Version2.1 2020-12-05T22:51:25Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 13-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE c1ccc(cc1)CCCOc2cccc3c2N[C@H]([C@H]4[C@@H]3C=CC4)c5cc(ccc5O)[N+](=O)[O-] C14476121 RHF 6-31G(d) (6D,7F) c1ccc(cc1)CCCOc2cccc3c2N[C@H]([C@H]4[C@@H]3C=CC4)c5cc(ccc5O)[N+](=O)[O-] C01[X(C27H26N2O4)] 171 C1 547 Oc1ccc(cc1[C@@H]1Nc2c(OCCCc3ccccc3)cccc2[C@@H]2[C@H]1CC=C2)[N+](=O)[O-] Oc1ccc(cc1[C@@H]1Nc2c(OCCCc3ccccc3)cccc2[C@@H]2[C@H]1CC=C2)[N+](=O)[O-] Oc1ccc(cc1[C@@H]2Nc3c(OCCCc4ccccc4)cccc3[C@H]5C=CC[C@@H]25)[N+]([O-])=O InChIKey=FJWJUCCEFZAIIH-LZCXECNNSA-N InChI=1S/C27H26N2O4/c30-24-15-14-19(29(31)32)17-23(24)26-21-11-4-10-20(21)22-12-5-13-25(27(22)28-26)33-16-6-9-18-7-2-1-3-8-18/h1-5,7-8,10,12-15,17,20-21,26,28,30H,6,9,11,16H2/t20-,21+,26+/m0/s1 InChI=1/C27H26N2O4/c30-24-15-14-19(29(31)32)17-23(24)26-21-11-4-10-20(21)22-12-5-13-25(27(22)28-26)33-16-6-9-18-7-2-1-3-8-18/h1-5,7-8,10,12-15,17,20-21,26,28,30H,6,9,11,16H2/t20-,21+,26+/m0/s1 c1ccc(cc1)CCCOc2cccc3c2N[C@H]([C@H]4[C@@H]3C=CC4)c5cc(ccc5O)[N+](=O)[O-] C01[X(C27H26N2O4)] 171 C01 547 Oc1ccc(cc1[C@@H]1Nc2c(OCCCc3ccccc3)cccc2[C@@H]2[C@H]1CC=C2)[N+](=O)[O-] O[C]1[CH][CH][C]([CH][C]1[C@@H]1N[C]2[C]([CH][CH][CH][C]2[C@@H]2[C@H]1CC=C2)OCCC[C]1[CH][CH][CH][CH][CH]1)[N]([O])[O] [O]N([O])[C]1[CH][CH][C](O)[C]([CH]1)[C@@H]2N[C]3[C]([CH][CH][CH][C]3[C@H]4C=CC[C@@H]24)OCCC[C]5[CH][CH][CH][CH][CH]5 InChIKey=FJWJUCCEFZAIIH-LZCXECNNSA-N InChI=1S/C27H26N2O4/c30-24-15-14-19(29(31)32)17-23(24)26-21-11-4-10-20(21)22-12-5-13-25(27(22)28-26)33-16-6-9-18-7-2-1-3-8-18/h1-5,7-8,10,12-15,17,20-21,26,28,30H,6,9,11,16H2/t20-,21+,26+/m0/s1 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442.18926 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 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168 169 170 171 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 12.1757 16.5623 19.8962 32.2394 40.2014 49.7562 51.5760 72.3315 87.0454 93.3818 107.2199 132.2578 142.6735 148.6652 168.8184 172.0941 193.8467 223.1847 248.4706 262.3414 291.1684 304.9973 319.8846 368.4832 368.7370 381.4535 392.1467 398.6928 401.1432 427.9491 441.2880 455.5900 479.9439 523.9565 538.0081 563.8956 581.7105 595.5693 599.0386 614.5484 630.9505 647.0378 664.4989 681.5934 693.5546 701.1221 728.9864 745.9962 758.6925 780.6454 812.2193 816.8505 819.3339 830.9088 839.4613 842.2620 858.7321 863.1721 883.1101 888.4492 894.2120 902.3352 924.8507 950.1784 950.7925 954.3706 958.2162 972.9103 1001.0738 1002.7841 1023.7613 1031.9914 1042.2338 1072.6343 1074.5835 1086.2509 1089.8004 1090.2391 1098.2969 1108.3651 1110.6178 1124.1782 1125.7255 1131.4960 1133.4379 1152.7627 1173.4886 1178.3842 1184.7624 1192.4447 1212.1495 1220.6846 1228.1133 1240.8926 1244.8666 1245.4104 1259.3434 1272.3704 1302.0890 1306.3632 1320.8050 1321.9140 1324.5242 1334.1544 1352.8584 1355.2560 1367.7858 1383.9285 1387.5314 1407.8407 1417.9438 1427.3406 1427.9810 1432.2012 1447.2639 1447.4217 1461.7137 1473.5644 1488.6259 1496.7174 1514.4473 1521.4530 1525.3296 1544.1630 1583.1068 1612.3818 1618.7481 1621.2906 1624.9189 1638.8536 1648.1565 1651.0338 1652.4210 1668.8765 1671.8814 1673.3712 1679.9247 1770.8274 1785.6085 1795.2017 1805.9375 1812.4224 1821.4187 1851.3085 1857.9424 3169.4960 3185.7476 3196.8640 3200.7510 3204.2992 3223.1336 3230.7141 3237.5260 3260.1646 3265.4834 3273.4692 3346.3460 3347.9177 3354.8210 3362.6576 3372.2734 3373.4039 3378.5381 3387.0227 