NCI:628307 BBtclserve11129919432D 0 0.00000 0.00000215510 999-99-9 33 36 0 0 0 0 0 0 0 0 2 V2000 4.5981 2.5728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 1.0728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 2.0728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.5728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.0728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.0728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.5728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.0728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.0728 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.5728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.5728 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.5728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5728 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.4272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.9272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5506 -0.5204 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.3596 -1.9217 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3814 -2.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8814 -1.2636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -0.9272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5350 -1.8680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5191 -2.0452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1645 -1.2814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8258 -0.3405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8416 -0.1634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8895 -2.6319 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.9053 -2.4547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2283 -3.5728 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 10.1487 -1.4585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4875 -2.3993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4713 0.4233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4555 0.2462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 2 4 2 0 0 0 0 4 5 1 0 0 0 0 1 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 5 10 1 0 0 0 0 3 11 1 0 0 0 0 11 12 1 0 0 0 0 2 13 1 0 0 0 0 13 14 1 0 0 0 0 10 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 17 20 1 0 0 0 0 15 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 21 26 2 0 0 0 0 22 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 24 30 1 0 0 0 0 30 31 1 0 0 0 0 25 32 1 0 0 0 0 32 33 1 0 0 0 0 2 3 1 0 0 0 0 5 6 2 0 0 0 0 9 10 2 0 0 0 0 19 20 1 0 0 0 0 25 26 1 0 0 0 0 M CHG 2 27 1 29 -1 M END