TDT2MOL CC1=CCC2(O)C(C)(C)C1C3CC4(C)C(O)CC=C(CO)C4C2(O)O3 55 58 0 0 0 0 0 -3.7500 2.5700 -0.2300 C 0 0 0 3 0 0 -2.9000 1.4500 0.2800 C 0 0 0 0 0 0 -2.8500 1.1400 1.5900 C 0 0 0 1 0 0 -2.0100 0.0200 2.1400 C 0 0 0 2 0 0 -1.1500 -0.6700 1.1000 C 0 0 0 0 0 0 -0.7800 -1.8900 1.5400 O 0 0 0 1 0 0 -1.9400 -0.7700 -0.1800 C 0 0 0 0 0 0 -3.3700 -1.2400 0.1500 C 0 0 0 3 0 0 -1.4300 -1.7400 -1.1700 C 0 0 0 3 0 0 -2.0500 0.6400 -0.7100 C 0 0 0 1 0 0 -0.7000 1.3300 -0.8100 C 0 0 0 1 0 0 0.2600 0.7800 -1.8000 C 0 0 0 2 0 0 1.5800 0.3200 -1.1500 C 0 0 0 0 0 0 2.2900 -0.5800 -2.1400 C 0 0 0 3 0 0 2.4400 1.5100 -0.7900 C 0 0 0 1 0 0 3.6900 1.5200 -1.3700 O 0 0 0 1 0 0 2.7000 1.6600 0.7000 C 0 0 0 2 0 0 3.2900 0.3400 1.1300 C 0 0 0 1 0 0 2.5600 -0.7500 0.8200 C 0 0 0 0 0 0 2.9800 -2.1400 1.1600 C 0 0 0 2 0 0 2.9100 -2.9200 0.0700 O 0 0 0 1 0 0 1.2100 -0.5200 0.0900 C 0 0 0 1 0 0 0.1500 0.1100 0.9100 C 0 0 0 0 0 0 0.6200 0.3900 2.1900 O 0 0 0 1 0 0 -0.2000 1.3500 0.4700 O 0 0 0 0 0 0 -4.7000 2.6000 0.3400 H 0 0 0 0 0 0 -3.9800 2.4000 -1.2900 H 0 0 0 0 0 0 -3.2200 3.5200 -0.1100 H 0 0 0 0 0 0 -3.4600 1.7300 2.3000 H 0 0 0 0 0 0 -2.7400 -0.7000 2.5600 H 0 0 0 0 0 0 -1.4100 0.3900 2.9800 H 0 0 0 0 0 0 -0.4900 -2.4600 0.8500 H 0 0 0 0 0 0 -3.9800 -1.2300 -0.7600 H 0 0 0 0 0 0 -3.3200 -2.2400 0.5900 H 0 0 0 0 0 0 -3.8100 -0.5500 0.8800 H 0 0 0 0 0 0 -2.0400 -1.6600 -2.1000 H 0 0 0 0 0 0 -0.3900 -1.6500 -1.4900 H 0 0 0 0 0 0 -1.5300 -2.7900 -0.8100 H 0 0 0 0 0 0 -2.5500 0.6500 -1.6800 H 0 0 0 0 0 0 -0.9000 2.4100 -1.0200 H 0 0 0 0 0 0 -0.2100 0.0100 -2.4400 H 0 0 0 0 0 0 0.5900 1.5200 -2.5900 H 0 0 0 0 0 0 1.6400 -1.4300 -2.3900 H 0 0 0 0 0 0 3.2200 -0.9400 -1.6800 H 0 0 0 0 0 0 2.5100 0.0100 -3.0400 H 0 0 0 0 0 0 2.0200 2.4900 -1.1000 H 0 0 0 0 0 0 4.1500 0.7300 -1.1000 H 0 0 0 0 0 0 1.7300 1.7800 1.2200 H 0 0 0 0 0 0 3.3600 2.4800 0.9500 H 0 0 0 0 0 0 4.2500 0.2800 1.6500 H 0 0 0 0 0 0 4.0200 -2.1300 1.5400 H 0 0 0 0 0 0 2.3200 -2.5500 1.9400 H 0 0 0 0 0 0 3.5000 -2.6000 -0.6000 H 0 0 0 0 0 0 0.9800 -1.5600 -0.1500 H 0 0 0 0 0 0 0.8900 -0.4400 2.5600 H 0 0 0 0 0 0 1 2 1 0 2 10 1 0 2 3 2 0 3 4 1 0 4 5 1 0 5 23 1 0 5 6 1 0 5 7 1 0 7 8 1 0 7 9 1 0 7 10 1 0 10 11 1 0 11 25 1 0 11 12 1 0 12 13 1 0 13 22 1 0 13 14 1 0 13 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 19 22 1 0 22 23 1 0 23 24 1 0 23 25 1 0 26 1 1 0 27 1 1 0 28 1 1 0 29 3 1 0 30 4 1 0 31 4 1 0 32 6 1 0 33 8 1 0 34 8 1 0 35 8 1 0 36 9 1 0 37 9 1 0 38 9 1 0 39 10 1 0 40 11 1 0 41 12 1 0 42 12 1 0 43 14 1 0 44 14 1 0 45 14 1 0 46 15 1 0 47 16 1 0 48 17 1 0 49 17 1 0 50 18 1 0 51 20 1 0 52 20 1 0 53 21 1 0 54 22 1 0 55 24 1 0 M END $$$$