3398.9169 3401.9991 3407.4958 3424.0093 3438.1654 3796.6593 3878.0635 6.4201 3.7439 6.5257 5.5326 4.6160 6.4591 7.4491 5.5975 3.4107 4.4877 4.8428 2.3584 7.7660 2.5271 5.3243 5.5601 5.7141 5.7131 4.8718 4.9941 3.9632 4.8579 5.2147 4.1243 2.5824 4.8407 4.4239 7.7318 3.9876 2.7403 3.9526 2.9228 4.7415 4.4671 4.0602 3.4594 4.0833 5.0870 3.9490 3.9386 6.2169 4.5211 3.3546 6.3363 4.2734 5.6474 2.5595 3.3379 1.8689 1.9117 3.6687 2.0923 1.3498 2.9486 3.5635 1.8857 1.9327 6.9189 2.9550 3.3488 2.9225 2.6654 3.0243 2.8100 1.2810 1.9498 1.2506 2.2342 1.9505 1.6653 2.4939 1.4471 3.3221 2.6442 1.4609 1.3098 2.9922 1.6567 1.3634 2.8003 1.3456 1.4454 2.0370 2.2807 2.7017 1.6902 3.6677 3.1135 1.9262 2.5168 2.0550 1.8975 1.6288 1.4402 1.6305 1.5088 4.3019 4.0229 1.1925 1.3447 1.4143 2.3913 1.7999 2.1772 2.2559 1.4693 1.8102 1.7008 1.5881 1.3523 1.5543 2.0686 1.5140 1.4231 1.3048 1.5390 1.8142 1.7290 1.2565 1.4250 1.4881 1.6733 1.4569 1.4112 1.5028 3.1789 1.9426 2.1143 4.7847 1.1009 1.1076 1.1173 2.6939 2.2615 2.2007 3.0323 1.1536 5.4419 5.2055 6.2584 6.6358 5.3114 5.6644 6.3160 10.2572 1.0841 1.0851 1.0580 1.0729 1.0591 1.0610 1.1044 1.1085 1.0913 1.0879 1.1079 1.0873 1.0897 1.0887 1.0915 1.0868 1.0954 1.0945 1.0989 1.1056 1.0924 1.0939 1.0927 1.0950 1.0757 1.0667 0.0006 0.0006 0.0015 0.0034 0.0044 0.0094 0.0117 0.0173 0.0152 0.0231 0.0328 0.0243 0.0931 0.0329 0.0894 0.0970 0.1265 0.1677 0.1772 0.2025 0.1980 0.2663 0.3144 0.3299 0.2069 0.4150 0.4008 0.7241 0.3781 0.2957 0.4535 0.3574 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0.3744 0.4964 0.1662 0.1828 0.2037 0.6293 0.4137 0.2032 0.2981 4.6079 3.8551 2.8310 0.3371 1.7359 1.1119 1.2892 3.0407 0.1950 0.5410 0.6330 0.3118 0.4209 1.2116 1.6978 0.2482 5.2143 0.5459 1.1291 0.0005 3.4033 3.7221 1.1538 18.4891 0.9932 4.8979 1.0938 6.8514 3.5581 0.6905 11.6754 0.0031 13.8721 22.5828 4.0557 36.1685 55.3820 29.3899 2.3066 8.3058 1.0190 1.9037 7.2196 45.6521 66.4337 54.6547 31.1399 21.8300 68.0424 24.0498 35.8947 2.0065 1.1020 30.5029 0.0875 6.7179 23.2425 18.6396 3.7367 1.2512 11.6691 15.7007 11.9215 1.1886 0.8610 0.1059 0.0115 8.6524 0.1171 4.3060 8.5422 4.5447 7.6044 1.2062 3.1615 20.2218 2.5420 4.6546 84.5724 3.1099 43.5545 3.4044 9.0533 0.0164 187.2234 41.7648 0.3843 0.9552 2.6118 1.7908 64.0850 21.2478 27.0588 1.8012 60.9044 63.5900 11.6801 3.4609 8.6367 98.4036 46.9306 12.3402 49.8198 84.7284 56.4501 34.0628 0.2513 31.7044 35.5986 19.7501 7.2516 44.7531 105.5250 193.2930 244.1763 7.5275 377.9892 0.6968 1.5663 2.2386 15.9047 146.2545 16.2596 45.5744 8.4870 76.4318 2.1471 71.2935 68.6197 6.2095 22.1568 1.2581 439.9032 33.2671 18.2178 3.2656 43.2865 56.0277 32.1231 12.0658 12.2179 29.5272 27.0905 62.7713 12.9187 7.3987 7.4590 9.2516 7.0375 48.4299 29.7448 25.8013 26.0187 3.1296 18.2344 1.4400 0.7419 35.5304 600.1996 0.7841 6.7508 2.4680 5.4323 0.9511 5.0017 3.0097 3.2530 0.8571 0.5949 0.9811 1.9779 0.9130 0.0681 0.8884 3.0340 0.7253 2.3680 2.9553 5.1531 2.1414 2.3021 5.2835 0.3970 0.0389 3.3432 3.1810 0.9639 3.1848 1.4202 1.7848 0.0353 0.7383 1.5342 1.1735 0.8660 0.7262 0.4547 0.5941 1.3287 1.2644 1.7046 2.1600 4.7328 1.8139 3.6971 7.3398 2.4879 3.4964 0.6138 0.9126 1.3957 1.3045 3.6318 5.0445 2.5830 11.3557 3.4866 8.4020 12.8007 5.6670 1.9332 6.0331 5.3762 0.9528 5.1176 2.6418 1.5484 3.2604 3.6464 3.4084 0.8286 6.6469 1.8889 2.1791 0.2260 22.1701 6.9198 0.0108 6.4600 1.0378 0.6512 1.5061 7.5835 13.4510 0.0549 29.6578 8.9959 0.2323 