IBS-ZINC00053897 MOE2007 3D CORINA 3.40 0006 02.08.2006 16 16 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 -0.6320 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 0.0160 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 -1.9780 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -2.6260 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6330 -3.9120 0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8760 -4.3580 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8080 -3.4040 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9910 -1.8430 0.0380 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 -2.4960 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1180 -5.4110 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8760 -3.5610 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 3 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 14 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 M END