PUBCHEM-ZINC02044837 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 -1.2300 0.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 -1.2550 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 -1.7120 2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -1.3460 3.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 -1.7240 4.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -0.5830 3.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -0.3310 4.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -0.1640 2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 0.5260 2.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 -2.5200 2.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6010 -3.1620 1.9260 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -1.5020 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 -0.2070 -0.9840 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 -0.5660 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 7 8 2 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 15 16 3 0 0 0 0 21 22 1 0 0 0 0 M END