PUBCHEM-ZINC06567457 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 31 0 0 1 0 0 0 0 0999 V2000 -0.0080 1.3830 0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.0150 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -0.6550 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 0.0390 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 1.4500 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 2.1010 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 3.8230 0.0500 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.4750 -0.9300 -0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8820 -2.1730 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 -1.9950 0.1210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -2.7410 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8950 -0.6670 -0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2730 0.4570 -0.8210 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8740 -1.8230 -0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2720 -1.3290 -0.0290 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5740 -0.4590 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2810 -2.4040 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6880 -2.8390 -1.4350 N 0 5 0 0 0 0 0 0 0 0 0 0 9.6860 -3.9260 0.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8690 -3.0230 0.8150 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2430 -0.9110 1.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 1.9060 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -0.5760 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 2.0180 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 -3.1740 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5330 -2.5230 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8600 -2.3370 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8880 -1.4950 1.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5780 -3.8170 -1.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 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 14 26 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 20 2 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 19 29 2 0 0 0 0 21 28 1 0 0 0 0 M CHG 1 18 -1 M END