6.6501 19.5517 7.9558 22.2752 9.5662 4.3665 6.0167 39.7636 25.5249 3.9564 4.3629 2.9685 7.7306 11.6457 4.5827 5.2716 1.3238 6.9737 1.7758 4.7081 1.4634 8.9961 12.5040 7.6937 4.2322 17.2671 24.1295 25.6119 6.0498 0.2826 2.3718 7.5001 2.5319 7.0024 6.9262 2.2607 41.0344 42.4939 0.3794 148.4313 27.7427 14.6822 0.3703 9.4076 3.1974 0.5776 38.0033 11.9928 48.7725 8.1688 46.5936 51.2638 32.2152 8.3583 32.2076 3.0445 102.0605 27.8764 3.4478 128.2748 140.9549 20.9414 74.2400 35.2396 74.3614 45.4444 0.2315 11.6107 80.8814 63.7914 106.8770 77.2177 38.5506 159.8113 266.8730 158.5520 90.9153 157.3253 29.7547 97.7565 57.4730 113.0354 0.7459 0.7499 0.7393 0.7498 0.7495 0.7447 0.7491 0.7339 0.7412 0.7321 0.6382 0.7473 0.7484 0.6991 0.7035 0.2373 0.6524 0.3215 0.5805 0.7330 0.5475 0.7069 0.3696 0.5481 0.3656 0.6669 0.3991 0.4827 0.7258 0.6150 0.6629 0.7498 0.2874 0.3315 0.5786 0.7327 0.4776 0.1847 0.7314 0.6304 0.2397 0.4633 0.7483 0.7500 0.4656 0.7283 0.2257 0.0293 0.4772 0.6665 0.7393 0.4824 0.5894 0.1306 0.1072 0.3824 0.2458 0.7473 0.1622 0.0538 0.6558 0.7422 0.7050 0.0598 0.4411 0.2987 0.7440 0.2316 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0.3867 0.6333 0.8560 0.8571 0.6353 0.8428 0.3683 0.0568 0.6461 0.7999 0.8501 0.6509 0.7416 0.2310 0.1937 0.5533 0.3946 0.8554 0.2792 0.1021 0.7921 0.8520 0.8270 0.1129 0.6122 0.4600 0.8532 0.3761 0.3846 0.7136 0.5633 0.6504 0.2227 0.8391 0.8538 0.6111 0.2809 0.1703 0.8351 0.7894 0.8473 0.6849 0.8058 0.2006 0.3988 0.8385 0.3954 0.6664 0.8549 0.3598 0.2561 0.4191 0.8200 0.8239 0.8461 0.8571 0.5374 0.4765 0.8378 0.8265 0.8571 0.2239 0.7547 0.4026 0.6942 0.8454 0.3881 0.4128 0.8536 0.8141 0.1975 0.4030 0.4857 0.8272 0.6298 0.5744 0.3350 0.2468 0.8571 0.2579 0.4214 0.7033 0.4294 0.7352 0.7220 0.4328 0.4726 0.8551 0.4891 0.7978 0.8426 0.3574 0.2110 0.6660 0.8405 0.4413 0.8561 0.7570 0.8571 0.8401 0.7999 0.7656 0.6598 0.3468 0.8115 0.4207 0.4074 0.8230 0.4176 0.1008 0.2349 0.8562 0.8568 0.5723 0.4579 0.4856 0.1966 0.8571 0.7602 0.7113 0.7506 0.8568 0.5441 0.1977 0.2675 0.5419 0.2966 0.4131 0.3890 0.2718 0.4087 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 6 6 6 6 6 6 6 6 6 8 6 6 6 6 6 6 7 6 1 6 1 6 1 6 6 6 6 6 6 6 6 6 8 7 8 8 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 1.00783 12.00000 1.00783 12.00000 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 14.00307 15.99491 15.99491 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 13495.7338 25199.2660 35319.5788 0.99986 -0.01667 0.00139 0.01666 0.99983 0.00791 -0.00152 -0.00789 0.99997 1 0.00642 0.00344 0.00245 0.13373 0.07162 0.05110 17.52 23.83 28.63 46.39 57.84 71.59 74.21 104.07 125.24 134.36 154.27 190.29 205.28 213.90 242.89 247.60 278.90 321.11 357.49 377.45 418.93 438.82 460.24 530.17 530.53 548.83 564.21 573.63 577.16 615.72 634.92 655.49 690.53 753.86 774.07 811.32 836.95 856.89 861.88 884.20 907.80 930.94 956.07 980.66 997.87 1008.76 1048.85 1073.32 1091.59 1123.17 1168.60 1175.27 1178.84 1195.49 1207.80 1211.83 1235.52 1241.91 1270.60 1278.28 1286.57 1298.26 1330.65 1367.09 1367.98 1373.13 1378.66 1399.80 1440.32 1442.78 1472.96 1484.81 1499.54 1543.28 1546.09 1562.87 1567.98 1568.61 1580.20 1594.69 1597.93 1617.44 1619.67 1627.97 1630.76 1658.57 1688.39 1695.43 1704.61 1715.66 1744.01 1756.29 1766.98 1785.37 1791.09 1791.87 1811.91 1830.66 1873.42 1879.57 1900.34 1901.94 1905.69 1919.55 1946.46 1949.91 1967.94 1991.16 1996.35 2025.57 2040.10 2053.62 2054.55 