PUBCHEM-ZINC04621271 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 0.8180 1.2200 -0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -0.0100 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 -0.3100 1.2190 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -1.5250 1.4830 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 -1.8530 3.0080 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2870 -3.0700 2.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -1.6720 3.8840 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7290 -0.6010 3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0660 -0.7800 3.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9850 0.2010 3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5660 1.3620 4.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2280 1.5400 4.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 0.5560 4.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8230 2.7050 4.5000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 -0.8740 -1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 -1.4420 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 -2.2490 -2.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 -2.4970 -3.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -1.9320 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -1.1200 -2.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 -3.3150 -4.2820 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 0.9620 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 1.6120 -1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 1.9760 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 -2.1740 0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3920 -1.6860 2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0290 0.0620 3.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9010 2.4470 4.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 0.6940 4.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 -1.2510 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0750 -2.6890 -2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -2.1270 -4.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 -0.6780 -2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 -3.7090 -4.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -3.4890 -5.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 7 2 0 0 0 0 5 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 29 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 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 M END