NCI:659513 BBtclserve11129920082D 0 0.00000 0.00000230804 999-99-9 31 33 0 0 0 0 0 0 0 0 2 V2000 2.0000 4.6577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7431 3.9886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5352 3.0104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 4.2976 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4373 3.6285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2294 2.6503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9726 1.9812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9236 2.2902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1315 3.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3884 3.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6668 1.6211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6178 1.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9268 2.8811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3391 3.6901 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9268 2.8811 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2359 1.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1869 1.6210 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.4268 1.3423 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4268 0.3423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5608 -0.1577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8288 0.8423 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5608 -1.1577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6948 -1.6577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6948 -2.6577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5608 -3.1577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4268 -2.6577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4268 -1.6577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5608 -4.1577 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.6948 -4.6577 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4268 -4.6577 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.6948 0.3423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 5 10 2 0 0 0 0 8 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 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 12 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 22 27 2 0 0 0 0 25 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 20 31 1 0 0 0 0 9 10 1 0 0 0 0 16 18 1 0 0 0 0 26 27 1 0 0 0 0 21 31 3 0 0 0 0 M CHG 2 28 1 30 -1 M END