NCI:98958 BBtclserve11129917242D 0 0.00000 0.00000 77663 67992-16-9 26 27 0 0 0 0 0 0 0 0 2 V2000 3.7321 -0.9664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.4664 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.0336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.4664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.9664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.9664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.4664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.4664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2026 1.0847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.9664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2692 -1.1228 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.3301 -2.4664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5571 1.8485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1868 1.2618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4412 -0.1377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0364 -1.7642 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5729 1.6714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8958 2.7894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0528 0.7618 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.5255 2.2026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9275 2.4352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2342 0.7305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8800 2.9664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0528 -0.2382 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9187 1.2617 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.9433 2.2581 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 2 0 0 0 0 4 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 7 10 2 0 0 0 0 8 11 1 0 0 0 0 8 12 2 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 13 17 1 0 0 0 0 13 18 1 0 0 0 0 14 19 1 0 0 0 0 14 20 2 0 0 0 0 17 21 1 0 0 0 0 17 22 2 0 0 0 0 18 23 2 0 0 0 0 19 24 2 0 0 0 0 19 25 1 0 0 0 0 21 26 1 0 0 0 0 10 12 1 0 0 0 0 20 23 1 0 0 0 0 M CHG 4 11 1 16 -1 19 1 25 -1 M END