NCI:681626 BBtclserve11129920192D 0 0.00000 0.00000240852 999-99-9 27 28 0 0 0 0 0 0 0 0 1 V2000 4.6551 0.5800 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 1.5311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 1.5311 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.2731 0.5800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.5078 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.5078 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7831 3.2536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3764 2.3401 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7776 3.3582 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -3.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5078 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5078 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1953 4.0626 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6021 4.9762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0143 5.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4210 6.6988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8332 7.5078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -4.0078 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.5078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.5078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -6.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -7.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -7.5078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -7.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -6.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 1 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 2 10 1 0 0 0 0 9 11 2 0 0 0 0 8 13 1 0 0 0 0 12 14 2 0 0 0 0 9 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 12 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 22 27 2 0 0 0 0 4 5 2 0 0 0 0 9 10 1 0 0 0 0 12 13 1 0 0 0 0 26 27 1 0 0 0 0 M END