NCI:170144 BBtclserve11129918042D 0 0.00000 0.00000125584 20379-57-1 21 21 0 0 0 0 0 0 0 0 2 V2000 5.4641 1.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.8170 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8301 0.9510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8301 2.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.3170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.1830 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.1830 0.0000 N 0 3 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 -1.0490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 0.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.6830 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 2 0 0 0 0 2 6 2 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 9 13 1 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 11 16 2 0 0 0 0 13 17 1 0 0 0 0 13 18 2 0 0 0 0 13 19 2 0 0 0 0 14 20 1 0 0 0 0 16 21 2 0 0 0 0 12 15 1 0 0 0 0 M CHG 2 16 1 21 -1 M END