PUBCHEM-ZINC06423705 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 30 0 0 0 0 0 0 0 0999 V2000 0.0050 1.4760 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 0.0140 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 -0.6800 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -0.0170 2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -0.7190 3.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -2.1050 3.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 -2.7870 2.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -2.0960 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -2.8180 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 -2.1830 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -2.8580 -2.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -4.0690 -2.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -1.9960 -3.5750 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 -2.4100 -4.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 -0.6290 -3.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 0.0030 -4.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 -0.0140 -2.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 -0.6860 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -4.3460 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 -4.8930 0.2110 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9500 1.8690 0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 1.9280 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 1.8370 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 1.0670 2.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -0.1790 4.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -2.6600 4.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -3.8750 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -4.8560 -0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 28 2 0 0 0 0 M CHG 1 20 -1 M END