PUBCHEM-ZINC05425107 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 24 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.7700 1.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.0550 0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.0860 -0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7860 -1.1000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.3260 -2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 -0.1470 -2.9960 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9570 -1.0750 -2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 0.2110 -4.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 0.2790 -5.1130 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.0390 0.9030 -2.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -3.7960 -1.8840 I 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -3.2320 1.5700 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0690 -3.0770 2.7780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -4.3560 1.1000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -1.0650 -3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 0.6250 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -0.5460 -5.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 1.1830 -4.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 1.7600 -2.3430 H 0 0 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 6 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 12 24 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END