NCI:152057 BBtclserve11129917532D 0 0.00000 0.00000113199 38597-53-4 25 26 0 0 0 0 0 0 0 0 2 V2000 4.7700 0.6942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0028 1.3356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7091 1.0378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1748 2.3207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8810 2.0229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4763 0.3964 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.7909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.7909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4076 2.9622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1139 2.6644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.2909 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.7909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4685 2.6185 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.5795 3.9473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2858 3.6495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.7091 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5981 -2.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5186 4.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.2909 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 -3.2909 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -3.2909 0.0000 F 0 0 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 2 0 0 0 0 3 7 1 0 0 0 0 4 8 2 0 0 0 0 4 9 1 0 0 0 0 5 10 2 0 0 0 0 5 11 1 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 9 14 2 0 0 0 0 10 15 1 0 0 0 0 10 16 1 0 0 0 0 11 17 2 0 0 0 0 12 18 2 0 0 0 0 12 19 1 0 0 0 0 13 20 2 0 0 0 0 16 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 14 20 1 0 0 0 0 17 21 1 0 0 0 0 M CHG 2 12 1 19 -1 M END