PUBCHEM-ZINC06691157 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 20 0 0 1 0 0 0 0 0999 V2000 -0.2600 1.5790 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 0.0600 -0.0840 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0140 -0.4440 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -0.4680 -1.3430 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1200 -0.0840 -2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 -2.0160 -1.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 -0.2050 -1.2020 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7640 -0.2190 1.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -0.2770 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 2.1250 -0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 1.8990 -0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -2.5060 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 -2.3620 -1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 -2.4210 -2.2160 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1910 -3.3000 -1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 -1.6130 -1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 -2.3390 -3.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 1.9620 1.3160 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3080 2.9390 1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 1.3390 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 1.7610 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 M CHG 1 7 -1 M CHG 1 14 1 M CHG 1 18 1 M END