PUBCHEM-ZINC06072522 MOE2007 3D CORINA 3.40 0006 02.08.2006 17 16 0 0 1 0 0 0 0 0999 V2000 -0.1340 1.4770 -0.4300 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3520 0.8000 -1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 2.0440 -0.5460 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6650 2.3770 0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 1.0040 -1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 1.1550 -2.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -0.1280 -0.3450 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 -0.8580 -0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 -0.2480 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 3.2110 -1.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 0.6930 0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 0.8250 1.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 3.3490 -1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 0.0120 1.2990 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.1210 2.6120 -0.5070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 3.1750 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 2.1630 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 11 1 0 0 0 0 1 15 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 M CHG 1 14 -1 M END