IBS-ZINC01302128 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1240 -0.9400 -1.4230 N 0 3 0 0 0 0 0 0 0 0 0 0 4.8640 -0.1160 -2.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4130 1.1390 -1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1570 1.8510 -2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3830 1.3480 -3.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8590 0.1590 -4.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 -0.5720 -3.4040 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4450 -1.8760 -3.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7780 -2.1260 -2.2120 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3340 -3.3690 -1.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7390 -4.5950 -1.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2500 -5.7360 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3570 -5.6510 -0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9520 -4.4250 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4440 -3.2850 -0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0560 -7.2120 0.4190 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 -2.2300 -2.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2360 1.5210 -0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5760 2.8040 -2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9750 1.9130 -4.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0370 -0.2210 -5.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 -1.8260 -4.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1790 -2.6540 -3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 -4.6600 -2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7850 -6.6930 -1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8160 -4.3580 0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9110 -2.3280 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 -2.9980 -2.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 24 42 1 0 0 0 0 M CHG 1 8 1 M END