NCI:331791 BBtclserve11129919062D 0 0.00000 0.00000175911 999-99-9 20 22 0 0 0 0 0 0 0 0 2 V2000 3.1756 0.3314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 1.2450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7634 -0.4776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 2.0540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5768 1.3495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4544 -1.4287 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7634 -0.4776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 2.9675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.9494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2634 -2.0164 0.0000 Cu 0 0 0 0 0 0 0 0 0 0 0 0 2.6453 -2.0165 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 5.0724 -1.4287 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8135 3.7765 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9544 -2.9675 0.0000 S 0 3 0 0 0 0 0 0 0 0 0 0 4.5724 -2.9675 0.0000 S 0 3 0 0 0 0 0 0 0 0 0 0 2.9544 -2.9675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8814 -2.0164 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 5.5724 -2.9675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3666 -3.7765 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1602 -3.7765 0.0000 N 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 2 5 1 0 0 0 0 3 6 2 0 0 0 0 3 7 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 7 12 2 0 0 0 0 8 13 1 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 11 16 1 0 0 0 0 12 17 1 0 0 0 0 15 18 2 0 0 0 0 16 19 1 0 0 0 0 18 20 1 0 0 0 0 10 12 1 0 0 0 0 14 16 2 0 0 0 0 17 18 1 0 0 0 0 M CHG 6 6 1 11 -1 12 1 14 1 15 1 17 -1 M END