2060.62 2082.29 2082.52 2103.08 2120.13 2141.80 2153.44 2178.95 2189.03 2194.61 2221.71 2277.74 2319.86 2329.02 2332.68 2337.90 2357.94 2371.33 2375.47 2377.47 2401.14 2405.46 2407.61 2417.04 2547.83 2569.09 2582.89 2598.34 2607.67 2620.62 2663.62 2673.16 4560.20 4583.58 4599.57 4605.17 4610.27 4637.37 4648.28 4658.08 4690.65 4698.30 4709.79 4814.65 4816.91 4826.84 4838.11 4851.95 4853.58 4860.96 4873.17 4890.28 4894.72 4902.63 4926.39 4946.75 5462.55 5579.67 0.519933 0.545696 0.546640 0.459157 -1445.287933 -1445.262170 -1445.261226 -1445.348709 2.934194D-04 MUNgauss RevisionA2.0 retrievium 05-Dec-2020 DUDE c1ccc(cc1)CCCOc2cccc3c2N[C@H]([C@H]4[C@@H]3C=CC4)c5cc(ccc5O)[N+](=O)[O-] C14476121 RHF 6-31G(d) (6D,10F) C1 442.189258 |X|Y|Z| 113.140554 80.012555 32.930417 66.802271 29 6 7 8 27 1 1 |36.858105| |13.752476|36.858105| |7.933387|13.751258|36.858105| |6.814814|7.889523|13.703886|36.858105| |7.933220|6.895007|7.977623|13.703521|36.858105| |13.752057|7.960986|6.895233|7.889707|13.751701|36.858105| |4.420667|5.007438|7.541362|12.581188|7.541543|5.007578|36.858105| |3.748166|4.160238|5.659105|7.510057|5.664120|4.162268|12.411042|36.858105| |2.905887|3.175537|4.048184|4.903971|4.049086|3.175994|7.522343|12.544798|36.858105| |2.587720|2.788895|3.384675|3.887742|3.387738|2.790621|5.091592|8.060353|13.543984|73.516695| |2.189541|2.339172|2.758492|3.084424|2.760228|2.340239|3.878659|5.213470|7.958513|25.013075|36.858105| |2.024661|2.161363|2.541034|2.832586|2.540898|2.161287|3.590090|4.387081|6.673713|13.979522|13.841124|36.858105| |1.764148|1.868815|2.146379|2.346202|2.146049|1.868603|2.845298|3.327855|4.485798|9.229871|7.957728|13.663200|36.858105| |1.661874|1.751194|1.981321|2.140702|1.981336|1.751209|2.519409|2.976417|3.783882|8.230414|6.890363|7.939749|13.879639|36.858105| |1.748712|1.841016|2.077922|2.241119|2.078273|1.841263|2.609171|3.194312|3.967423|9.406032|7.895317|6.828270|7.909682|13.624164|36.858105| |1.998635|2.115345|2.425267|2.648516|2.426999|2.116499|3.141409|4.084425|5.237703|14.576508|13.558892|7.900364|6.875245|7.955713|13.812064|36.858105| |2.091739|2.202270|2.492632|2.698100|2.499900|2.207287|3.086628|4.091480|4.705545|12.796922|7.871743|5.170703|4.558074|5.151970|7.839672|13.516924|53.358707| |1.880847|1.978472|2.190071|2.306627|2.154321|1.951940|2.553345|3.208698|3.524995|8.436697|5.175731|3.957114|3.788808|4.510570|6.698901|7.814591|17.744329|36.858105| |1.844832|1.965681|2.180801|2.259227|2.079525|1.890399|2.502711|3.106935|3.425549|7.991005|4.932488|3.896354|3.768876|4.455660|6.294089|6.960205|12.325411|17.499660|0.500000| |1.660652|1.727714|1.894614|2.004635|1.900482|1.732168|2.214863|2.685119|2.992809|6.819545|4.436544|3.685156|3.810664|4.897141|7.347008|6.588316|10.604626|12.351144|0.246931|36.858105| |1.659080|1.706347|1.860674|1.987244|1.912196|1.745905|2.181239|2.633978|2.897923|6.519276|4.131099|3.452592|3.527218|4.384081|6.154297|5.810793|9.550587|8.889657|0.174925|17.590820|0.500000| |1.599946|1.672166|1.851215|1.969142|1.852450|1.673079|2.220625|2.660723|3.101042|7.001291|5.001423|4.424527|5.021064|7.536864|12.567758|7.571970|8.990879|7.475991|0.189579|12.268655|0.242388|36.858105| |1.515283|1.569860|1.727586|1.847560|1.758791|1.593214|2.073888|2.442750|2.828627|6.183312|4.334271|4.026201|4.702707|6.924693|9.027944|5.940285|7.128333|5.571863|0.138472|8.824971|0.226613|17.485081|0.500000| |1.482411|1.559515|1.715294|1.792441|1.676758|1.530