NCI:47085 BBtclserve11129917022D 0 0.00000 0.00000 40699 6331-46-0 20 22 0 0 0 0 0 0 0 0 1 V2000 3.9142 0.0694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6213 -0.6378 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9483 -0.1895 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1730 1.0353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3625 -1.6037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9051 2.0353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 1.9013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0696 -2.3108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4273 3.9838 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7370 1.2765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7071 2.1601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1639 3.0012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0355 -2.0520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8108 -3.2767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9959 2.2424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4483 3.1260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.4530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7426 -2.7591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5179 -3.9838 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4838 -3.7250 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 1 4 1 0 0 0 0 2 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 5 8 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 8 13 2 0 0 0 0 8 14 1 0 0 0 0 10 15 1 0 0 0 0 11 16 2 0 0 0 0 11 17 1 0 0 0 0 13 18 1 0 0 0 0 14 19 2 0 0 0 0 18 20 2 0 0 0 0 9 12 1 0 0 0 0 12 15 1 0 0 0 0 19 20 1 0 0 0 0 M END