PUBCHEM-ZINC05438574 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 25 0 0 1 0 0 0 0 0999 V2000 -0.3890 1.4460 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 0.0070 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 -0.4150 0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -0.7430 -0.7590 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -0.3450 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -2.1770 -1.0760 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3890 -2.6750 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 -2.4480 -2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 -2.1020 -2.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 -2.5770 -3.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0550 -2.4670 -3.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4640 -2.8980 -5.1520 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.8940 -3.1970 -6.1070 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -3.0100 -4.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 -2.7880 -1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5580 -1.9220 -1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 1.5330 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 2.0080 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 1.8670 0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -1.8810 -3.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 -3.5070 -2.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 -2.5650 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 -1.0180 -2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 -3.1110 -3.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3570 -1.4280 -3.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -4.0480 -1.0600 O 0 5 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 15 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 13 3 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 M CHG 1 12 1 M CHG 1 26 -1 M END