NCID-ZINC05760163 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 31 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3970 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 1.3520 -0.3890 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 0.7400 -0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 0.7740 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 1.8200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 3.6280 -0.0060 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -1.8040 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 -2.1640 0.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 -2.6950 -0.6320 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -2.2450 -1.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 -1.8220 -1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 -0.9750 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 -1.1100 0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1430 -2.0360 1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4800 -2.8460 0.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7400 -1.8100 2.1780 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1070 -0.8670 2.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 -0.4060 2.1400 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4750 -0.4120 4.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 2.0240 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -3.6420 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -1.3960 -2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -3.0540 -2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -1.2420 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7810 -2.7090 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 0.2840 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2500 -0.7900 4.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9620 0.2880 4.5090 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 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 22 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 27 1 0 0 0 0 20 28 1 0 0 0 0 20 29 1 0 0 0 0 M END