IBS-ZINC05443204 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 41 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3830 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 1.1960 -0.6930 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0000 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4030 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 2.0900 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6670 2.1300 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7350 3.3270 -0.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8630 1.3160 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0940 1.9190 0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1930 1.1260 0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0720 -0.2600 0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8580 -0.8610 0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7420 -0.0840 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 -0.6760 -0.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1550 -1.0310 1.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3780 -0.3530 1.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4600 -1.3650 1.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2420 -1.8380 0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2360 -2.7660 0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4470 -3.2220 2.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6650 -2.7490 3.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6750 -1.8160 2.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9530 -3.3730 4.9590 Br 0 0 0 0 0 0 0 0 0 0 0 0 6.2060 3.2710 0.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9090 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.5500 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -1.7730 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 3.1700 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1460 1.5820 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7810 -1.9380 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6650 0.2650 0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2400 0.2780 2.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0770 -1.4820 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8460 -3.1350 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2220 -3.9480 2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0660 -1.4430 3.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0320 3.6710 1.4430 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 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 25 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 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 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 37 1 0 0 0 0 25 38 1 0 0 0 0 M END