NCI:407580 BBtclserve11129919272D 0 0.00000 0.00000197648 7498-75-1 22 23 0 0 0 0 0 0 0 0 2 V2000 4.5981 -0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.2306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.2306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.2694 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.5981 -3.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.2694 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.5211 3.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1392 3.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.2694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7694 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.3301 -4.2694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.7694 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.8302 4.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8302 4.2694 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 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 6 9 1 0 0 0 0 7 10 2 0 0 0 0 8 11 2 0 0 0 0 9 12 1 0 0 0 0 9 13 2 0 0 0 0 10 14 1 0 0 0 0 11 15 1 0 0 0 0 11 16 1 0 0 0 0 12 17 2 0 0 0 0 12 18 1 0 0 0 0 14 19 2 0 0 0 0 14 20 1 0 0 0 0 15 21 1 0 0 0 0 16 22 1 0 0 0 0 10 13 1 0 0 0 0 21 22 1 0 0 0 0 M CHG 4 12 1 14 1 18 -1 20 -1 M END