NCI:117917 BBtclserve11129917322D 0 0.00000 0.00000 89849 21303-46-8 22 24 0 0 0 0 0 0 0 0 2 V2000 4.9921 0.3495 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9703 0.5574 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6831 -0.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2793 1.5085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.9106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2709 -1.4106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6101 2.2516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2574 1.7164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.9106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.4106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2709 -1.4106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6831 -2.2196 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6320 2.0437 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.9192 3.2027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5664 2.6674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.4106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.9106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9629 2.7868 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 1.0926 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.8973 3.4106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.4106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9106 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 2 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 4 7 2 0 0 0 0 4 8 1 0 0 0 0 5 9 2 0 0 0 0 5 10 1 0 0 0 0 6 11 2 0 0 0 0 6 12 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 8 15 2 0 0 0 0 9 16 1 0 0 0 0 10 17 2 0 0 0 0 13 18 2 0 0 0 0 13 19 1 0 0 0 0 14 20 2 0 0 0 0 16 21 1 0 0 0 0 16 22 2 0 0 0 0 9 12 1 0 0 0 0 15 20 1 0 0 0 0 17 22 1 0 0 0 0 M CHG 2 13 1 19 -1 M END