RDKit 3D 46 50 0 0 0 0 0 0 0 0999 V2000 4.8737 -0.0768 0.1249 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4915 -0.7339 0.2463 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8195 -0.3200 1.4969 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6286 0.5364 1.3104 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2046 1.0965 2.3272 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9316 0.7687 0.0519 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4745 2.1073 0.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8944 0.6692 -1.1082 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7558 1.7567 -1.0438 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1155 0.6810 -2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 1.0222 -2.2069 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9831 0.0421 -1.2330 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2247 -1.1351 -1.0836 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2391 -0.1659 -0.0790 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8704 -0.6051 1.1679 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1874 -1.0848 2.1341 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3242 -0.4878 1.2984 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8539 -0.6940 2.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2187 -0.6107 2.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9988 -0.3294 1.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4382 -0.1308 0.3686 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2660 0.1418 -0.6857 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0584 -0.2068 0.1836 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4578 0.0225 -1.1399 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8856 1.3287 -1.5303 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6970 -0.5810 -1.0067 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1796 0.1887 1.1659 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8369 0.8162 -0.5085 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6263 -0.7883 -0.2661 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7262 -1.8368 0.3426 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5437 0.3021 2.1038 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5384 -1.1443 2.1814 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2119 2.2086 0.7733 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6081 2.3129 -0.2269 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 1.3396 -3.1587 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1459 -0.3480 -2.8466 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5609 2.0650 -2.0042 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8242 0.7932 -3.1965 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1997 -0.9109 3.3916 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6749 -0.7640 3.6824 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0686 -0.2708 1.7587 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8965 0.2771 -1.6047 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9459 -0.6896 -1.8519 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4659 1.9185 -0.8265 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0771 -1.4969 -1.2294 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4401 -0.5601 -1.8586 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 1 1 6 8 1 0 8 9 1 6 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 6 14 13 1 6 14 15 1 0 15 16 2 0 15 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 1 0 21 23 2 0 23 24 1 0 24 25 1 0 8 26 1 0 26 2 1 0 14 6 1 0 23 17 1 0 14 12 1 0 24 12 1 0 1 27 1 0 1 28 1 0 1 29 1 0 2 30 1 1 3 31 1 0 3 32 1 0 7 33 1 0 9 34 1 0 10 35 1 0 10 36 1 0 11 37 1 0 11 38 1 0 18 39 1 0 19 40 1 0 20 41 1 0 22 42 1 0 24 43 1 6 25 44 1 0 26 45 1 0 26 46 1 0 M END