SIAL-ZINC04556876 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 28 0 0 1 0 0 0 0 0999 V2000 -0.3920 1.3720 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -0.1170 0.0790 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0160 -0.6820 0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 -0.3190 1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 -0.8110 1.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -0.6220 -1.1410 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -0.7590 -2.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -0.5040 -2.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -1.2470 -3.4790 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9360 -1.0530 -3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -2.7520 -3.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 -3.3030 -4.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 -5.0950 -4.9940 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -5.3920 -6.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 1.9540 -0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 1.5820 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 1.7470 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -0.8860 -0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -3.2790 -2.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 -2.9460 -4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 -2.8130 -5.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 -3.1310 -4.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -4.7980 -7.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6660 -5.1430 -5.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -6.4500 -6.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 0.0150 2.4370 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6060 -0.4780 -4.7050 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 0.5120 -4.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -0.5460 -4.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 6 7 1 0 0 0 0 6 18 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 26 -1 M END