IBS-ZINC00548876 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 0 0 0 0 0 0999 V2000 0.0290 1.5290 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 0.0430 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -0.8490 1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -2.1920 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -2.2820 -0.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -0.7630 -1.3290 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -3.4800 -1.2960 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -3.6770 -2.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -2.8230 -3.5230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -5.1050 -3.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -5.4210 -4.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -6.7440 -4.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -7.7520 -3.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -7.4480 -2.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -6.1230 -2.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -9.5450 -4.5650 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -3.3750 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 -4.5030 0.9920 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9880 1.8910 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 1.9760 -0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 1.8880 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -0.5610 2.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -4.2710 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -4.6370 -5.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 -6.9730 -5.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 -8.2290 -2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 -5.9140 -1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 -3.2070 2.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 23 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 15 2 0 0 0 0 11 12 2 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 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 17 18 1 0 0 0 0 17 28 2 0 0 0 0 M CHG 1 18 -1 M END