PUBCHEM-ZINC05131764 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 24 0 0 1 0 0 0 0 0999 V2000 0.2860 1.5090 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -0.0120 0.0950 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8140 -0.4080 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 -0.2770 0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 -0.6610 -0.5150 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -2.0240 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 -2.1620 -2.4210 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4460 -1.9050 -3.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -3.6300 -2.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2010 -3.8470 -3.5850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 1.9320 -0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 1.1290 -1.7930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 1.9500 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 1.9580 0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -2.7420 -1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 -2.1210 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 -0.1010 1.6880 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4570 -0.6680 -1.2340 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4520 -0.6890 -1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 0.0270 -1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0710 -4.4420 -1.6870 O 0 5 0 0 0 0 0 0 0 0 0 0 3.1890 -1.2790 -2.3220 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9100 -0.2830 -2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7520 -1.4390 -3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 2.9960 -0.4760 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 11 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 18 1 0 0 0 0 4 5 2 0 0 0 0 4 17 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 17 -1 M CHG 1 18 1 M CHG 1 21 -1 M CHG 1 25 -1 M END