PUBCHEM-ZINC06528584 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 0 0 0 0 0 0999 V2000 -0.0720 1.6200 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 0.3870 0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -0.3500 0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 0.1430 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 1.3900 -0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 2.1240 -0.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4130 1.9250 -1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4160 1.2440 -1.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3890 3.1680 -1.8470 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 -0.5980 -0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4130 -1.9380 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 -2.5100 0.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6670 -2.7120 0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9000 -2.0580 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0660 -2.7860 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0170 -4.1630 0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8000 -4.8180 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6240 -4.1010 0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 -4.9970 0.4360 Br 0 0 0 0 0 0 0 0 0 0 0 0 8.3740 -2.0940 0.2650 N 0 3 0 0 0 0 0 0 0 0 0 0 8.4190 -0.8830 0.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4060 -2.7360 0.3570 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9920 2.1870 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 0.0000 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 -1.3090 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 3.0860 -1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 3.7110 -1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1710 3.5190 -2.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3110 -0.1500 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9400 -0.9840 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9340 -4.7280 0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7690 -5.8920 0.5870 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END