CHEMBRIDGE-ZINC02880933 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0290 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4120 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 2.1840 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3860 3.6070 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4390 4.4400 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5620 3.9940 -0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2210 5.9310 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5170 6.6140 -0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5680 7.9610 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5420 8.6070 0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9010 8.6640 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6890 10.1140 -0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7460 10.9500 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8770 10.5000 -0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5340 12.4000 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5200 13.3460 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0390 14.6330 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7050 14.7410 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9690 13.2020 0.0070 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0470 -0.8940 -0.0400 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 3.1660 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 1.9240 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2390 1.9330 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 6.2200 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 6.2120 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3380 6.0980 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4700 8.3750 0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4540 8.3840 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7880 10.4720 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5730 13.1050 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6900 15.4950 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1670 15.6770 0.0260 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 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 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 M END