TDT2MOL NNN=C1CCSC1 17 17 0 0 0 0 0 -3.2500 -0.0700 -0.3400 N 0 0 0 2 0 0 -2.2700 -0.5700 0.6400 N 0 0 0 1 0 0 -0.9300 -0.2800 0.5200 N 0 0 0 0 0 0 0.2300 -0.0200 0.4100 C 0 0 0 0 0 0 1.1800 -0.9400 -0.3600 C 0 0 0 2 0 0 2.2000 -0.1100 -1.0500 C 0 0 0 2 0 0 2.3900 1.3800 0.0300 S 0 0 0 0 0 0 0.8500 1.2200 1.0000 C 0 0 0 2 0 0 -3.5100 0.8600 -0.0800 H 0 0 0 0 0 0 -2.8100 -0.0500 -1.2400 H 0 0 0 0 0 0 -2.6600 -1.1000 1.4100 H 0 0 0 0 0 0 1.6400 -1.6100 0.4000 H 0 0 0 0 0 0 0.5800 -1.5600 -1.0400 H 0 0 0 0 0 0 1.8500 0.2600 -2.0200 H 0 0 0 0 0 0 3.1800 -0.5800 -1.1600 H 0 0 0 0 0 0 0.2200 2.0900 0.8300 H 0 0 0 0 0 0 1.1000 1.0700 2.0500 H 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 8 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 9 1 1 0 10 1 1 0 11 2 1 0 12 5 1 0 13 5 1 0 14 6 1 0 15 6 1 0 16 8 1 0 17 8 1 0 M END $$$$