PUBCHEM-ZINC04531301 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 1 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0290 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4120 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 2.1840 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 2.5010 -1.7300 S 0 0 0 0 0 0 0 0 0 0 0 0 5.6700 3.3900 -1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2000 3.6890 0.1510 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3960 3.8340 -2.4940 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6400 4.5730 -2.2600 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1400 4.1900 -1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5660 4.4450 -3.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6940 5.4880 -3.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9730 6.8550 -2.3790 S 0 0 0 0 0 0 0 0 0 0 0 0 8.8160 7.9970 -3.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6680 6.9670 -1.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3360 6.0830 -2.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0470 -0.8940 -0.0400 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 3.1660 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5330 3.1320 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 1.6030 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0960 3.6640 -3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9960 3.4430 -3.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9980 4.6260 -4.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5510 5.0600 -2.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9900 5.8450 -4.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6130 6.4190 -2.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9810 6.2950 -1.0810 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 M END