CHEMBRIDGE-ZINC01153432 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -0.6360 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 0.1000 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -0.5440 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -1.9290 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 -2.6770 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -2.0370 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -2.8300 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 -2.2700 -0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -4.1760 -0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -4.9020 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 -4.1130 -0.0680 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -6.2480 -0.0700 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 -6.9990 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1090 -8.3920 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 -9.1240 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4930 -8.4360 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4850 -7.0550 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 -6.3840 -0.1040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -9.0240 -0.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3370 -2.7960 0.0380 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 1.1800 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 0.0340 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -3.7560 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 -4.6240 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -6.6950 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2680 -10.2040 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4290 -8.9750 -0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4210 -6.5170 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -9.1980 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 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 29 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 30 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 21 34 1 0 0 0 0 M END