NCID-ZINC05732882 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 -1.5780 1.9240 0.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 0.7550 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 0.8940 0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -0.4750 0.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -1.5710 -0.3130 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5520 -1.3650 -1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6630 -1.7570 -0.9290 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5870 -2.3560 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7590 -2.0470 0.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1090 -3.2340 1.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7990 -3.5240 1.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -4.4710 1.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 -2.7910 0.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -3.2190 0.3870 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5780 -4.3010 0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -2.7720 1.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6440 -2.3850 1.2220 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3890 -3.0150 1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 -2.6430 -0.3010 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0160 -3.6360 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -2.5580 -0.6760 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 -1.5760 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5120 -1.8980 -2.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9080 -0.9710 1.5030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 -0.6120 2.5660 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0400 -0.2530 3.6290 N 0 5 0 0 0 0 0 0 0 0 0 0 -2.5660 -2.6940 -2.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 -0.0130 -1.5060 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 2.8630 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6450 1.8260 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 1.9180 1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 0.7620 -1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 0.9560 1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 0.0270 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 1.7990 -0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7200 -3.6640 1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -1.9120 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -3.5940 2.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 -0.6040 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 -1.5430 -0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0170 -1.2630 -2.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1790 -3.6610 -1.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5560 -2.8260 -2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8950 -2.2630 -2.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 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 36 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 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 24 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 25 26 2 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 M CHG 1 25 1 M CHG 1 26 -1 M END