TDT2MOL S=c1sc2cscc2s1 11 12 0 0 0 0 0 3.9700 0.6800 -0.8200 S 0 0 0 0 0 0 2.3400 0.4000 -0.4800 C 0 0 0 0 0 0 1.2300 1.4000 0.3600 S 0 0 0 0 0 0 -0.2400 0.5600 0.3600 C 0 0 0 0 0 0 -1.4700 0.9200 0.9100 C 0 0 0 1 0 0 -2.4900 -0.4200 0.5100 S 0 0 0 0 0 0 -1.3300 -1.3900 -0.3300 C 0 0 0 1 0 0 -0.1700 -0.6300 -0.2800 C 0 0 0 0 0 0 1.3700 -0.9500 -0.9000 S 0 0 0 0 0 0 -1.7300 1.8300 1.4600 H 0 0 0 0 0 0 -1.4800 -2.3700 -0.8000 H 0 0 0 0 0 0 1 2 2 0 2 9 1 0 2 3 1 0 3 4 1 0 4 8 1 0 4 5 2 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 10 5 1 0 11 7 1 0 M END $$$$