MMs02226746 MOE2007 2D CORINA 3.40 0006 02.08.2006 16 17 0 0 0 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 0.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2422 1.3124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7076 1.6330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8555 3.1257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4816 3.7276 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2251 4.8999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4845 2.6070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0155 2.5980 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7577 1.2946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7732 3.8926 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.8282 0.6359 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.5938 -1.0428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1061 -1.0267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8911 3.7318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9577 1.2874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 13 1 0 0 0 0 2 3 2 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 16 1 0 0 0 0 M CHG 1 9 1 M CHG 1 11 -1 M END