NCI:158262 BBtclserve11129917562D 0 0.00000 0.00000116995 21846-27-5 20 22 0 0 0 0 0 0 0 0 2 V2000 4.9563 2.1268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8223 2.6268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0903 2.6268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9563 1.1268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9073 1.4358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2653 0.1757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9563 1.1268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4563 -0.4121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1789 -0.2310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6473 0.1757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2872 1.8699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5608 -1.4066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2834 -1.2255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 -0.0322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 1.6620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4744 -1.8133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1969 -1.6323 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0000 0.7109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3015 -2.6268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0060 -1.0445 0.0000 O 0 5 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 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 8 12 1 0 0 0 0 9 13 2 0 0 0 0 10 14 1 0 0 0 0 11 15 2 0 0 0 0 12 16 2 0 0 0 0 13 17 1 0 0 0 0 14 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 8 10 1 0 0 0 0 13 16 1 0 0 0 0 15 18 1 0 0 0 0 M CHG 2 17 1 20 -1 M END