PUBCHEM-ZINC05919400 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 21 0 0 1 0 0 0 0 0999 V2000 0.5200 1.5540 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 0.0820 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4410 -0.2600 1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -0.0550 -0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7010 -0.7280 -1.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 -0.7540 -0.9580 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -1.0280 -0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 -0.6200 -0.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -1.9040 -2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0950 -1.6140 -2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9270 -2.5150 -2.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 -0.1950 -2.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5940 1.7220 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 1.9140 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 2.1780 0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 -1.1380 -1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -2.9430 -1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 -1.8000 -2.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 0.4350 -2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3960 -0.1710 -3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6690 0.1870 -3.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 0.4980 0.6970 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 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 22 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 9 18 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 19 1 0 0 0 0 12 20 1 0 0 0 0 12 21 1 0 0 0 0 M CHG 1 22 -1 M END