SIAL-ZINC04531924 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 0.2530 1.4210 -0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -0.0920 -0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -0.4430 1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 -0.5480 -0.4000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7010 -0.2980 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 0.1480 0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6120 -0.5000 1.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -1.9970 -0.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 -2.6980 -0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6380 -1.8960 -1.5280 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 -4.0320 -0.4900 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 -4.7480 -0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 -5.7350 -1.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6070 -6.4220 -2.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5350 -7.1290 -2.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8080 -6.1240 -1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7900 -6.7470 -2.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9400 -5.1490 -0.7610 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8150 -4.9490 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8630 -4.4520 -0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9820 -3.5720 0.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 1.7460 -0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 1.6710 -1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 1.9250 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 -0.5960 -1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 0.0610 1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -1.5210 1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -0.1180 1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -2.4520 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7070 -4.4970 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5230 -5.9790 -2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 1.4880 0.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 1.8900 1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 32 33 1 0 0 0 0 M END