NCI:644500 BBtclserve11129920002D 0 0.00000 0.00000223845 999-99-9 22 23 0 0 0 0 0 0 0 0 2 V2000 4.0981 -0.5955 0.0000 Br 0 5 0 0 0 0 0 0 0 0 0 0 3.7321 1.7705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.2705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.7705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.7705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.2705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.7705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.2705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.7705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.7705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.2705 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.0981 -0.5955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0981 -0.5955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5981 -1.4615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5981 -1.4615 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1859 -2.2705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1369 -1.9615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1369 -0.9615 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1859 -0.6525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8768 0.2985 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 8.5460 1.0417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8987 0.5065 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 2 7 1 0 0 0 0 2 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 7 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 15 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 6 7 1 0 0 0 0 10 11 1 0 0 0 0 18 19 2 0 0 0 0 M CHG 4 1 -1 11 1 20 1 22 -1 M END