TDT2MOL O=c1n2CCCSc2nc3ccccc13 25 27 0 0 0 0 0 -0.0400 1.8300 1.3900 O 0 0 0 0 0 0 0.1700 0.8300 0.6700 C 0 0 0 0 0 0 -0.9200 0.0500 0.2200 N 0 0 0 0 0 0 -2.2300 0.4800 0.6500 C 0 0 0 2 0 0 -3.3700 0.2700 -0.3000 C 0 0 0 2 0 0 -3.5700 -1.2100 -0.5100 C 0 0 0 2 0 0 -2.0700 -2.0100 -1.1300 S 0 0 0 0 0 0 -0.6300 -1.0700 -0.5800 C 0 0 0 0 0 0 0.6700 -1.4100 -0.9300 N 0 0 0 0 0 0 1.7400 -0.6300 -0.4800 C 0 0 0 0 0 0 3.0500 -0.9700 -0.8300 C 0 0 0 1 0 0 4.1100 -0.1800 -0.3700 C 0 0 0 1 0 0 3.8600 0.9400 0.4300 C 0 0 0 1 0 0 2.5500 1.2700 0.7800 C 0 0 0 1 0 0 1.4800 0.4900 0.3200 C 0 0 0 0 0 0 -2.1500 1.5700 0.8600 H 0 0 0 0 0 0 -2.4600 -0.0200 1.6100 H 0 0 0 0 0 0 -3.1300 0.7400 -1.2600 H 0 0 0 0 0 0 -4.2900 0.7000 0.1100 H 0 0 0 0 0 0 -4.3800 -1.3700 -1.2200 H 0 0 0 0 0 0 -3.8300 -1.6800 0.4500 H 0 0 0 0 0 0 3.2400 -1.8500 -1.4600 H 0 0 0 0 0 0 5.1500 -0.4500 -0.6400 H 0 0 0 0 0 0 4.7000 1.5500 0.7900 H 0 0 0 0 0 0 2.3500 2.1500 1.4100 H 0 0 0 0 0 0 1 2 2 0 2 15 1 0 2 3 1 0 3 8 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 15 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 16 4 1 0 17 4 1 0 18 5 1 0 19 5 1 0 20 6 1 0 21 6 1 0 22 11 1 0 23 12 1 0 24 13 1 0 25 14 1 0 M END $$$$