NCI:111719 BBtclserve11129917302D 0 0.00000 0.00000 85537 6580-77-4 21 22 0 0 0 0 0 0 0 0 1 V2000 3.8660 3.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 2.4150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.2811 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3660 2.4151 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 1.5490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 1.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8660 1.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3660 0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3660 0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8660 -0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8660 -0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3660 -1.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3660 -1.0490 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8660 -1.9150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8660 -1.9150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3661 -2.7811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3661 -2.7811 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3661 -3.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2321 -3.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 2 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 4 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 6 7 1 0 0 0 0 20 21 1 0 0 0 0 M END