IFLAB-ZINC04504612 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2050 -0.6860 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0120 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 1.4080 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 2.1620 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 1.5670 -0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 3.5100 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9010 4.2570 -0.0200 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6530 3.7110 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6830 5.6450 0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9400 6.4870 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2520 6.0520 -1.4830 S 0 0 0 0 0 0 0 0 0 0 0 0 7.6440 5.8370 -1.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5540 6.9600 -2.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3840 4.4440 -1.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 -0.9220 -0.0390 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5540 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -1.7660 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 3.9850 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 6.1120 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5740 5.5530 1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7320 7.5520 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7820 6.1930 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 3.6440 -1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5340 4.4680 -2.1540 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 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 22 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 23 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 M END