NCI:111589 BBtclserve11129917302D 0 0.00000 0.00000 85448 20271-30-1 18 19 0 0 0 0 0 0 0 0 1 V2000 5.2215 2.2467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2160 2.3512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6337 3.0557 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8147 1.3331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6227 3.2648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8366 1.1252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 0.4671 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6173 3.3693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0935 1.7944 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.1307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6456 -0.2760 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.8693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.8693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.8693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.8693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.3693 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 6 10 1 0 0 0 0 7 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 15 17 2 0 0 0 0 16 18 2 0 0 0 0 10 11 1 0 0 0 0 17 18 1 0 0 0 0 M END