NCI:401648 BBtclserve11129919232D 0 0.00000 0.00000192160 7479-43-8 28 30 0 0 0 0 0 0 0 0 2 V2000 4.3660 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2321 -0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0981 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 0.5000 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2321 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9641 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -2.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2321 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8301 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9641 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -2.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8301 1.0000 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 8.6962 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8301 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6962 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9641 1.5000 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.6962 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5622 -2.0000 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 9.5622 -3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4282 -1.5000 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 2 5 1 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 4 9 2 0 0 0 0 4 10 1 0 0 0 0 5 11 1 0 0 0 0 7 12 1 0 0 0 0 8 13 1 0 0 0 0 9 14 1 0 0 0 0 10 15 2 0 0 0 0 11 16 2 0 0 0 0 11 17 1 0 0 0 0 12 18 1 0 0 0 0 14 19 2 0 0 0 0 16 20 1 0 0 0 0 16 21 1 0 0 0 0 17 22 2 0 0 0 0 20 23 2 0 0 0 0 20 24 1 0 0 0 0 21 25 2 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 13 18 1 0 0 0 0 15 19 1 0 0 0 0 22 25 1 0 0 0 0 M CHG 4 20 1 24 -1 26 1 28 -1 M END