CHEMBRIDGE-ZINC02998756 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 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 0.6050 -0.6060 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 0.1600 -2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -0.4540 -3.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 -1.8370 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -2.6130 -2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -2.0040 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -2.8290 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 -2.2960 0.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -4.1730 -0.1270 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 -4.9480 0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -6.3140 0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 -6.8740 2.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -5.9300 2.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 -4.3270 2.2610 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2590 -6.2140 4.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7150 -7.6750 4.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 -8.5690 3.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1870 -8.3650 2.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -7.1340 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -7.4600 -0.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -7.5260 -1.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6820 -2.6610 -4.6940 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 1.1250 1.2380 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 0.1470 -3.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 -3.6900 -2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -4.5990 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5860 -6.0410 5.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1270 -5.5600 4.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0780 -7.9440 5.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5140 -7.8080 3.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 -8.3030 4.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -9.6130 3.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9830 -8.7800 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 -8.8620 2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -7.2660 -1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 -8.0680 -1.9060 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 24 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 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 21 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 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 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 M END