326|1.999740|2.342719|2.683507|5.801661|3.974861|3.703853|4.266608|5.983742|7.440720|5.292472|6.551414|5.837152|0.175002|7.948515|0.161187|12.548522|0.248855|36.858105| |1.438250|1.509337|1.642031|1.699839|1.599079|1.475708|1.862816|2.171184|2.410037|5.148176|3.340139|3.047780|3.337744|4.284300|5.270573|4.320670|5.933588|5.819030|0.177186|7.952835|0.161236|8.104566|0.182292|14.461500|36.858105| |1.503642|1.565359|1.694397|1.763096|1.675188|1.550142|1.914721|2.257848|2.459976|5.333896|3.361017|2.945552|3.099781|3.870558|5.032420|4.456011|6.785934|7.449275|0.196440|12.318636|0.241812|7.796889|0.181704|8.127434|12.622831|36.858105| |1.934206|2.016173|2.189296|2.282386|2.164318|1.996569|2.441599|3.032279|3.122632|7.076422|3.960498|3.136464|2.954705|3.338554|4.414002|5.104627|10.701283|12.527282|0.248541|7.466192|0.193960|4.864974|0.113977|4.175519|4.500425|6.061000|36.858105| |1.869708|1.962429|2.102337|2.138455|2.019289|1.894230|2.243752|2.714191|2.734134|5.913749|3.269210|2.693519|2.558827|2.845246|3.566905|3.961837|7.248516|7.561683|0.205427|5.423082|0.136774|3.927102|0.093509|3.709600|4.193082|5.329403|13.777596|36.858105| |1.851549|1.922401|2.017558|2.035149|1.951240|1.864650|2.082790|2.464355|2.411883|5.028138|2.722754|2.296841|2.179401|2.376918|2.868546|3.152921|5.490751|5.016588|0.133728|4.069337|0.109474|3.115031|0.077388|2.962216|3.323933|4.109799|7.923857|13.764307|36.858105| |1.895010|1.932113|2.009015|2.050032|2.005563|1.929027|2.074912|2.444714|2.358014|4.868078|2.602789|2.200073|2.076667|2.245583|2.686768|2.971227|5.167432|4.402318|0.110681|3.736249|0.106796|2.887447|0.073723|2.660439|2.913946|3.625182|6.785684|7.896047|13.755967|36.858105| |1.968128|1.988970|2.090001|2.181434|2.153431|2.043514|2.233041|2.676001|2.597673|5.465616|2.914586|2.422089|2.270521|2.462673|2.994536|3.371588|6.075330|4.970624|0.116134|4.233412|0.127971|3.198737|0.082409|2.811711|3.004571|3.821901|7.838164|6.887597|8.015877|13.846414|36.858105| |1.992669|2.036002|2.188001|2.314562|2.250391|2.086085|2.440300|3.013819|3.023225|6.690591|3.631128|2.909762|2.716051|3.002881|3.830528|4.444130|8.854961|7.457673|0.154907|5.856326|0.180510|4.110432|0.103062|3.430630|3.603160|4.748873|13.560858|7.969919|6.925996|7.925862|13.681257|36.858105| |2.014695|2.035553|2.203924|2.390864|2.355771|2.153626|2.557056|3.176931|3.242938|7.243660|3.963327|3.156624|2.929488|3.224931|4.112333|4.831472|9.336404|6.524333|0.133666|5.742700|0.196721|4.273419|0.111316|3.366928|3.378452|4.317482|7.939183|5.247839|4.664717|5.300649|8.188727|14.271931|73.516695| |1.744116|1.819547|1.886319|1.868757|1.787138|1.729867|1.891323|2.184313|2.127115|4.312117|2.341929|2.026730|1.937718|2.093211|2.453426|2.641095|4.350160|3.840405|0.108549|3.269746|0.086727|2.646468|0.066380|2.618561|2.957877|3.454393|5.120913|7.796035|13.154578|7.782385|5.145615|4.537224|6.122126|53.358707| |1.684910|1.777550|1.853162|1.822212|1.722573|1.661118|1.857950|2.136442|2.104489|4.255300|2.337401|2.040430|1.963877|2.125372|2.475087|2.632767|4.238115|3.783583|0.112760|3.226887|0.083018|2.671096|0.066281|2.728814|3.115294|3.500283|4.679580|7.085358|8.394028|5.419221|4.101133|3.911449|5.470853|21.675637|73.516695| |1.699583|1.756125|1.794410|1.771749|1.713736|1.680136|1.768773|2.011580|1.937105|3.856915|2.082496|1.823747|1.743976|1.866720|2.152661|2.307501|3.730381|3.166149|0.087899|2.784724|0.075592|2.303884|0.058870|2.268472|2.529790|2.919730|4.079691|5.