TDT2MOL COC(=O)C1=C(SC(=C2SC3C4CC(C3S2)C5C4C(=O)C6C7CC(C=C7)C6C5=O)S1)C(=O)OC 56 62 0 0 0 0 0 -8.4200 1.0600 -1.9500 C 0 0 0 3 0 0 -7.4500 0.2200 -1.5200 O 0 0 0 0 0 0 -6.2800 0.8800 -1.4400 C 0 0 0 0 0 0 -6.1700 2.0000 -2.0100 O 0 0 0 0 0 0 -5.1200 0.3200 -0.6900 C 0 0 0 0 0 0 -5.1200 -0.8700 -0.0500 C 0 0 0 0 0 0 -3.5300 -1.3100 0.8000 S 0 0 0 0 0 0 -2.5600 0.2000 0.4800 C 0 0 0 0 0 0 -1.3800 0.4800 0.9500 C 0 0 0 0 0 0 -0.3700 -0.5800 2.0600 S 0 0 0 0 0 0 0.9400 0.5500 2.5900 C 0 0 0 1 0 0 2.3200 -0.0200 2.2700 C 0 0 0 1 0 0 3.1700 1.2700 2.2500 C 0 0 0 2 0 0 2.2900 1.9600 1.2000 C 0 0 0 1 0 0 0.9200 1.8800 1.8600 C 0 0 0 1 0 0 -0.4100 2.0000 0.6300 S 0 0 0 0 0 0 2.3200 0.9200 0.0700 C 0 0 0 1 0 0 2.3300 -0.4000 0.7900 C 0 0 0 1 0 0 3.5600 -1.2300 0.5300 C 0 0 0 0 0 0 4.0400 -1.9100 1.4600 O 0 0 0 0 0 0 4.2000 -1.2600 -0.8200 C 0 0 0 1 0 0 5.6900 -1.6100 -0.7200 C 0 0 0 1 0 0 6.2100 -1.0500 -2.0500 C 0 0 0 2 0 0 5.6700 0.3700 -1.7900 C 0 0 0 1 0 0 6.2700 0.6300 -0.3900 C 0 0 0 1 0 0 6.2800 -0.5800 0.2600 C 0 0 0 1 0 0 4.1900 0.0700 -1.5400 C 0 0 0 1 0 0 3.5400 1.1800 -0.7800 C 0 0 0 0 0 0 4.0100 2.3400 -0.8300 O 0 0 0 0 0 0 -3.5500 1.2800 -0.6300 S 0 0 0 0 0 0 -6.2700 -1.8000 0.0400 C 0 0 0 0 0 0 -6.1500 -2.8800 0.6600 O 0 0 0 0 0 0 -7.4500 -1.5300 -0.5600 O 0 0 0 0 0 0 -8.4200 -2.2500 0.0400 C 0 0 0 3 0 0 -8.5100 1.9000 -1.2500 H 0 0 0 0 0 0 -8.1400 1.4500 -2.9500 H 0 0 0 0 0 0 -9.3700 0.5200 -2.0200 H 0 0 0 0 0 0 0.8400 0.6600 3.6800 H 0 0 0 0 0 0 2.6800 -0.7500 2.9600 H 0 0 0 0 0 0 3.1800 1.7900 3.2000 H 0 0 0 0 0 0 4.1900 1.0900 1.9100 H 0 0 0 0 0 0 2.6200 2.9400 0.9500 H 0 0 0 0 0 0 0.8000 2.7500 2.5300 H 0 0 0 0 0 0 1.4500 1.0700 -0.5800 H 0 0 0 0 0 0 1.4700 -1.0400 0.5700 H 0 0 0 0 0 0 3.7300 -2.0700 -1.4000 H 0 0 0 0 0 0 5.9400 -2.6200 -0.5200 H 0 0 0 0 0 0 7.2900 -1.0700 -2.1200 H 0 0 0 0 0 0 5.7600 -1.5200 -2.9200 H 0 0 0 0 0 0 5.9100 1.0900 -2.5200 H 0 0 0 0 0 0 6.6100 1.5700 -0.0200 H 0 0 0 0 0 0 6.6300 -0.7800 1.2500 H 0 0 0 0 0 0 3.7100 0.0300 -2.5400 H 0 0 0 0 0 0 -9.3900 -2.0200 -0.4400 H 0 0 0 0 0 0 -8.4700 -1.9900 1.1100 H 0 0 0 0 0 0 -8.2000 -3.3200 -0.0700 H 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 30 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 2 0 9 16 1 0 9 10 1 0 10 11 1 0 11 15 1 0 11 12 1 0 12 18 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 14 17 1 0 17 28 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 21 27 1 0 21 22 1 0 22 26 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 24 27 1 0 27 28 1 0 28 29 2 0 8 30 1 0 6 31 1 0 31 32 2 0 31 33 1 0 33 34 1 0 35 1 1 0 36 1 1 0 37 1 1 0 38 11 1 0 39 12 1 0 40 13 1 0 41 13 1 0 42 14 1 0 43 15 1 0 44 17 1 0 45 18 1 0 46 21 1 0 47 22 1 0 48 23 1 0 49 23 1 0 50 24 1 0 51 25 1 0 52 26 1 0 53 27 1 0 54 34 1 0 55 34 1 0 56 34 1 0 M END $$$$