TDT2MOL NC(=S)CC(=O)*21F] 11 10 0 0 0 0 0 -1.8600 -0.7000 0.2900 N 0 0 0 2 0 0 -0.7300 0.1800 0.1000 C 0 0 0 0 0 0 -0.9500 1.8700 0.1300 S 0 0 0 0 0 0 0.6300 -0.3900 -0.1300 C 0 0 0 2 0 0 1.6400 0.7200 -0.2200 C 0 0 0 0 0 0 1.2600 1.9100 -0.1500 O 0 0 0 0 0 0 2.9900 0.4300 -0.3800 R 0 0 0 0 0 0 -2.7800 -0.3200 0.4400 H 0 0 0 0 0 0 -1.7300 -1.6900 0.2700 H 0 0 0 0 0 0 0.6400 -0.9700 -1.0700 H 0 0 0 0 0 0 0.9000 -1.0500 0.7100 H 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 8 1 1 0 9 1 1 0 10 4 1 0 11 4 1 0 M END $$$$