NCI:55225 BBtclserve11129917072D 0 0.00000 0.00000 46428 6945-27-3 19 21 0 0 0 0 0 0 0 0 2 V2000 4.8255 0.7136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5686 0.0445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5468 0.2524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.9500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.6136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0376 1.3523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3776 -1.3568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 0.3864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3010 2.3349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8696 0.5935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5856 -2.3349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5200 -0.5795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6108 -0.3724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.4500 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -2.3161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -0.5840 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 4 7 1 0 0 0 0 4 8 1 0 0 0 0 5 9 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 7 12 1 0 0 0 0 8 13 2 0 0 0 0 9 14 1 0 0 0 0 9 15 1 0 0 0 0 12 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 5 8 1 0 0 0 0 9 10 1 0 0 0 0 11 15 1 0 0 0 0 M CHG 1 16 1 M END