MAYBRIDGE-ZINC03119052 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 23 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3720 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 1.2160 -0.6850 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 0.0230 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 1.3990 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 3.5180 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 4.6540 0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 -0.7050 -0.0350 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7530 -0.0860 -0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 -1.9230 -0.0410 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2360 -2.4470 -0.0220 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -2.8750 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -4.3970 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0710 -4.7340 -0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9000 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3340 1.9480 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 -2.4660 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 -2.4570 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 -4.8060 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -4.8150 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 -5.6850 -0.0060 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 16 1 0 0 0 0 2 3 2 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 7 8 3 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 14 22 1 0 0 0 0 15 23 1 0 0 0 0 M CHG 1 9 1 M CHG 1 11 -1 M END