IBS-ZINC06719921 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 0 0 0 0 0 0999 V2000 -1.4810 1.0240 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -0.2170 0.1080 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 -0.7150 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -0.0650 2.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -0.5940 3.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 -1.7710 3.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -2.4310 2.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -1.9070 1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -2.5720 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 -3.6050 -0.4100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.0030 -1.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 -0.8650 -1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -0.3990 -2.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -2.6160 -2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -2.2870 -3.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -2.8930 -4.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -3.8260 -4.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 -4.1550 -4.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 -3.5570 -2.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 -2.4740 4.8660 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 1.8730 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3210 0.9990 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 1.1230 1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 0.8510 2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -0.0870 4.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 -3.3470 2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 -1.5580 -3.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -2.6380 -5.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -4.2980 -5.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 -4.8840 -4.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7130 -3.8180 -2.0950 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 12 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 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 26 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 14 1 0 0 0 0 12 13 2 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 27 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 17 18 2 0 0 0 0 17 29 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 M END