IBS-ZINC05179192 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.1360 1.5440 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 0.0200 0.0050 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9980 -0.4300 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -0.4100 -1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -0.9380 -1.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -0.2050 -2.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -0.6440 -3.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -0.4070 1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.5410 2.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 -0.3100 2.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 -0.4420 3.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -0.8100 4.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -1.0450 4.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -0.9120 3.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -1.3840 5.9150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -1.4000 6.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 -1.7000 8.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -1.9370 8.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 -1.9720 7.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9170 -2.1950 8.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9680 -2.3850 9.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -2.3520 10.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -2.1240 10.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8920 -2.6120 12.6110 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 -1.0320 5.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1500 -0.9320 6.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 1.9940 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 1.8700 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 1.8550 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 -0.1230 -3.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -1.7180 -3.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -0.4190 -4.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -0.0250 1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2000 -0.2620 3.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 -1.0930 3.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6780 -1.7640 8.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 -1.8250 6.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 -2.2220 8.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9180 -2.5600 10.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -2.0950 10.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 40 1 0 0 0 0 25 26 2 0 0 0 0 M END