CHEMBRIDGE-ZINC00994478 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 28 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3610 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 1.2120 -0.6870 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 0.0100 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 1.3760 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 2.0770 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 3.5380 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 4.3390 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 5.5680 0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 5.6030 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 4.3250 0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 6.7460 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 8.1340 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 8.9130 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 8.0630 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 6.7890 0.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8170 8.6280 0.0850 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 -0.7290 -0.0350 N 0 3 0 0 0 0 0 0 0 0 0 0 4.8360 -0.0710 -0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 -2.0460 -0.0420 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2220 -2.4230 -0.0220 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8900 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3510 1.9160 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 8.4730 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 9.9930 0.0620 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END