PUBCHEM-ZINC03122915 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2100 -0.6820 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 0.0390 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.4350 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 3.5740 0.0100 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0660 4.1590 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 4.2070 0.0030 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7020 -0.6720 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 -1.9700 -0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9550 -2.6460 -0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9820 -3.9940 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9410 -4.6230 -0.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2740 -4.7050 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4720 -3.9860 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6760 -4.6580 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7040 -6.0440 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5270 -6.7660 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3070 -6.1060 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1500 -6.8150 -0.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2970 -3.6840 -0.1110 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9020 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 1.9980 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6270 -0.1130 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7860 -2.1440 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4550 -2.9060 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6510 -6.5620 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5560 -7.8450 -0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8040 -7.0200 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -2.0400 -0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 -2.4290 -0.9050 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 32 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 25 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 19 30 1 0 0 0 0 20 21 1 0 0 0 0 21 31 1 0 0 0 0 32 33 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END