TDT2MOL O=c1n2CCSc2nc3ccccc13 22 24 0 0 0 0 0 0.5800 -2.1900 -0.4600 O 0 0 0 0 0 0 0.3600 -0.9900 -0.1900 C 0 0 0 0 0 0 1.4000 -0.1000 0.0300 N 0 0 0 0 0 0 2.8200 -0.4700 -0.0400 C 0 0 0 2 0 0 3.7400 0.7100 -0.0200 C 0 0 0 2 0 0 2.6700 2.1500 0.5500 S 0 0 0 0 0 0 1.1000 1.2500 0.3400 C 0 0 0 0 0 0 -0.1800 1.7300 0.4400 N 0 0 0 0 0 0 -1.2300 0.8200 0.2200 C 0 0 0 0 0 0 -2.5500 1.2700 0.3100 C 0 0 0 1 0 0 -3.6100 0.3700 0.0900 C 0 0 0 1 0 0 -3.3400 -0.9700 -0.2100 C 0 0 0 1 0 0 -2.0200 -1.4100 -0.3100 C 0 0 0 1 0 0 -0.9600 -0.5200 -0.0900 C 0 0 0 0 0 0 2.9900 -1.1400 0.8300 H 0 0 0 0 0 0 2.9400 -1.0900 -0.9500 H 0 0 0 0 0 0 4.0900 1.0300 -1.0000 H 0 0 0 0 0 0 4.5600 0.6700 0.6900 H 0 0 0 0 0 0 -2.7600 2.3200 0.5500 H 0 0 0 0 0 0 -4.6400 0.7300 0.1700 H 0 0 0 0 0 0 -4.1700 -1.6700 -0.3800 H 0 0 0 0 0 0 -1.8100 -2.4700 -0.5500 H 0 0 0 0 0 0 1 2 2 0 2 14 1 0 2 3 1 0 3 7 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 14 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 15 4 1 0 16 4 1 0 17 5 1 0 18 5 1 0 19 10 1 0 20 11 1 0 21 12 1 0 22 13 1 0 M END $$$$