IBS-ZINC04994977 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 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 -1.1990 -0.6370 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 0.0990 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5950 -0.5460 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6570 -1.9300 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4990 -2.6780 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -2.0380 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -2.8310 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -3.8790 0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -4.3440 0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 -3.5600 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -2.6580 -0.8750 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2090 -3.6850 -1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5090 -2.8450 -2.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7400 -2.9700 -2.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5350 -3.8300 -2.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0650 -2.0580 -4.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2820 -2.1790 -4.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5800 -1.3260 -5.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6730 -0.3500 -6.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4640 -0.2240 -5.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1530 -1.0760 -4.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0890 0.8170 -7.6240 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 1.1780 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5070 0.0320 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6170 -2.4250 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 -3.7560 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -4.2660 1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 -5.1600 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 -4.4470 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8040 -2.0830 -2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9900 -2.9400 -4.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5210 -1.4190 -6.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7620 0.5390 -5.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2080 -0.9800 -3.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 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 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 M END