TDT2MOL CCOC(=NS(=O)(=O)C)N1C2CCC3(CC(COC)C(COC)C3)CC21 58 60 0 0 0 0 0 5.0400 -0.1700 2.3100 C 0 0 0 3 0 0 4.8000 1.2900 2.0800 C 0 0 0 2 0 0 3.5200 1.4800 1.6900 O 0 0 0 0 0 0 3.3100 0.8200 0.5200 C 0 0 0 0 0 0 4.0100 1.1800 -0.4600 N 0 0 0 0 0 0 3.8100 0.3800 -2.0000 S 0 0 0 0 0 0 3.0900 -0.8600 -1.8100 O 0 0 0 0 0 0 3.0700 1.2400 -2.9000 O 0 0 0 0 0 0 5.4300 0.0300 -2.7100 C 0 0 0 3 0 0 2.3700 -0.1900 0.4200 N 0 0 0 0 0 0 1.6400 -1.1700 -0.2200 C 0 0 0 1 0 0 0.6500 -0.7300 -1.2200 C 0 0 0 2 0 0 -0.2900 0.3100 -0.7000 C 0 0 0 2 0 0 -0.8600 -0.1100 0.6200 C 0 0 0 0 0 0 -1.6400 -1.4100 0.5000 C 0 0 0 2 0 0 -3.0100 -1.0100 -0.0300 C 0 0 0 1 0 0 -3.2100 -1.4700 -1.4600 C 0 0 0 2 0 0 -2.2200 -0.9700 -2.2000 O 0 0 0 0 0 0 -2.5400 -0.0500 -3.1300 C 0 0 0 3 0 0 -3.1000 0.4900 0.1100 C 0 0 0 1 0 0 -4.4000 1.0100 0.6500 C 0 0 0 2 0 0 -4.6500 0.3800 1.8200 O 0 0 0 0 0 0 -5.8200 0.8300 2.3300 C 0 0 0 3 0 0 -1.9600 0.8500 1.0500 C 0 0 0 2 0 0 0.2500 -0.1600 1.6400 C 0 0 0 2 0 0 1.4200 -0.9000 1.1900 C 0 0 0 1 0 0 6.0800 -0.3200 2.6300 H 0 0 0 0 0 0 4.8600 -0.7200 1.3800 H 0 0 0 0 0 0 4.3600 -0.5300 3.1000 H 0 0 0 0 0 0 5.4800 1.6600 1.3000 H 0 0 0 0 0 0 4.9800 1.8500 3.0100 H 0 0 0 0 0 0 6.0000 -0.6200 -2.0300 H 0 0 0 0 0 0 5.3000 -0.4700 -3.6800 H 0 0 0 0 0 0 5.9800 0.9700 -2.8600 H 0 0 0 0 0 0 2.1900 -2.0700 -0.4800 H 0 0 0 0 0 0 1.1900 -0.3200 -2.1100 H 0 0 0 0 0 0 0.0800 -1.6000 -1.6000 H 0 0 0 0 0 0 -1.0900 0.4900 -1.4400 H 0 0 0 0 0 0 0.2300 1.2800 -0.5700 H 0 0 0 0 0 0 -1.1100 -2.1400 -0.1100 H 0 0 0 0 0 0 -1.7100 -1.8600 1.5200 H 0 0 0 0 0 0 -3.8200 -1.5000 0.5600 H 0 0 0 0 0 0 -3.1300 -2.5700 -1.4900 H 0 0 0 0 0 0 -4.2100 -1.1800 -1.8100 H 0 0 0 0 0 0 -2.8700 -0.5500 -4.0500 H 0 0 0 0 0 0 -1.6500 0.5600 -3.3600 H 0 0 0 0 0 0 -3.3400 0.6100 -2.7700 H 0 0 0 0 0 0 -2.9200 1.0100 -0.8500 H 0 0 0 0 0 0 -4.3300 2.0800 0.8300 H 0 0 0 0 0 0 -5.2100 0.7900 -0.0600 H 0 0 0 0 0 0 -6.0300 0.3100 3.2800 H 0 0 0 0 0 0 -5.7500 1.9100 2.5200 H 0 0 0 0 0 0 -6.6300 0.6300 1.6200 H 0 0 0 0 0 0 -1.6300 1.8900 0.9700 H 0 0 0 0 0 0 -2.2400 0.6300 2.0900 H 0 0 0 0 0 0 0.5200 0.8900 1.9000 H 0 0 0 0 0 0 -0.2000 -0.5800 2.5700 H 0 0 0 0 0 0 1.8800 -1.6000 1.8900 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 26 1 0 10 11 1 0 11 26 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 24 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 16 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 20 24 1 0 14 25 1 0 25 26 1 0 27 1 1 0 28 1 1 0 29 1 1 0 30 2 1 0 31 2 1 0 32 9 1 0 33 9 1 0 34 9 1 0 35 11 1 0 36 12 1 0 37 12 1 0 38 13 1 0 39 13 1 0 40 15 1 0 41 15 1 0 42 16 1 0 43 17 1 0 44 17 1 0 45 19 1 0 46 19 1 0 47 19 1 0 48 20 1 0 49 21 1 0 50 21 1 0 51 23 1 0 52 23 1 0 53 23 1 0 54 24 1 0 55 24 1 0 56 25 1 0 57 25 1 0 58 26 1 0 M END $$$$