RDKit 3D 86 90 0 0 0 0 0 0 0 0999 V2000 6.6097 -0.2186 0.8204 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0768 0.7043 1.8729 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6594 0.9766 2.9123 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8594 1.1793 1.4948 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2064 2.0970 2.4070 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4309 1.2674 3.4371 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2747 0.4834 2.7987 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2616 1.3701 2.0046 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5039 2.2100 3.0678 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0857 2.2274 0.9752 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1694 3.0135 0.0218 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1453 2.1203 -0.7028 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7731 1.2676 0.2299 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6945 2.2707 0.9828 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1942 0.4698 1.2030 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9268 -0.6658 0.4318 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1015 -1.4621 -0.5093 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1132 -1.1142 -0.9586 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9589 -2.2127 -1.6428 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2855 -1.9600 -3.1479 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9875 -1.8665 -3.9694 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2188 -3.0569 -3.7236 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.6086 -2.7989 -5.1838 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4927 -3.1654 -2.8812 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1647 -3.5117 -1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2003 -2.5184 -0.7482 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7602 -3.2045 0.5752 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9347 -1.2015 -0.4124 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0297 -0.1389 0.2364 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7597 0.2381 -0.5978 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1674 0.9761 -1.9012 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5108 1.0811 -2.9273 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3529 1.6168 -1.8393 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2887 3.0527 1.5767 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8606 4.2504 2.4483 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1390 3.6512 0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9357 -1.0703 0.6992 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7220 0.3211 -0.1233 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5911 -0.5909 1.1277 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9679 2.6987 2.9208 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1040 0.5387 3.9057 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0773 1.9089 4.2486 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7404 -0.2587 2.1432 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7459 -0.0819 3.5766 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0727 2.3606 3.9879 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4108 1.7056 3.3969 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2436 3.2086 2.7169 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5866 1.5048 0.3173 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 3.8281 0.5468 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7674 3.4958 -0.7593 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6886 1.4645 -1.3942 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4627 2.7904 -1.3229 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1874 3.1705 1.3234 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1682 1.8091 1.8547 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4869 2.6515 0.3304 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4389 -0.0287 1.9516 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7911 -0.3034 -0.1297 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3054 -1.3861 1.1671 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5138 -2.4377 -0.7632 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3676 -3.1427 -1.6465 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8239 -1.0144 -3.2516 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 -1.1532 -3.5412 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1878 -1.5280 -4.9903 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4873 -2.8395 -4.0245 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6959 -4.0224 -3.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7442 -2.8792 -5.8495 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3426 -3.5365 -5.5265 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0475 -1.8033 -5.3078 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1421 -3.9500 -3.2892 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0662 -2.2324 -2.9308 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7220 -4.5172 -1.4281 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0992 -3.5872 -0.8672 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2538 -4.1557 0.3731 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0706 -2.5971 1.1674 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6283 -3.4216 1.2086 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7702 -1.4061 0.2699 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3859 -0.7770 -1.3158 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7270 -0.4861 1.2318 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6671 0.7347 0.4143 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4259 2.0407 -2.7203 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1513 4.8992 1.9253 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4149 3.9562 3.3981 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7297 4.8693 2.7043 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0889 4.0477 0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 2.9026 -0.3434 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6229 4.4810 -0.0737 H 0 0 0 0 0 0 0 0 0 0 0 0 28 26 1 0 19 26 1 0 10 11 1 0 11 12 1 0 12 13 1 0 15 13 1 0 34 10 1 0 8 7 1 0 19 20 1 0 26 25 1 0 25 24 1 0 24 22 1 0 22 20 1 0 8 10 1 0 5 4 1 0 34 35 1 1 15 16 1 0 13 14 1 1 13 30 1 0 22 23 1 0 18 17 2 0 34 36 1 0 17 16 1 0 30 31 1 6 18 30 1 0 31 32 2 0 6 5 1 0 31 33 1 0 6 7 1 0 8 9 1 1 5 34 1 0 26 27 1 1 8 15 1 0 4 2 1 0 18 19 1 0 2 1 1 0 30 29 1 0 2 3 2 0 29 28 1 0 20 21 1 0 6 41 1 0 6 42 1 0 5 40 1 1 7 43 1 0 7 44 1 0 10 48 1 6 11 49 1 0 11 50 1 0 12 51 1 0 12 52 1 0 15 56 1 1 17 59 1 0 16 57 1 0 16 58 1 0 29 78 1 0 29 79 1 0 28 76 1 0 28 77 1 0 19 60 1 6 25 71 1 0 25 72 1 0 24 69 1 0 24 70 1 0 22 65 1 6 20 61 1 1 35 81 1 0 35 82 1 0 35 83 1 0 14 53 1 0 14 54 1 0 14 55 1 0 23 66 1 0 23 67 1 0 23 68 1 0 36 84 1 0 36 85 1 0 36 86 1 0 33 80 1 0 9 45 1 0 9 46 1 0 9 47 1 0 27 73 1 0 27 74 1 0 27 75 1 0 1 37 1 0 1 38 1 0 1 39 1 0 21 62 1 0 21 63 1 0 21 64 1 0 M END