ACROSORGANICS-ZINC00153864 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -0.6300 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 0.0140 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.1360 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 -2.5820 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5730 -1.7590 0.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0080 -4.0180 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3430 -4.4470 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5940 -5.8080 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5290 -6.6940 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 -6.2610 -0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 -4.9770 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3720 -6.4530 0.0280 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 -2.5140 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 -2.5230 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1550 -3.7350 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7220 -7.7560 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -4.6620 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 5 19 1 0 0 0 0 6 7 2 0 0 0 0 6 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 20 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 13 22 1 0 0 0 0 M END