CHEMBRIDGE-ZINC04622115 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 -1.4570 1.5230 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 0.0410 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1350 -0.6390 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -2.0000 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 -2.6890 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 -2.0220 -1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -0.6490 -1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 0.0710 -2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 1.2720 -2.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -0.6030 -3.5990 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 0.0540 -4.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 1.7450 -4.7980 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -0.6210 -5.9320 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 0.0630 -7.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 1.2720 -7.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 1.9490 -8.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 1.4290 -9.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 0.2290 -9.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -0.4700 -8.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2350 -1.7560 -8.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 -2.3160 -7.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 2.3700 -11.2030 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 2.0630 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 1.7700 -0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 1.8100 0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -0.1070 2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 -2.5280 2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 -3.7520 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 -2.5610 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 -1.5620 -3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 -1.5820 -5.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 1.6840 -6.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 2.8890 -8.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 -0.1710 -10.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8210 -2.3110 -9.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2740 -3.1550 -9.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 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 31 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 35 36 1 0 0 0 0 M END