CHEMDIV-ZINC04759104 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 1.1680 1.2080 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -0.2850 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -0.7520 -1.6600 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 -1.1240 -2.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 -1.5520 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 -1.9200 -1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8070 -1.8600 -3.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8470 -1.4310 -3.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 -1.0700 -3.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0420 -2.2210 -3.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2820 -2.1350 -4.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7140 -2.5790 -5.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 -0.8390 -2.6810 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -1.9120 -3.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 -0.7760 -1.8610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 0.6300 -3.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 1.6080 -3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 2.7650 -4.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 2.9380 -5.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 1.9600 -5.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 0.7950 -4.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2540 -0.0660 -5.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0060 0.5300 -6.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 1.8920 -6.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5130 -1.2690 -4.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -1.6090 -3.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5190 -2.1900 -5.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7680 -3.5410 -4.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 -3.4740 -5.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 4.1060 -3.8500 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 1.3620 -0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 1.7520 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 1.5730 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5090 -0.8380 0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -0.4470 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0220 -1.5980 -0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2560 -2.2530 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 -1.3850 -4.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -0.7420 -4.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5820 -2.7830 -5.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1430 -1.1050 -5.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8530 -3.6080 -4.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8970 -2.5130 -6.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4140 -1.9310 -4.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 1.4720 -2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 3.8400 -5.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 -0.1020 -7.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0480 0.6740 -5.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0450 2.7070 -6.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 1.9280 -7.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3680 -1.7010 -5.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2060 -3.7640 -3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7820 -3.9410 -4.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4930 -3.8300 -6.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -3.6530 -5.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 M END