PUBCHEM-ZINC04095505 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 0.0860 1.4880 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -0.0320 0.0970 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7470 -0.4710 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -0.4530 -1.2800 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0850 -0.1710 -2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 0.2010 -1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 -0.4600 -2.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 1.6940 -1.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 2.0870 -0.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3950 3.6370 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 4.2280 -0.7970 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 1.6530 1.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -1.8760 -1.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -0.5540 0.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -1.4980 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 1.9010 -0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 1.7450 1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1160 1.9740 -1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 2.1720 -2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 2.5230 1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -2.0670 -1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 4.0810 1.0040 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 13 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 12 20 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 M CHG 1 22 -1 M END