RDKit 3D 93 97 0 0 0 0 0 0 0 0999 V2000 2.2547 -5.0746 2.0432 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4843 -3.9792 1.6341 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0591 -2.8479 1.0974 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3997 -2.6511 0.9045 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9282 -1.4952 0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3648 -1.4013 0.1802 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0040 -0.3392 -0.2179 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4601 -0.2651 -0.3963 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0186 0.9734 -0.7312 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3754 1.0577 -0.9192 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2116 -0.0293 -0.7916 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5825 0.0833 -0.9873 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6495 -1.2409 -0.4627 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2867 -1.3477 -0.2688 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0784 -0.4955 -0.0053 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6907 -0.6571 0.1747 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9213 0.3934 -0.2272 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4626 0.4705 -0.1303 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0586 0.0448 -1.3615 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3921 -0.1329 -1.0518 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0440 -1.1032 -2.0246 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3851 -1.2397 -1.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0442 -2.1574 -2.5205 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.0678 -1.4503 -3.1414 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1389 -2.1911 -3.5576 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.8276 -3.2129 -4.6282 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8865 -2.7285 -2.3865 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.8813 -1.8067 -2.0309 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0084 -2.8749 -1.1705 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.5184 -3.6911 -0.1851 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5865 -3.2109 -1.5751 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.6294 -4.4178 -2.2548 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0891 1.1857 -0.9596 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.3162 1.0655 -0.2962 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2727 2.2481 -0.3185 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2397 3.3865 -1.1366 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9044 1.8809 0.1326 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7863 2.0830 1.5093 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1567 3.0435 1.8536 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0847 2.4016 2.6642 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9619 3.2526 3.2788 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8631 4.0065 2.3259 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2877 4.1951 4.2309 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7880 3.4887 5.3142 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 4.9626 3.4861 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8343 6.0326 2.8325 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6069 4.1150 2.6025 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2261 4.9313 1.6574 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2074 -1.8083 0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6371 -4.9016 3.0714 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5819 -5.9759 2.0304 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1219 -5.2239 1.3661 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0883 -3.4507 1.1959 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9647 -2.2887 0.3923 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4309 0.5423 -0.4299 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3596 1.8309 -0.8297 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7977 2.0246 -1.1786 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9043 -0.0735 -1.9486 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2563 -2.1253 -0.3519 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8788 -2.3265 -0.0108 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4537 0.4141 -0.4309 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8881 -0.2739 0.5957 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4241 -0.5710 -0.0046 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5840 -2.1100 -1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8980 -0.7241 -3.0614 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3089 -2.5799 -3.2208 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8331 -1.4538 -4.0682 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7301 -3.2830 -4.7295 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2382 -4.2049 -4.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1897 -2.8926 -5.6457 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3943 -3.6915 -2.5789 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0273 -1.7574 -1.0595 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9306 -1.8366 -0.7264 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4893 -3.5420 -0.1235 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9246 -3.3262 -0.7082 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8668 -5.1214 -1.5875 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3128 1.5005 -2.0209 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0586 1.2575 -0.8879 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8409 2.5760 0.6085 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3243 3.5155 -1.5074 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1389 2.5821 -0.3238 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5983 3.4347 0.9258 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6495 2.6159 3.8973 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3654 4.3253 1.4038 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2012 4.9181 2.9012 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8115 3.4482 2.1268 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0494 4.9311 4.5726 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4355 4.1198 5.9943 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4482 5.4037 4.2678 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3693 6.2415 2.0053 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4005 3.5985 3.1965 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6735 4.9310 0.8441 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -1.9292 0.8502 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 11 13 1 0 13 14 2 0 5 15 2 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 25 27 1 0 27 28 1 0 27 29 1 0 29 30 1 0 29 31 1 0 31 32 1 0 20 33 1 0 33 34 1 0 33 35 1 0 35 36 1 0 35 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 41 43 1 0 43 44 1 0 43 45 1 0 45 46 1 0 45 47 1 0 47 48 1 0 16 49 2 0 49 3 1 0 14 8 1 0 37 18 1 0 47 39 1 0 31 23 1 0 1 50 1 0 1 51 1 0 1 52 1 0 4 53 1 0 6 54 1 0 7 55 1 0 9 56 1 0 10 57 1 0 12 58 1 0 13 59 1 0 14 60 1 0 15 61 1 0 18 62 1 1 20 63 1 1 21 64 1 0 21 65 1 0 23 66 1 6 25 67 1 6 26 68 1 0 26 69 1 0 26 70 1 0 27 71 1 6 28 72 1 0 29 73 1 1 30 74 1 0 31 75 1 1 32 76 1 0 33 77 1 6 34 78 1 0 35 79 1 1 36 80 1 0 37 81 1 6 39 82 1 6 41 83 1 1 42 84 1 0 42 85 1 0 42 86 1 0 43 87 1 1 44 88 1 0 45 89 1 1 46 90 1 0 47 91 1 1 48 92 1 0 49 93 1 0 M END