NCID-ZINC01575458 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 21 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 0.0070 1.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 -1.5170 1.9470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -2.0020 3.1340 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4130 -1.1650 3.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 -3.0300 2.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -4.1790 2.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -2.6470 4.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -2.6950 3.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -0.6380 -1.6160 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 -1.9250 1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6360 -2.5910 1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 -3.3250 3.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9380 -4.8740 1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -3.1660 5.2390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -3.5690 5.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 13 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 9 19 1 0 0 0 0 10 20 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 21 22 1 0 0 0 0 M END