PUBCHEM-ZINC05420534 MOE2007 3D CORINA 3.40 0006 02.08.2006 17 17 0 0 0 0 0 0 0 0999 V2000 0.0560 1.4920 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 0.1200 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 -0.6800 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 -0.0770 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 1.3080 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 2.0860 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 3.9710 -0.0440 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 -0.8600 0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -2.1480 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 -2.8410 -0.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 2.1090 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -0.3360 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4240 1.7780 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4240 -1.8250 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 -0.4430 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -2.7220 0.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 -3.6880 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 11 1 0 0 0 0 2 3 2 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 16 17 1 0 0 0 0 M END