NCI:228081 BBtclserve11129918252D 0 0.00000 0.00000147267 61785-57-7 16 18 0 0 0 0 0 0 0 0 2 V2000 4.9921 1.5771 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.6831 0.6260 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7321 0.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2709 -0.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6831 -0.9920 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.8170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.1830 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0000 -2.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.6830 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 4 7 1 0 0 0 0 5 8 2 0 0 0 0 5 9 1 0 0 0 0 6 10 1 0 0 0 0 8 11 1 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 10 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 6 7 2 0 0 0 0 10 11 2 0 0 0 0 12 13 1 0 0 0 0 M CHG 4 1 -1 2 1 14 1 16 -1 M END