426973|8.402036|7.075580|4.685123|3.906390|5.486224|21.693812|16.018652|73.516695| |17.716503|8.905200|5.641494|4.921656|5.641413|8.904909|3.537895|3.112487|2.504171|4.048475|1.961554|1.821695|1.608455|1.526889|1.605951|1.815730|2.594815|1.739048|0.047428|1.546867|0.043006|1.485352|0.039209|1.384209|1.351090|1.413870|1.802392|1.758091|1.760652|1.808869|1.862768|1.861889|3.327843|2.279259|2.870870|2.928999|0.500000| |8.912385|17.711719|8.925320|5.628217|4.963003|5.653113|4.088399|3.548674|2.825704|4.502141|2.161742|2.007145|1.755871|1.655301|1.738336|1.978020|2.805250|1.882083|0.052423|1.646468|0.044945|1.591937|0.041452|1.500915|1.460562|1.508429|1.924501|1.901333|1.872886|1.867170|1.894267|1.925694|3.380687|2.447955|3.143360|3.097510|0.214581|0.500000| |5.647888|8.933617|17.692238|8.910955|5.658778|4.961606|6.998458|5.547934|4.158567|6.171421|2.848316|2.638860|2.225415|2.046108|2.137759|2.491384|3.451663|2.239954|0.062907|1.927323|0.051985|1.895711|0.048791|1.773577|1.694046|1.730698|2.214004|2.143687|2.036604|1.994553|2.055703|2.168971|3.843528|2.609450|3.389057|3.217639|0.124186|0.216038|0.500000| |5.647752|4.961497|5.658827|8.910955|17.692361|8.933510|6.998886|5.556599|4.160423|6.182087|2.851790|2.638631|2.224790|2.046169|2.138479|2.494790|3.470400|2.173165|0.057620|1.938424|0.054675|1.898111|0.050456|1.699832|1.612754|1.694729|2.168599|1.994084|1.919588|1.988578|2.167176|2.281119|4.335956|2.372041|2.975754|2.968525|0.124183|0.107661|0.124206|0.500000| |8.912294|5.653133|4.963105|5.628279|8.925532|17.711526|4.088495|3.550876|2.826250|4.506189|2.163224|2.007022|1.755546|1.655312|1.738694|1.979685|2.815213|1.841879|0.049242|1.653339|0.046650|1.593329|0.042458|1.455383|1.407451|1.484395|1.894389|1.794527|1.780590|1.862202|1.980379|2.002860|3.701344|2.248654|2.805091|2.873248|0.214576|0.124157|0.107663|0.216035|0.500000| |3.978594|4.218962|5.677383|8.915295|7.145966|4.729106|17.529420|8.839320|6.912205|8.389139|3.752614|3.594804|2.863575|2.505072|2.551800|3.024294|3.969120|2.409129|0.064945|2.137071|0.059032|2.166323|0.056955|1.937706|1.794740|1.843336|2.288519|2.084697|1.939183|1.948149|2.115165|2.313335|4.391376|2.392578|3.061417|2.934734|0.090554|0.097190|0.143952|0.214171|0.112227|0.500000| |3.978679|4.730104|7.149492|8.915556|5.675784|4.218413|17.529092|8.838145|6.914963|8.385010|3.751491|3.596338|2.864906|2.505828|2.552355|3.023414|3.959966|2.446762|0.067878|2.131886|0.057617|2.165703|0.055972|1.981722|1.839525|1.862673|2.311177|2.151483|1.986899|1.951332|2.071717|2.264572|4.162093|2.485034|3.226734|3.027300|0.090555|0.112257|0.214381|0.143891|0.097173|0.303839|0.500000| |3.804767|4.413769|6.025008|6.869958|5.067559|3.992113|8.817764|17.550476|8.925788|13.086706|4.905564|4.034987|3.146077|2.884535|3.154666|4.042411|5.731279|3.381281|0.092827|2.744655|0.073696|2.672023|0.067118|2.390618|2.242289|2.333026|3.246494|2.966915|2.685754|2.621372|2.816295|3.154206|5.694073|3.254604|4.179681|3.886451|0.088288|0.106970|0.174302|0.129909|0.093763|0.173380|0.211142|0.500000| |3.802317|3.987050|5.058945|6.863923|6.028561|4.414086|8.814513|17.554179|8.928730|13.113159|4.911217|4.035210|3.145801|2.884560|3.154846|4.046363|5.760981|3.284517|0.085726|2.756366|0.076749|2.673967|0.068855|2.314972|2.162898|2.295698|3.184703|2.798552|2.570976|2.613391|2.928375|3.290363|6.329484|3.054283|3.837220|3.695558|0.088239|0.093639|0.129639|0.174681|0.107019|0.211186|0.173342|0.303424|0.500000| |2.759405|2.931899|3.647184|4.543432|3.964297|3.089587|6.843273|8.831039|17.540348|16.548620|7.089589|6.767485|4.588258|3.758051|3.797485|4.778647|5.694825|3.185839|0.084656|2.821199|0.077291|2.972589|0.077307|2.549005|2.275646|2.322059|2.829628|2.466503|2.200855|2.181088|2.422991|2.800426|5.480692|2.647945|3.405971|3.177892|0.066460|0.072191|0.101207|0.118738|0.077809|0.206416|0.170614|0.173912|0.212612|0.500000| |2.759392|3.089795|3.964257|4.541803|3.645925|2.931478|6.835045|8.829265|17.536968|16.537999|7.086767|6.774675|4.592932|3.761474|3.801534|4.779382|5.673798|3.278394|0.091641|2.811245|0.074217|2.972740|0.074915|2.654224|2.371380|2.362983|2.875856|2.582673|2.273839|2.187226|2.359513|2.716702|5.053660|2.778208|3.643138|3.299729|0.066462|0.077822|0.118748|0.101156|0.072179|0.170235|0.206219|0.212755|0.173928|0.300904|0.500000| |2.112757|2.265279|2.699511|3.045343|2.698522|2.264705|3.994823|4.664873|7.401367|12.496050|8.924141|17.763467|8.908464|5.659709|4.932372|5.619968|5.695626|3.307381|0.091076|3.066701|0.081023|3.542288|0.091544|3.081430|2.611916|2.532940|2.745424|2.409093|2.096597|2.021870|2.208890|2.590132|4.970280|2.549688|3.350601|3.025971|0.052476|0.058125|0.078106|0.078052|0.058102|0.113594|0.113689|0.115225|0.115196|0.225691|0.226005|0.500000| |1.666428|1.762257|2.013651|2.192023|2.013124|1.761910|2.640470|2.969665|3.887488|7.441320|5.663251|8.911645|17.722861|8.950011|5.629028|4.953605|4.935000|3.134908|0.087340|3.193297|0.083200|4.092233|0.110511|3.679439|2.945104|2.707951|2.535877|2.243354|1.943959|1.859213|2.014259|2.357801|4.494476|2.385714|3.165558|2.828851|0.042358|0.046147|0.058036|0.058008|0.046132|0.074743|0.074780|0.077693|0.077684|0.113163|0.113245|0.215826|0.500000| |1.519340|1.594499|1.784048|1.911735|1.784295|1.594678|2.212039|2.549260|3.127076|6.524832|4.960030|5.644420|8.962891|17.704255|8.896836|5.659244|5.678637|3.916644|0.108555|4.492383|0.112647|7.019609|0.198423|6.245226|4.372747|3.787140|2.998046|2.610973|2.209255|2.087584|2.266889|2.712642|5.130182|2.681421|3.570365|3.140325|0.039046|0.042105|0.051112|0.051126|0.042113|0.061342|0.061349|0.068966|0.068981|0.086998|0.087031|0.124400|0.215683|0.500000| |2.325869|2.474252|2.834563|3.064575|2.793017|2.446418|3.511741|4.891154|5.405311|15.335757|7.658663|4.948493|4.128625|4.358348|5.900329|9.568093|25.928736|9.279385|0.215929|5.709513|0.146561|4.977930|0.114431|3.992841|3.715295|4.150710|7.365945|5.368360|4.152102|3.900262|4.507949|6.259004|11.120086|4.497652|5.706676|5.040768|0.058363|0.064012|0.080319|0.078176|0.062909|0.089715|0.091078|0.145626|0.140273|0.126139|0.130222|0.116225|0.093336|0.099515|0.500000| |1.433620|1.513737|1.668598|1.738868|1.619115|1.476428|1.949470|2.251811|2.604705|5.492541|3.795094|3.732036|4.494351|6.272233|6.612308|4.723076|5.565115|4.595106|0.140448|5.566833|0.123484|8.342895|0.193415|17.724259|8.940015|5.629962|3.455214|3.154468|2.586775|2.336324|2.446392|2.912454|5.125182|3.185242|4.371681|3.645922|0.037185|0.040566|0.048184|0.045537|0.038947|0.052633|0.054256|0.063591|0.061033|0.069104|0.072976|0.087027|0.110840|0.197459|0.097785|0.500000| |1.358114|1.427310|1.543338|1.583448|1.489588|1.384388|1.721134|1.977607|2.169792|4.526316|2.876936|2.676806|2.918995|3.600555|4.158232|3.542311|4.863211|4.574150|0.142524|5.566291|0.123468|5.620104|0.136232|8.951857|17.718641|8.361162|3.825694|3.783530|3.102206|2.696086|2.705319|3.122655|5.147557|3.907724|5.495934|4.