TDT2MOL Fc1ccc(NC(=S)Nc2ccc(F)cc2)cc1 28 29 0 0 0 0 0 6.4700 -0.5600 0.6200 F 0 0 0 0 0 0 5.1800 -0.2300 0.3800 C 0 0 0 0 0 0 4.1500 -1.0900 0.7700 C 0 0 0 1 0 0 2.8100 -0.7600 0.5300 C 0 0 0 1 0 0 2.4900 0.4400 -0.1000 C 0 0 0 0 0 0 1.1900 0.8500 -0.3800 N 0 0 0 1 0 0 0.0000 0.1000 -0.0500 C 0 0 0 0 0 0 0.0600 -1.4000 0.7200 S 0 0 0 0 0 0 -1.2500 0.7200 -0.4400 N 0 0 0 1 0 0 -2.5200 0.1800 -0.2200 C 0 0 0 0 0 0 -3.6200 0.9400 -0.6700 C 0 0 0 1 0 0 -4.9200 0.4700 -0.4900 C 0 0 0 1 0 0 -5.1400 -0.7700 0.1400 C 0 0 0 0 0 0 -6.3900 -1.2300 0.3100 F 0 0 0 0 0 0 -4.0500 -1.5200 0.5800 C 0 0 0 1 0 0 -2.7400 -1.0500 0.4000 C 0 0 0 1 0 0 3.5300 1.3100 -0.5000 C 0 0 0 1 0 0 4.8600 0.9800 -0.2600 C 0 0 0 1 0 0 4.3900 -2.0400 1.2800 H 0 0 0 0 0 0 2.0300 -1.4600 0.8500 H 0 0 0 0 0 0 1.0600 1.7400 -0.8500 H 0 0 0 0 0 0 -1.2000 1.6200 -0.9000 H 0 0 0 0 0 0 -3.4400 1.9100 -1.1600 H 0 0 0 0 0 0 -5.7700 1.0700 -0.8400 H 0 0 0 0 0 0 -4.2100 -2.4900 1.0700 H 0 0 0 0 0 0 -1.9100 -1.6700 0.7600 H 0 0 0 0 0 0 3.2800 2.2600 -1.0000 H 0 0 0 0 0 0 5.6600 1.6600 -0.5700 H 0 0 0 0 0 0 1 2 1 0 2 18 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 16 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 13 15 1 0 15 16 2 0 5 17 1 0 17 18 2 0 19 3 1 0 20 4 1 0 21 6 1 0 22 9 1 0 23 11 1 0 24 12 1 0 25 15 1 0 26 16 1 0 27 17 1 0 28 18 1 0 M END $$$$