NCI:308830 BBtclserve11129918542D 0 0.00000 0.00000170190 78045-40-6 22 24 0 0 0 0 0 0 0 0 2 V2000 4.2788 0.8784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5878 -0.0727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -0.8817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5388 -0.3817 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5878 -1.6907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -1.7477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -0.0157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5388 -1.3817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3479 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -1.7477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -0.0157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3479 -1.9695 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2614 -0.2006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2433 1.2006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0704 0.3872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0523 1.7884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9840 -0.0196 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.9659 1.3817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0885 -1.0141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7930 0.5682 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.7749 1.9695 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 2 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 6 10 1 0 0 0 0 7 11 1 0 0 0 0 8 12 2 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 10 15 1 0 0 0 0 13 16 1 0 0 0 0 14 17 2 0 0 0 0 16 18 1 0 0 0 0 16 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 22 1 0 0 0 0 5 8 1 0 0 0 0 11 15 1 0 0 0 0 17 19 1 0 0 0 0 M CHG 2 18 1 21 -1 M END