PUBCHEM-ZINC06452589 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 25 0 0 0 0 0 0 0 0999 V2000 -0.0690 1.5000 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 0.0500 0.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -0.6950 1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -2.0310 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -2.7780 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -4.0000 -0.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -1.9680 -1.1770 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -2.4390 -2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -0.5820 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 0.0040 -2.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -2.4780 2.4990 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -1.3490 3.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -1.2980 4.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -0.2430 2.4690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 0.7150 2.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -3.8560 2.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -4.4460 2.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 -3.7250 2.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 1.8640 0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 1.9540 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 1.8030 0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -3.8990 3.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 -4.4830 2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -5.6040 3.4800 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 3 4 2 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 16 23 1 0 0 0 0 17 18 2 0 0 0 0 17 24 1 0 0 0 0 M CHG 1 24 -1 M END