NCI:686781 BBtclserve11129920232D 0 0.00000 0.00000243295 999-99-9 27 30 0 0 0 0 0 0 0 0 1 V2000 3.1519 -2.0227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9609 -1.4349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8744 -1.8416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9790 -2.8361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1699 -3.4239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2564 -3.0172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2383 -1.6159 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2745 -4.4184 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.8563 -0.4404 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8509 -0.3358 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8618 -0.5449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8925 -3.2429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7518 0.5542 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5608 1.1419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1789 2.3175 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2834 1.3230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4744 0.7352 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9563 3.6753 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9563 3.6753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6473 2.7242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4563 2.1365 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2653 2.7243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 2.5163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 4.2105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2872 4.4184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1969 0.9163 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 1 6 2 0 0 0 0 1 7 1 0 0 0 0 5 8 1 0 0 0 0 2 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 4 12 1 0 0 0 0 9 13 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 14 17 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 14 21 1 0 0 0 0 15 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 19 26 1 0 0 0 0 16 27 2 0 0 0 0 5 6 1 0 0 0 0 16 17 1 0 0 0 0 20 21 1 0 0 0 0 18 22 1 0 0 0 0 21 22 1 0 0 0 0 25 26 2 0 0 0 0 M END