PUBCHEM-ZINC05163005 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 24 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -0.6690 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -0.0650 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 1.3220 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 2.0610 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 3.4820 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 4.6720 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 5.8820 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9110 5.9140 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 4.7430 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9830 3.5140 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4510 2.2110 -0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3880 1.9580 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8120 7.5770 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 7.0450 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 1.9130 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -0.5490 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 -0.6530 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 4.6470 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7170 4.7780 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 7.3770 0.9150 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 17 1 0 0 0 0 2 3 2 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 19 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 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 16 22 1 0 0 0 0 M END