TDT2MOL Cc1sccc1Cl 12 12 0 0 0 0 0 2.0400 0.1300 0.1200 C 0 0 0 3 0 0 0.5800 -0.1800 0.0500 C 0 0 0 0 0 0 -0.1900 -1.7200 0.1500 S 0 0 0 0 0 0 -1.8300 -1.2000 -0.0100 C 0 0 0 1 0 0 -1.7400 0.1900 -0.1300 C 0 0 0 1 0 0 -0.4700 0.7200 -0.1000 C 0 0 0 0 0 0 -0.2100 2.4200 -0.2400 Cl 0 0 0 0 0 0 2.1900 1.1600 0.4900 H 0 0 0 0 0 0 2.4800 0.0400 -0.8800 H 0 0 0 0 0 0 2.5300 -0.5800 0.8000 H 0 0 0 0 0 0 -2.7400 -1.8100 -0.0100 H 0 0 0 0 0 0 -2.6500 0.8300 -0.2500 H 0 0 0 0 0 0 1 2 1 0 2 6 2 0 2 3 1 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 8 1 1 0 9 1 1 0 10 1 1 0 11 4 1 0 12 5 1 0 M END $$$$