NCI:171302 BBtclserve11129918052D 0 0.00000 0.00000126661 69819-48-3 23 24 0 0 0 0 0 0 0 0 2 V2000 4.5981 -0.3807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.1193 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.1193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.3807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.1193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.8807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.8807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6551 1.7071 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.2731 1.7071 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.8807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.8807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 2.6581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 2.6581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.3807 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.5981 -3.3807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.3807 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3763 3.4672 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8660 -4.3807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.8807 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.3301 -4.3807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.8807 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.7831 4.3807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3818 3.3626 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 2 0 0 0 0 4 7 1 0 0 0 0 5 8 1 0 0 0 0 5 9 2 0 0 0 0 6 10 1 0 0 0 0 7 11 2 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 10 15 2 0 0 0 0 11 16 1 0 0 0 0 12 17 1 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 16 20 2 0 0 0 0 16 21 1 0 0 0 0 17 22 2 0 0 0 0 17 23 1 0 0 0 0 12 13 2 0 0 0 0 11 15 1 0 0 0 0 M CHG 6 14 1 16 1 17 1 19 -1 21 -1 23 -1 M END