MAYBRIDGE-ZINC04336514 MOE2007 3D CORINA 3.40 0006 02.08.2006 18 17 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.0560 -0.5940 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 2.0100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 2.2700 -1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 3.6920 -1.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 4.4140 -1.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 2.2460 1.2080 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4640 2.0290 2.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1680 2.6670 1.2000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 2.1170 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 1.5880 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -0.6910 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 4.1570 -2.8440 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 5.0760 -3.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -1.6560 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 2 3 2 0 0 0 0 2 15 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 6 7 2 0 0 0 0 6 16 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M END