NCID-ZINC05580084 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 43 0 0 0 0 0 0 0 0999 V2000 -0.4050 1.7930 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 0.4600 -0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -0.5450 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 -0.2200 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 1.1000 0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 2.1090 0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 3.4420 0.4520 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 4.2430 -0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 3.9170 -1.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9190 5.1060 -3.3460 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 4.0110 1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 3.4750 2.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 4.1580 4.4320 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.2370 1.4400 0.7570 N 0 3 0 0 0 0 0 0 0 0 0 0 4.0670 0.5570 0.8810 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5520 2.6020 0.9390 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1810 -1.9600 -0.3840 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0740 -2.7960 0.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 -2.2900 -1.4120 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.1520 0.1150 -0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 -1.0510 -0.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0460 1.0920 -0.9310 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4220 0.7490 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2230 2.0330 -1.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6390 1.6800 -1.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9730 0.5220 -1.9810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 2.5750 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 -1.0000 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 4.0110 -1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 5.3030 -0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 4.0620 -1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 2.8800 -2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 5.0970 1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 3.7280 1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 2.3860 2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 3.8050 2.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7770 2.0220 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4180 0.1550 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8800 0.1750 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2270 2.6270 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7650 2.6070 -2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5290 2.6540 -2.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4250 2.3780 -2.3930 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M CHG 1 17 1 M CHG 1 19 -1 M END