.472594|3.301721|0.033292|0.035809|0.035361|0.037916|0.038612|0.034538|0.036848|0.042585|0.042969|0.051874|0.067763|0.065476|0.050980|0.088066|0.092312|0.500000| |1.174188|1.244993|1.198019|1.373748|2.588857|1.619220|1.700599|1.927197|2.105376|1.954912|1.718139|2.504058|0.070485|2.853521|3.671794|3.872619|5.097300|0.123880|9.775536|8.953314|17.701719|8.933373|5.658802|4.984543|5.664648|5.671237|5.072747|4.518285|3.927225|3.756007|4.075666|4.729435|4.727237|5.352544|6.096598|3.074143|5.283773|2.542966|0.030708|0.033146|0.032452|0.034483|0.034408|0.031275|0.033095|0.038161|0.039004|0.044449|0.055058|0.056505|0.045325|0.074809|0.076218|0.230762|0.500000| |1.136350|1.193306|1.136639|1.309255|2.439952|1.508648|1.561274|1.733207|1.883219|1.791399|1.602517|2.156599|0.059527|2.508354|3.031032|2.954893|3.387485|0.082703|5.678601|5.622664|8.935253|17.725284|8.898809|5.656852|4.942168|4.930312|3.457728|3.528269|3.286578|3.036806|2.999883|3.171916|3.582477|4.326663|4.481412|2.427590|4.087750|2.134566|0.029790|0.032357|0.031290|0.033222|0.032409|0.029808|0.031268|0.036147|0.037581|0.040926|0.048849|0.051950|0.042806|0.068181|0.068852|0.116206|0.215792|0.500000| |1.255099|1.315326|1.233922|1.451797|2.695608|1.669818|1.710544|1.888644|2.068129|1.995729|1.788207|2.328399|0.062928|2.829960|3.296609|2.971218|3.096994|0.074309|4.920879|4.924157|5.651754|8.892239|17.726659|8.936035|5.630669|5.727897|3.067401|3.319339|3.033332|2.647956|2.520802|2.670801|2.971824|3.640136|3.681754|2.433720|3.954191|2.229722|0.032767|0.036104|0.034368|0.036808|0.035050|0.032286|0.033750|0.039765|0.042262|0.044538|0.052486|0.058160|0.047969|0.079239|0.079647|0.092891|0.124162|0.213481|0.500000| |1.491820|1.582178|1.466654|1.783129|3.348700|2.123607|2.180832|2.460099|2.770349|2.654099|2.311505|3.178412|0.083796|4.248953|4.948443|3.948279|3.719820|0.086372|5.703012|5.642880|4.983647|5.660912|8.932296|17.690756|8.935454|10.008899|3.457698|3.788113|3.213754|2.685881|2.567241|2.824050|2.953858|3.568143|3.668085|3.099510|4.770737|2.906643|0.038516|0.043086|0.040685|0.044329|0.041827|0.037967|0.039953|0.048570|0.052385|0.055712|0.067610|0.077810|0.061195|0.121034|0.122512|0.099334|0.108024|0.124209|0.215745|0.500000| |1.692511|1.839532|1.708553|2.118708|4.105020|2.706492|2.871014|3.431630|3.998136|3.586536|2.956532|4.962075|0.130059|8.028124|9.553613|5.839695|4.690583|0.107997|6.857664|5.834038|4.342293|4.112829|4.933512|7.624341|9.441506|26.088626|3.860693|3.965461|3.156524|2.657976|2.633399|3.040578|3.013928|3.571558|3.807211|4.295390|6.128372|4.109477|0.043301|0.048481|0.046038|0.051497|0.049408|0.043678|0.046409|0.057519|0.061748|0.071731|0.095088|0.102954|0.075193|0.201630|0.251118|0.111835|0.099214|0.093048|0.116547|0.231256|0.500000| |1.500094|1.586727|1.502574|1.815786|3.382267|2.184373|2.214990|2.558449|3.071993|2.986909|2.475381|3.821004|0.095994|4.617268|6.208253|6.853271|6.855015|0.141744|7.477084|5.887756|4.793056|4.194308|4.273303|5.037212|6.113553|7.964345|8.920698|17.743238|8.962185|5.658849|5.008171|5.670393|4.927277|5.725846|5.727211|5.317919|8.357235|4.282401|0.038441|0.042590|0.041999|0.043144|0.042799|0.038501|0.042019|0.051451|0.052157|0