NCI:228181 BBtclserve11129918252D 0 0.00000 0.00000147367 28665-07-8 17 18 0 0 0 0 0 0 0 0 2 V2000 4.0823 -0.3807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2163 -0.8807 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9483 -0.8807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 0.6193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2163 -1.8807 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2733 1.2071 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8913 1.2071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3502 -2.3807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -2.3807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 2.1581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5823 2.1581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3502 -3.3807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -3.3807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 2.9672 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.2163 -3.8807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 3.8807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.8626 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 2 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 2 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 6 10 1 0 0 0 0 7 11 1 0 0 0 0 8 12 1 0 0 0 0 9 13 1 0 0 0 0 10 14 1 0 0 0 0 12 15 1 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 10 11 2 0 0 0 0 13 15 1 0 0 0 0 M CHG 2 14 1 17 -1 M END