PUBCHEM-ZINC00335035 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 0 0 0 0 0 0999 V2000 -0.1970 1.6020 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 0.1430 -0.1790 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2310 -0.4120 0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 -1.7950 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -2.5950 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 -1.9840 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -0.5920 -1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 0.1960 -2.7460 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -1.1820 -3.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 0.4500 2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -0.0490 3.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 2.0100 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 1.8760 -1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 2.0070 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -2.2420 2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -3.6710 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -2.5790 -2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 -1.8560 -3.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 -1.7230 -3.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 -0.7930 -4.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 1.7870 1.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 2.3090 2.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 15 1 0 0 0 0 5 6 2 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 18 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 10 11 2 0 0 0 0 10 21 1 0 0 0 0 21 22 1 0 0 0 0 M CHG 1 2 1 M END