SIAL-ZINC04545866 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 0 0 1 0 0 0 0 0999 V2000 0.2060 1.1050 -0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -0.3810 -0.4100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4810 -0.6120 0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -0.7030 -0.3460 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9500 -0.4340 -1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 -2.2030 -0.0920 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7200 -2.4490 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 -2.9860 -1.1970 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4030 -2.7630 -2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 -2.5760 -1.2280 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0380 -3.0980 -2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 -1.1650 -1.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 -2.9170 0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 -4.9660 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 -2.5440 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 -2.8340 2.2530 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 -2.9840 3.4710 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1760 -1.8820 2.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 0.0380 0.7170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 1.4300 -0.6690 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 1.3180 -1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 1.7020 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -2.6850 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 0.9970 0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 2.3590 -0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 -4.4260 -0.9240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 -4.6620 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 -4.1950 1.9400 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4190 -4.4780 2.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 19 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 15 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 26 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 13 23 1 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 28 1 0 0 0 0 19 24 1 0 0 0 0 20 25 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 M END