TDT2MOL NC(=S)c1nc[nH]c1S*21F] 14 14 0 0 0 0 0 2.0800 1.2300 0.2000 N 0 0 0 2 0 0 1.4800 0.1500 0.9700 C 0 0 0 0 0 0 2.2400 -0.4300 2.3700 S 0 0 0 0 0 0 0.1800 -0.4400 0.5200 C 0 0 0 0 0 0 -0.5200 -1.4800 1.1500 N 0 0 0 0 0 0 -1.6800 -1.7300 0.4100 C 0 0 0 1 0 0 -1.7000 -0.8500 -0.6800 N 0 0 0 1 0 0 -0.5500 -0.0500 -0.6100 C 0 0 0 0 0 0 -0.1000 1.2400 -1.7800 S 0 0 0 0 0 0 -1.1500 2.4400 -1.6800 R 0 0 0 0 0 0 1.6300 1.5700 -0.6200 H 0 0 0 0 0 0 2.9500 1.6300 0.5000 H 0 0 0 0 0 0 -2.4400 -2.4900 0.6400 H 0 0 0 0 0 0 -2.4100 -0.8000 -1.3800 H 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 8 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 11 1 1 0 12 1 1 0 13 6 1 0 14 7 1 0 M END $$$$