MAYBRIDGE-ZINC04271725 MOE2007 3D CORINA 3.40 0006 02.08.2006 16 17 0 0 0 0 0 0 0 0999 V2000 0.0200 1.3960 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 0.0040 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -0.7220 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 -2.1240 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8150 -2.3690 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7390 -0.9410 -0.0490 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 0.0200 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 1.3640 -0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 2.0040 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3840 -3.7150 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 -4.6900 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8860 1.9920 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 -0.5080 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -2.9110 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 3.0880 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 -3.8290 -0.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 2 0 0 0 0 1 12 1 0 0 0 0 2 3 2 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 16 2 0 0 0 0 M CHG 1 11 -1 M END