NCI:692426 BBtclserve11129920262D 0 0.00000 0.00000245612 999-99-9 27 29 0 0 0 0 0 0 0 0 2 V2000 4.6831 -3.5597 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2709 -2.7507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6831 -1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.2507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -3.2507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.7507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.7507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1300 -1.7607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9169 -1.1437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7760 -0.1536 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.8482 0.2194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0612 -0.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2022 -1.3877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1490 0.7742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5320 1.5611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5419 1.4202 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9049 2.4890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2879 3.2759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6609 4.2037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2709 -2.7507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0991 -3.7358 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9827 -4.2037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7009 -3.5078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2609 -2.6098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7660 -0.0127 0.0000 Br 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 3 4 1 0 0 0 0 1 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 5 9 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 10 15 2 0 0 0 0 12 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 2 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 22 26 1 0 0 0 0 4 5 2 0 0 0 0 8 9 2 0 0 0 0 14 15 1 0 0 0 0 10 22 1 0 0 0 0 25 26 1 0 0 0 0 M CHG 2 12 1 27 -1 M END