TDT2MOL CCOC(=NS(=O)(=O)C)N1C2CCC3(CCCC3)CC21 44 46 0 0 0 0 0 4.9600 1.3700 1.6100 C 0 0 0 3 0 0 3.5600 1.6500 2.0900 C 0 0 0 2 0 0 2.8200 0.5300 2.0300 O 0 0 0 0 0 0 2.4200 0.2400 0.7700 C 0 0 0 0 0 0 3.2800 0.1500 -0.1300 N 0 0 0 0 0 0 2.8700 -0.2200 -1.7800 S 0 0 0 0 0 0 1.4300 -0.2400 -1.9400 O 0 0 0 0 0 0 3.4300 0.8000 -2.6600 O 0 0 0 0 0 0 3.5500 -1.8300 -2.2300 C 0 0 0 3 0 0 1.0800 0.0300 0.5100 N 0 0 0 0 0 0 -0.1100 0.0100 1.1000 C 0 0 0 1 0 0 -1.1200 -0.9700 1.5100 C 0 0 0 2 0 0 -2.1500 -1.2700 0.4500 C 0 0 0 2 0 0 -2.3100 -0.0600 -0.4800 C 0 0 0 0 0 0 -3.4100 -0.3800 -1.4800 C 0 0 0 2 0 0 -4.6700 -0.4000 -0.6400 C 0 0 0 2 0 0 -4.4000 0.5000 0.5400 C 0 0 0 2 0 0 -3.0000 1.0300 0.3600 C 0 0 0 2 0 0 -1.0000 0.3400 -1.0800 C 0 0 0 2 0 0 0.1700 -0.2400 -0.4000 C 0 0 0 1 0 0 4.9300 1.0400 0.5600 H 0 0 0 0 0 0 5.4100 0.5700 2.2200 H 0 0 0 0 0 0 5.5700 2.2800 1.6900 H 0 0 0 0 0 0 3.6100 1.9800 3.1400 H 0 0 0 0 0 0 3.1200 2.4600 1.4900 H 0 0 0 0 0 0 3.1300 -2.6000 -1.5700 H 0 0 0 0 0 0 4.6400 -1.8100 -2.1200 H 0 0 0 0 0 0 3.2900 -2.0600 -3.2800 H 0 0 0 0 0 0 -0.4100 1.0500 1.3100 H 0 0 0 0 0 0 -0.5800 -1.9100 1.8100 H 0 0 0 0 0 0 -1.6200 -0.6500 2.4600 H 0 0 0 0 0 0 -3.1200 -1.5900 0.8500 H 0 0 0 0 0 0 -1.7900 -2.0800 -0.2300 H 0 0 0 0 0 0 -3.1800 -1.3100 -2.0100 H 0 0 0 0 0 0 -3.4100 0.4500 -2.2100 H 0 0 0 0 0 0 -5.5400 -0.0900 -1.2400 H 0 0 0 0 0 0 -4.8900 -1.4500 -0.3400 H 0 0 0 0 0 0 -4.4700 -0.0400 1.5100 H 0 0 0 0 0 0 -5.1200 1.3300 0.6300 H 0 0 0 0 0 0 -2.9800 1.9500 -0.2600 H 0 0 0 0 0 0 -2.4400 1.2200 1.2800 H 0 0 0 0 0 0 -0.8600 1.4500 -1.0400 H 0 0 0 0 0 0 -0.9500 0.1100 -2.1700 H 0 0 0 0 0 0 0.2300 -1.3200 -0.6400 H 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 6 8 2 0 6 9 1 0 4 10 1 0 10 20 1 0 10 11 1 0 11 20 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 18 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 14 19 1 0 19 20 1 0 21 1 1 0 22 1 1 0 23 1 1 0 24 2 1 0 25 2 1 0 26 9 1 0 27 9 1 0 28 9 1 0 29 11 1 0 30 12 1 0 31 12 1 0 32 13 1 0 33 13 1 0 34 15 1 0 35 15 1 0 36 16 1 0 37 16 1 0 38 17 1 0 39 17 1 0 40 18 1 0 41 18 1 0 42 19 1 0 43 19 1 0 44 20 1 0 M END $$$$