NCI:243887 BBtclserve11129918322D 0 0.00000 0.00000151517 54313-59-6 27 28 0 0 0 0 0 0 0 0 2 V2000 5.8738 1.8530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7997 2.2309 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0836 2.4659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7381 0.8623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9354 3.2216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7763 1.1362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.0995 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7374 0.8989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8613 3.5995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3696 2.0498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1886 0.3272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2941 -0.6572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0811 -0.0402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3751 2.1543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.0995 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.5995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3308 -1.6565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9683 3.0679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.0995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.0995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5994 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7320 -3.0995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.0995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0994 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5994 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5981 -3.5995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 2 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 5 9 1 0 0 0 0 6 10 1 0 0 0 0 6 11 2 0 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 8 14 1 0 0 0 0 10 15 1 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 13 18 1 0 0 0 0 15 19 1 0 0 0 0 17 20 2 0 0 0 0 17 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 21 24 2 0 0 0 0 22 25 2 0 0 0 0 22 26 1 0 0 0 0 23 27 2 0 0 0 0 13 14 1 0 0 0 0 24 27 1 0 0 0 0 M CHG 2 22 1 26 -1 M END