CHEMBRIDGE-ZINC02451240 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.3680 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0090 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -0.6880 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 0.0440 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 1.4320 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0880 0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 3.9730 0.4070 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.5060 -0.9410 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8640 -0.6900 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5480 0.6190 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 1.6690 -0.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8690 0.5530 -0.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4710 -0.6360 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1590 -0.9220 -0.0010 S 0 0 0 0 0 0 0 0 0 0 0 0 6.1940 -1.8600 0.0640 S 0 0 0 0 0 0 0 0 0 0 0 0 7.6680 1.7780 -0.2300 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0050 2.6400 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5590 1.7110 -1.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6840 1.7010 -2.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5610 1.6350 -3.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7630 1.6000 -3.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5290 1.9110 1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4810 1.0700 1.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 -2.2540 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3840 -3.3340 -0.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -2.0420 -0.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8880 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5590 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9920 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2160 2.5800 -1.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1590 0.8020 -1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0260 0.8320 -2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0840 2.6100 -2.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -2.7450 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0070 1.6160 -5.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3500 2.9650 1.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8840 3.0070 1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6110 1.5730 -5.9270 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 8 9 2 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 34 1 0 0 0 0 35 38 1 0 0 0 0 36 37 1 0 0 0 0 M END