392806|0.035599|0.038608|0.044360|0.041541|0.036705|0.045998|0.047502|0.056988|0.054451|0.056931|0.059920|0.065054|0.073330|0.103748|0.087950|0.206291|0.500000| |1.526501|1.591850|1.712299|1.764753|1.675997|1.562495|1.893669|2.230850|2.378397|5.113267|3.109864|2.700130|2.766223|3.315063|4.204083|3.990010|6.376382|7.230374|0.200322|8.631105|0.189871|5.675774|0.134196|5.978075|8.756032|17.573879|6.916938|6.806145|5.072599|4.221527|4.238265|5.106430|7.622779|5.756081|7.678208|6.144213|0.039999|0.042814|0.048628|0.046757|0.041519|0.050214|0.051152|0.064949|0.063065|0.061706|0.063533|0.065533|0.067673|0.088892|0.113619|0.126857|0.202118|0.500000| |1.416566|1.462945|1.572455|1.640311|1.574719|1.464770|1.769708|2.059886|2.228353|4.736968|2.959684|2.649876|2.811003|3.467461|4.290000|3.785220|5.645196|5.553211|0.141632|8.718627|0.223361|6.385783|0.172257|6.420319|8.865318|17.510391|4.978021|4.437992|3.693062|3.403189|3.618332|4.314603|7.218276|4.293258|5.575186|4.881019|0.037165|0.039151|0.044341|0.044460|0.039231|0.047720|0.047677|0.058536|0.058625|0.059298|0.059250|0.064107|0.069438|0.096699|0.097690|0.133807|0.193396|0.304547|0.500000| |1.801200|1.911444|2.055094|2.068443|1.930017|1.809374|2.182986|2.615887|2.669814|5.724447|3.220562|2.695628|2.587929|2.886875|3.578025|3.879666|6.691102|7.008066|0.227292|5.164010|0.123070|3.944178|0.092217|3.954171|4.566731|5.410547|8.926808|17.772761|8.974254|5.647622|4.964360|5.651028|7.489851|9.849093|14.273287|8.868665|0.047058|0.051847|0.058982|0.052654|0.047388|0.056147|0.059029|0.080017|0.073239|0.066526|0.071590|0.066951|0.063241|0.074048|0.137388|0.094201|0.117510|0.196301|0.120967|0.500000| |1.842311|1.863424|1.908895|1.934061|1.910415|1.864832|1.929102|2.228205|2.126870|4.288699|2.286728|1.967662|1.862564|1.994875|2.335538|2.553062|4.277862|3.529035|0.090799|3.107148|0.089100|2.491851|0.064581|2.327366|2.539153|3.070547|4.911855|5.637065|8.927513|17.785159|8.920168|5.635299|7.593297|9.759038|8.811632|14.113185|0.049360|0.050302|0.052394|0.052468|0.050366|0.050456|0.050451|0.066118|0.066122|0.055053|0.055083|0.050798|0.046822|0.051934|0.089962|0.057619|0.066379|0.097712|0.081824|0.124539|0.500000| |1.969761|1.959235|2.040199|2.146844|2.160229|2.065025|2.175529|2.570436|2.470491|5.089210|2.699116|2.276012|2.132689|2.288055|2.725460|3.046265|5.273525|4.073728|0.096298|3.649650|0.113205|2.874212|0.075901|2.515584|2.648162|3.289702|5.619910|4.962751|5.667899|8.909435|17.750575|8.970811|13.432956|5.658986|6.041296|7.135778|0.052035|0.051582|0.055084|0.060910|0.056272|0.057822|0.055611|0.073900|0.079339|0.065019|0.061938|0.058253|0.053000|0.058792|0.108542|0.061585|0.066675|0.098133|0.089004|0.107768|0.213074|0.500000| |2.056071|2.096048|2.307233|2.528139|2.456973|2.206651|2.774578|3.534078|3.741292|8.807920|4.918898|3.749271|3.429747|3.801197|5.051659|6.301010|13.179069|7.763594|0.151357|6.573147|0.220739|5.010339|0.127654|3.742773|3.616962|4.509624|7.791678|5.014962|4.213176|4.461690|6.112045|10.105191|35.323810|4.358496|5.243053|5.044261|0.052599|0.054157|0.063249|0.070954|0.058763|0.074556|0.070591|0.097913|0.109451|0.098465|0.089838|0.090077|0.080331|0.091901|0.224493|0.088670|0.084488|0.119943|0.114424|0.116705|0.101561|0.154149|0.500000| 1444.146678 -9697.083881 3843.915768 -195.960081 -4604.981516 3159.173597 -1445.807919 2.001150 40B3AFFFFFFFFFE0 44D506266B6AE40A 4457002A081D6B42 4290F87446C00001 37F769532C1A7AC1 4492E30A32591E8D