NCI:116654 BBtclserve11129917322D 0 0.00000 0.00000 88842 13226-11-4 28 31 0 0 0 0 0 0 0 0 1 V2000 2.7431 0.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5352 1.2346 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4127 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 -0.0526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5032 0.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0032 -1.0036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3122 -0.0526 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5032 1.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4154 -1.8126 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0032 -1.0036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3693 2.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6372 2.0352 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8276 -2.6217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2244 -2.4004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6064 -1.2249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5910 -1.8126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3693 3.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2353 1.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6372 3.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5855 -1.7081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1843 -2.7262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5032 3.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2353 3.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1013 2.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1733 -2.5171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7720 -3.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1013 3.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7666 -3.4307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 6 9 1 0 0 0 0 6 10 2 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 9 13 2 0 0 0 0 9 14 2 0 0 0 0 9 15 1 0 0 0 0 10 16 1 0 0 0 0 11 17 1 0 0 0 0 11 18 1 0 0 0 0 12 19 2 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 18 24 2 0 0 0 0 20 25 1 0 0 0 0 21 26 2 0 0 0 0 23 27 2 0 0 0 0 25 28 2 0 0 0 0 7 10 1 0 0 0 0 19 22 1 0 0 0 0 24 27 1 0 0 0 0 26 28 1 0 0 0 0 M END