CHEMBRIDGE-ZINC02922841 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.6670 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.0590 2.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.1350 1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -2.8880 2.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -4.2640 2.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -4.9020 1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.1840 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7890 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -1.9730 -1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6770 -1.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -2.6360 -2.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -1.5820 -3.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -0.4070 -3.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -1.9440 -5.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -0.9710 -6.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -1.2110 -7.3030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -0.1640 -8.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 1.0160 -7.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 0.7150 -5.7470 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 2.7130 -8.3160 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -2.3980 3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -4.8510 3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -5.9810 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.6930 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -3.2450 -2.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -3.2700 -2.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -2.8830 -5.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -0.2560 -9.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 M END