.055416|0.069251|0.093458|0.065962|0.134259|0.107565|0.127330|0.117140|0.098296|0.100675|0.125564|0.133261|0.500000| |1.341772|1.392097|1.324935|1.566154|2.851845|1.790668|1.781438|1.980701|2.295671|2.311528|2.011120|2.648117|0.067893|2.949986|3.461562|3.771418|4.050518|0.097036|4.823696|3.761448|3.632495|3.419992|3.351101|3.473142|3.670105|4.612996|5.620322|8.918726|17.729742|8.949017|5.693091|4.958171|5.672155|7.161123|6.053772|3.442441|6.022852|2.982441|0.034629|0.038109|0.037887|0.037660|0.037333|0.034248|0.037338|0.044763|0.044926|0.045261|0.053430|0.071903|0.055115|0.086789|0.072602|0.091873|0.095858|0.087299|0.084671|0.089289|0.084403|0.216679|0.500000| |1.181389|1.225223|1.184643|1.357784|2.477935|1.536495|1.544913|1.705077|1.919987|1.901106|1.686233|2.193212|0.058122|2.323867|2.695426|3.055601|3.520460|0.091362|4.254034|3.112118|3.154112|2.883938|2.654400|2.638608|2.827701|3.549067|4.907860|5.630699|8.869884|17.791435|8.926983|5.626461|9.781008|14.178583|8.831749|2.918872|5.493932|2.490210|0.030755|0.033248|0.033438|0.033127|0.033466|0.030827|0.033504|0.038897|0.038431|0.039836|0.046720|0.057492|0.046033|0.065723|0.058293|0.086849|0.090338|0.077161|0.067676|0.067056|0.065147|0.124153|0.213614|0.500000| |1.238166|1.318176|1.292172|1.465552|2.764996|1.745582|1.832719|2.101278|2.336256|2.161195|1.870501|2.848601|0.080087|2.914933|3.642848|4.728311|7.031979|0.226367|7.710637|4.424275|4.087704|3.215947|2.828498|2.936477|3.544816|4.540679|8.878058|5.658870|4.962201|5.636938|8.973579|17.772999|9.853831|8.876844|14.283635|4.417928|9.152392|3.279716|0.032244|0.034463|0.034734|0.035866|0.037237|0.033488|0.036303|0.041633|0.040847|0.047486|0.059821|0.063054|0.049203|0.075923|0.072610|0.176781|0.125534|0.082146|0.068382|0.071936|0.078947|0.124133|0.107697|0.124475|0.500000| |1.998951|2.237762|2.204888|2.668424|5.316612|3.722312|4.022700|5.197576|6.755644|5.577627|4.183892|8.752823|0.213334|5.533324|4.898629|5.564209|4.149625|0.118670|4.509861|2.899423|2.415204|2.151900|2.193610|2.538108|3.002196|4.942081|3.616989|3.389348|2.864597|2.610372|2.718185|3.146702|3.228055|3.801054|4.170196|9.012059|13.630374|17.605654|0.050375|0.054593|0.056489|0.059319|0.065199|0.054582|0.062700|0.077930|0.072057|0.095365|0.137460|0.154502|0.100940|0.138999|0.123685|0.082600|0.063924|0.053681|0.055210|0.069470|0.093700|0.098586|0.073987|0.064572|0.085842|0.500000| |2.051924|2.252927|2.149321|2.733361|5.267714|3.699472|3.728857|4.627427|6.737286|6.571507|4.545177|8.805034|0.174348|6.914640|5.874789|6.281210|4.391203|0.115016|4.709109|3.173918|2.619436|2.365766|2.465180|2.914820|3.425780|5.764746|4.033416|4.095868|3.398236|2.936543|2.923807|3.323333|3.357354|3.989985|4.203958|9.009674|11.867767|17.507004|0.051247|0.057103|0.058122|0.059663|0.062203|0.053208|0.061009|0.079982|0.076367|0.086808|0.115544|0.221217|0.113645|0.199938|0.140335|0.083965|0.067820|0.058413|0.061986|0.080961|0.109471|0.126430|0.089615|0.072103|0.086184|0.302851|0.500000| 1575.908666 -10862.404043 4334.891044 -214.059924 -5165.664257 3587.915588 -1577.748669 2.001168 40B43FFFFFFFFFFC 4540796CFE64C857 44C0796CFE64C857 4256E51B72400003 B14A22391F5F0C00 443EED7CD16E4878