NCI:55849 BBtclserve11129917072D 0 0.00000 0.00000 46939 6631-09-0 22 24 0 0 0 0 0 0 0 0 2 V2000 4.6261 1.2312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 0.2530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6751 1.5402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3693 1.9003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.9524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 2.4913 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1614 2.8785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3203 1.5913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 1.5402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.0476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 2.4913 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9045 3.5476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0635 2.2604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.5476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8556 3.2386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.5476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.0476 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0000 -3.5476 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -3.5476 0.0000 O 0 5 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 3 5 1 0 0 0 0 3 6 1 0 0 0 0 4 7 2 0 0 0 0 4 8 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 6 11 2 0 0 0 0 7 12 1 0 0 0 0 8 13 2 0 0 0 0 10 14 2 0 0 0 0 10 15 1 0 0 0 0 12 16 2 0 0 0 0 14 17 1 0 0 0 0 15 18 2 0 0 0 0 17 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 9 11 1 0 0 0 0 13 16 1 0 0 0 0 18 19 1 0 0 0 0 M CHG 2 20 1 22 -1 M END