NCI:111853 BBtclserve11129917302D 0 0.00000 0.00000 85558 20096-30-4 22 24 0 0 0 0 0 0 0 0 2 V2000 4.9921 0.2295 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9703 0.4374 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6831 -0.7215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2793 1.3885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2709 -1.5305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6101 2.1316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2574 1.5964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2709 -1.5305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6831 -2.3396 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6320 1.9237 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.9192 3.0827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5664 2.5475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9921 -3.2906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9629 2.6669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 0.9727 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.8973 3.2906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0306 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 2 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 2 0 0 0 0 5 10 1 0 0 0 0 6 11 2 0 0 0 0 6 12 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 8 15 2 0 0 0 0 9 16 1 0 0 0 0 10 17 2 0 0 0 0 12 18 1 0 0 0 0 13 19 2 0 0 0 0 13 20 1 0 0 0 0 14 21 2 0 0 0 0 16 22 2 0 0 0 0 9 12 1 0 0 0 0 15 21 1 0 0 0 0 17 22 1 0 0 0 0 M CHG 2 13 1 20 -1 M END