TDT2MOL OC(=O)n1cnc2sc3CCCCCc3c2c1=O 30 32 0 0 0 0 0 4.2000 -0.7900 -2.0200 O 0 0 0 1 0 0 4.4100 -0.9100 -0.7000 C 0 0 0 0 0 0 5.5300 -1.2400 -0.2600 O 0 0 0 0 0 0 3.3300 -0.6400 0.2400 N 0 0 0 0 0 0 3.5700 -0.7600 1.6100 C 0 0 0 1 0 0 2.5200 -0.4900 2.5000 N 0 0 0 0 0 0 1.2900 -0.1200 1.9800 C 0 0 0 0 0 0 -0.1800 0.2700 2.7700 S 0 0 0 0 0 0 -1.1200 0.6000 1.3500 C 0 0 0 0 0 0 -2.5600 1.0200 1.2800 C 0 0 0 2 0 0 -3.4000 0.0500 0.5200 C 0 0 0 2 0 0 -3.2400 0.1600 -0.9700 C 0 0 0 2 0 0 -1.9000 -0.3100 -1.4600 C 0 0 0 2 0 0 -0.7700 0.6000 -1.1300 C 0 0 0 2 0 0 -0.2500 0.3900 0.2900 C 0 0 0 0 0 0 1.0300 0.0100 0.6200 C 0 0 0 0 0 0 2.0800 -0.2600 -0.2700 C 0 0 0 0 0 0 1.9500 -0.1700 -1.5100 O 0 0 0 0 0 0 4.1600 0.1300 -2.2600 H 0 0 0 0 0 0 4.5500 -1.0600 1.9800 H 0 0 0 0 0 0 -2.8900 1.1200 2.3400 H 0 0 0 0 0 0 -2.6100 2.0200 0.8200 H 0 0 0 0 0 0 -3.1600 -0.9900 0.8200 H 0 0 0 0 0 0 -4.4700 0.2200 0.7900 H 0 0 0 0 0 0 -3.3700 1.2200 -1.2600 H 0 0 0 0 0 0 -4.0500 -0.4200 -1.4600 H 0 0 0 0 0 0 -1.9500 -0.4300 -2.5700 H 0 0 0 0 0 0 -1.7300 -1.3300 -1.0600 H 0 0 0 0 0 0 -1.0800 1.6600 -1.2100 H 0 0 0 0 0 0 0.1000 0.4700 -1.7900 H 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 17 1 0 4 5 1 0 5 6 2 0 6 7 1 0 7 16 2 0 7 8 1 0 8 9 1 0 9 15 2 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 19 1 1 0 20 5 1 0 21 10 1 0 22 10 1 0 23 11 1 0 24 11 1 0 25 12 1 0 26 12 1 0 27 13 1 0 28 13 1 0 29 14 1 0 30 14 1 0 M END $$$$