SIAL-ZINC00392074 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 0 0 0 0 0 0999 V2000 0.2000 1.1300 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 1.2600 -0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 1.0040 -0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 0.6170 0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 0.4890 1.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 0.7440 2.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 0.3400 -0.1800 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6760 0.4210 -1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0940 0.7880 -2.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0870 -0.1050 -1.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1280 0.5830 -0.2930 S 0 0 0 0 0 0 0 0 0 0 0 0 7.2950 1.9860 -0.6110 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5310 0.1600 0.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6440 -0.2900 -0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6980 0.2370 0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6940 -0.2650 1.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 1.3310 1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 1.5620 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 1.1180 -1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 0.1930 2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 0.6430 3.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7620 0.0660 0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 -1.1920 -1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5140 0.1560 -2.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4640 -1.3550 -0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9360 -0.1400 -1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5030 1.0640 -0.1450 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 17 1 0 0 0 0 2 3 2 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 15 27 1 0 0 0 0 M CHG 1 27 -1 M END