PUBCHEM-ZINC04087417 MOE2007 3D CORINA 3.40 0006 02.08.2006 18 18 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -0.6060 -1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -1.9910 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -2.5620 -2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 -1.7650 -3.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -0.4540 -3.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 0.1230 -2.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 0.5430 -4.2980 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 -3.9400 -2.3620 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -2.8390 -0.0730 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0860 -3.1980 -0.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 -3.1780 0.8820 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -4.5140 -1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -4.3300 -3.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 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 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 10 17 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 M CHG 1 11 1 M CHG 1 13 -1 M END