PUBCHEM-ZINC02002699 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 21 0 0 1 0 0 0 0 0999 V2000 -0.0700 1.4880 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -0.0400 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 -0.6430 -0.1880 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -2.4300 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7850 -3.1390 -0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 -3.3640 0.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 1.9980 0.0710 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9380 1.5590 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 3.5440 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 3.9160 -0.8760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 1.8550 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 1.9100 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 -0.4840 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -0.3830 1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 -2.6880 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -2.7130 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9790 -3.4930 -1.6170 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9890 4.1680 1.0930 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0840 1.5930 -1.2080 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4250 2.5680 -1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 1.2690 -1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 1.0090 -1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 15 1 0 0 0 0 4 16 1 0 0 0 0 5 6 2 0 0 0 0 5 17 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 0 0 0 0 9 10 2 0 0 0 0 9 18 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 M CHG 1 17 -1 M CHG 1 18 -1 M CHG 1 19 1 M END