PUBCHEM-ZINC05212293 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 0 0 0 0 0 0999 V2000 -0.1960 1.6900 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 0.1880 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 -0.4120 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -1.7900 1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -2.5720 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -1.9790 -1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -0.5940 -1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 0.0100 -2.4110 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -0.6570 -3.7410 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 0.2520 -4.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -2.0170 -3.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 -0.6710 -3.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2710 0.4110 -3.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6320 0.4010 -3.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2180 -0.6920 -2.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4410 -1.7740 -2.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0810 -1.7650 -2.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9280 -0.7040 -2.6530 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 -2.4300 2.6430 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7050 -1.7420 3.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 -3.6440 2.7320 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8420 2.0150 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 2.0040 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 2.1360 0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 0.1950 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 -3.6480 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -2.5900 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 0.8190 -2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 1.2640 -4.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2380 1.2470 -3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8980 -2.6270 -2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -2.6120 -2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 5 6 2 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 32 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END