LB4UE3 -OEChem-05032301062D 54 55 0 1 0 0 0 0 0999 V2000 3.4446 1.2863 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9088 1.2863 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6408 1.2863 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7748 2.7863 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1767 1.2863 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5405 -0.2106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2986 -3.2830 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3107 2.7863 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1767 2.2863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4446 2.2863 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0427 2.7863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3107 3.7863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9088 1.2863 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9088 2.2863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7748 0.7863 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5786 2.7863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7748 -0.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3107 0.7863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3107 -0.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9088 -0.7137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1767 -0.7137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0427 -0.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4007 -0.7206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1928 -1.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2947 -2.2830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3926 -1.7622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4345 -3.7863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7737 3.0963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7782 1.8114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5752 1.8114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9077 1.9763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4412 3.2612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6442 3.2612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9307 3.7863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3107 4.4063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6907 3.7863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7483 0.6874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7748 1.4063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8886 3.3232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0417 3.0963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2686 2.2494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9868 -0.7963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3854 -0.1060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9088 -1.3337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5988 1.8233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7327 0.3232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1777 0.9763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7332 -2.0590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8545 -2.0701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8367 -3.5909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1224 -3.2506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8988 -4.0984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7466 -4.3220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 18 1 0 0 0 0 13 2 1 6 0 0 0 2 45 1 0 0 0 0 15 3 1 1 0 0 0 3 47 1 0 0 0 0 4 14 2 0 0 0 0 5 18 2 0 0 0 0 6 23 1 0 0 0 0 6 51 1 0 0 0 0 7 25 1 0 0 0 0 7 27 1 0 0 0 0 7 50 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 6 0 0 0 8 28 1 0 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 16 1 1 0 0 0 10 31 1 0 0 0 0 11 14 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 37 1 0 0 0 0 15 17 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 20 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 19 21 2 0 0 0 0 19 23 1 0 0 0 0 20 22 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 46 1 0 0 0 0 23 26 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 26 49 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 M END $$$$