NCI:313401 BBtclserve11129919002D 0 0.00000 0.00000171532 1563-99-1 19 20 0 0 0 0 0 0 0 0 2 V2000 5.4921 0.8981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7000 -0.0801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 1.2071 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6511 -0.3891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.6193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2321 2.1581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.3807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9231 1.2071 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8199 2.9672 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.2321 2.1581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.8807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4131 3.8807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8144 2.8626 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8660 -1.8807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.3807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.3807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.3807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -3.3807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.8807 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 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 2 0 0 0 0 6 9 1 0 0 0 0 6 10 2 0 0 0 0 7 11 2 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 11 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 16 18 2 0 0 0 0 17 19 2 0 0 0 0 8 10 1 0 0 0 0 18 19 1 0 0 0 0 M CHG 2 9 1 13 -1 M END