RDKit 3D 108114 0 0 0 0 0 0 0 0999 V2000 -0.7279 0.7844 4.1953 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8314 -0.3851 3.2747 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3263 -1.4903 3.6578 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4301 -0.3344 2.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5075 -1.4732 1.2094 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0387 -1.7468 1.4463 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2915 -1.6531 2.8373 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5367 -0.5053 0.7956 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.9938 -0.3147 0.7722 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.4257 -0.2478 2.2646 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8351 -1.3969 0.1929 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5623 -0.7567 -0.9672 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3770 0.7045 -0.6955 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.7188 1.3301 -0.4378 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6205 1.0012 -1.6092 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6306 2.8464 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3355 0.8393 0.7074 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4277 0.8721 0.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7098 -0.2702 -0.4165 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.3275 -0.6458 -1.7285 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2205 1.1533 -0.5390 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4460 1.6404 -1.8578 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8906 1.5189 -0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1902 0.5235 0.0106 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2729 1.3779 0.5114 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5384 0.1114 0.0950 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1785 -0.7867 1.1536 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6318 -0.4287 1.3653 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4619 -0.5597 0.1135 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3868 0.4781 0.0475 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7009 0.0685 0.2574 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1779 0.5725 1.4745 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1568 1.5289 1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4175 0.9739 0.7016 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2087 0.3433 1.6575 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0476 0.0336 -0.4344 C 0 0 2 0 0 0 0 0 0 0 0 0 9.9228 0.1919 -1.5071 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6289 0.3421 -0.8756 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5510 1.6296 -1.3622 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6343 -0.7172 -1.1156 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5323 -0.1796 -2.2577 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5574 -2.1927 -1.4244 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3822 0.0432 -1.1963 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5306 -0.4953 -2.3025 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5643 -1.4367 -1.6003 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3424 -0.4778 -0.8445 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4981 -1.2179 -0.2360 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7630 -2.5327 -0.9332 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3938 0.6519 5.0816 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 1.6734 3.6559 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3143 0.9958 4.4858 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9815 -2.3516 1.5948 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3552 -2.7008 1.1424 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1519 -2.5221 3.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1499 0.3194 1.5065 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5762 -1.2317 2.6942 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6017 0.2495 2.8576 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2989 0.3776 2.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6585 -1.7484 0.8863 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3576 -2.2970 -0.1553 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1758 -1.0736 -1.9569 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6507 -1.0380 -0.9951 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0153 1.1761 -1.6593 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0000 0.7043 -2.4584 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2733 0.1356 -1.3294 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2491 1.8696 -1.9004 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6053 3.2134 -0.0222 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5106 3.2059 -1.4334 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8536 3.2120 0.2948 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3728 1.5050 1.4364 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8033 -1.6100 -1.7976 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4836 -0.6739 -2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9413 0.2011 -2.1625 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0380 1.7245 0.0179 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2335 2.6114 -1.8327 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5656 2.3595 -0.7129 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 2.1103 0.9405 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2048 1.6385 1.6149 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6252 2.3092 -0.0226 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7198 -0.4801 2.1457 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9461 -1.8327 1.0934 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6511 0.6402 1.6637 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0070 -1.0132 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0793 -1.4914 0.2861 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6720 -1.0443 0.4161 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8216 2.4501 0.8092 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4407 1.8524 2.3579 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9810 1.8309 0.2888 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7318 -0.4714 1.9842 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1332 -1.0129 -0.0885 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4903 -0.6071 -1.6304 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4145 -0.3734 -1.6934 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9711 1.6994 -2.2491 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2722 -0.9112 -2.5683 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0131 0.7650 -1.9862 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8555 0.0419 -3.1293 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2762 -2.8389 -0.5983 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0054 -2.4659 -2.3171 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6283 -2.5035 -1.6475 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6579 1.0878 -1.5436 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8805 0.3297 -2.7233 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -0.9102 -3.1551 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0578 -1.9216 -2.4658 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0005 -2.2275 -1.0267 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7785 0.0373 -1.7784 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7406 -2.9267 -0.6704 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9952 -3.2450 -0.5624 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 -2.4863 -2.0361 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 1 0 9 10 1 1 9 11 1 0 11 12 1 0 12 13 1 0 13 18 1 0 13 14 1 0 14 15 1 0 14 16 1 0 14 17 1 0 8 19 1 0 19 20 1 6 19 21 1 0 21 22 1 0 21 23 1 0 24 23 1 6 24 25 1 0 26 25 1 1 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 36 38 1 0 38 39 1 0 29 40 1 0 40 41 1 0 40 42 1 0 40 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 6 47 5 1 0 18 9 1 0 47 19 1 0 26 24 1 0 43 26 1 0 46 24 1 0 38 31 1 0 1 49 1 0 1 50 1 0 1 51 1 0 5 52 1 6 6 53 1 6 7 54 1 0 8 55 1 1 10 56 1 0 10 57 1 0 10 58 1 0 11 59 1 0 11 60 1 0 12 61 1 0 12 62 1 0 13 63 1 6 15 64 1 0 15 65 1 0 15 66 1 0 16 67 1 0 16 68 1 0 16 69 1 0 17 70 1 0 20 71 1 0 20 72 1 0 20 73 1 0 21 74 1 1 22 75 1 0 23 76 1 0 23 77 1 0 25 78 1 0 25 79 1 0 27 80 1 0 27 81 1 0 28 82 1 0 28 83 1 0 29 84 1 1 31 85 1 1 33 86 1 0 33 87 1 0 34 88 1 6 35 89 1 0 36 90 1 1 37 91 1 0 38 92 1 6 39 93 1 0 41 94 1 0 41 95 1 0 41 96 1 0 42 97 1 0 42 98 1 0 42 99 1 0 43100 1 6 44101 1 0 44102 1 0 45103 1 0 45104 1 0 46105 1 6 48106 1 0 48107 1 0 48108 1 0 M END