CHEMBRIDGE-ZINC01126671 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7120 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0990 1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.7270 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.0260 -1.2110 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.7020 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.0020 -2.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -0.6730 -3.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -2.3850 -3.5790 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 0.0040 -4.7390 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -0.6660 -5.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -1.8820 -5.9110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 0.0760 -7.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 -0.6090 -8.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 0.1330 -9.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 1.5160 -9.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 2.1330 -8.3330 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 1.4710 -7.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -0.7310 -11.2570 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.1960 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6800 2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -3.8060 -0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 0.9680 -2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 0.9740 -4.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -1.6890 -8.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 2.0980 -10.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 2.0130 -6.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 19 31 1 0 0 0 0 M END