PUBCHEM-ZINC03824390 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 23 0 0 1 0 0 0 0 0999 V2000 0.0030 1.4570 0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -0.0600 0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 -0.3040 1.1160 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3200 0.8220 0.6030 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1810 0.4930 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 1.8720 0.0080 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6560 2.2450 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 2.2350 1.1810 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8120 2.3750 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4880 3.0940 0.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5950 2.7270 1.4570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9280 -1.7580 0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 -2.5890 1.7100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 1.6990 -0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 1.9540 1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -0.4320 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -0.5590 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 4.1630 0.2760 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3340 -1.9430 -0.4330 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3160 -0.2230 2.5970 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -0.0630 2.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -1.2110 2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 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 16 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 18 -1 M CHG 1 19 -1 M END