TDT2MOL CC1(C)C2(C)CCC1(OC2=O)C(=O)OCC3CCCC4(C)CC5OC34C(=O)C6CCC(=O)C5C6(C)C 76 81 0 0 0 0 0 5.1300 1.4300 -0.0300 C 0 0 0 3 0 0 4.7900 0.0100 0.1500 C 0 0 0 0 0 0 4.4200 -0.2900 1.5600 C 0 0 0 3 0 0 5.7800 -0.9700 -0.4400 C 0 0 0 0 0 0 7.0300 -1.2100 0.2200 C 0 0 0 3 0 0 5.8000 -0.5700 -1.9200 C 0 0 0 2 0 0 4.3600 -0.1900 -2.2000 C 0 0 0 2 0 0 3.6900 -0.4800 -0.8300 C 0 0 0 0 0 0 3.4600 -1.6900 -0.6300 O 0 0 0 0 0 0 4.7900 -2.1600 -0.4400 C 0 0 0 0 0 0 4.7900 -3.0500 -0.3700 O 0 0 0 0 0 0 2.4800 0.3300 -0.5900 C 0 0 0 0 0 0 2.3700 1.0400 0.4300 O 0 0 0 0 0 0 1.4600 0.3500 -1.4700 O 0 0 0 0 0 0 0.3200 0.8100 -0.9000 C 0 0 0 2 0 0 -0.3300 -0.2300 -0.0300 C 0 0 0 1 0 0 0.5400 -0.5400 1.1500 C 0 0 0 2 0 0 0.5000 0.6100 2.1200 C 0 0 0 2 0 0 -0.9000 0.8000 2.6200 C 0 0 0 2 0 0 -1.8100 1.2000 1.4900 C 0 0 0 0 0 0 -1.5600 2.6100 1.0900 C 0 0 0 3 0 0 -3.2800 0.9800 1.8900 C 0 0 0 2 0 0 -3.5300 -0.4600 1.4900 C 0 0 0 1 0 0 -2.3200 -0.9100 0.9900 O 0 0 0 0 0 0 -1.7100 0.1600 0.3900 C 0 0 0 0 0 0 -2.5000 0.5300 -0.8200 C 0 0 0 0 0 0 -2.2300 1.6700 -1.3400 O 0 0 0 0 0 0 -3.5700 -0.2000 -1.5800 C 0 0 0 1 0 0 -4.5800 0.8600 -2.0100 C 0 0 0 2 0 0 -5.2400 1.4600 -0.8200 C 0 0 0 2 0 0 -5.5100 0.4900 0.2900 C 0 0 0 0 0 0 -6.4800 0.6900 1.0600 O 0 0 0 0 0 0 -4.6500 -0.7500 0.5600 C 0 0 0 1 0 0 -4.2700 -1.2800 -0.8100 C 0 0 0 0 0 0 -3.4000 -2.5000 -0.7000 C 0 0 0 3 0 0 -5.5500 -1.6900 -1.5400 C 0 0 0 3 0 0 4.2600 2.0500 0.2300 H 0 0 0 0 0 0 5.9700 1.6900 0.6400 H 0 0 0 0 0 0 5.4300 1.6500 -1.0600 H 0 0 0 0 0 0 4.1400 -1.3500 1.6600 H 0 0 0 0 0 0 3.5700 0.3400 1.8600 H 0 0 0 0 0 0 5.2800 -0.0900 2.2100 H 0 0 0 0 0 0 7.3700 -2.2600 0.1100 H 0 0 0 0 0 0 6.9700 -1.0000 1.3100 H 0 0 0 0 0 0 7.8400 -0.5700 -0.1900 H 0 0 0 0 0 0 6.5100 0.2600 -2.0000 H 0 0 0 0 0 0 6.1700 -1.4000 -2.5200 H 0 0 0 0 0 0 4.2400 0.8700 -2.4600 H 0 0 0 0 0 0 3.8800 -0.8000 -2.9600 H 0 0 0 0 0 0 -0.3700 1.0600 -1.7300 H 0 0 0 0 0 0 0.5200 1.7300 -0.3400 H 0 0 0 0 0 0 -0.4200 -1.1500 -0.6600 H 0 0 0 0 0 0 0.1700 -1.4500 1.6700 H 0 0 0 0 0 0 1.5700 -0.7400 0.8300 H 0 0 0 0 0 0 0.8500 1.5200 1.6200 H 0 0 0 0 0 0 1.1700 0.3800 2.9700 H 0 0 0 0 0 0 -0.9200 1.5600 3.4100 H 0 0 0 0 0 0 -1.2300 -0.1600 3.0800 H 0 0 0 0 0 0 -1.9000 3.2600 1.9400 H 0 0 0 0 0 0 -0.5000 2.8200 0.9400 H 0 0 0 0 0 0 -2.1500 2.8900 0.2100 H 0 0 0 0 0 0 -3.4400 1.2300 2.9500 H 0 0 0 0 0 0 -3.9400 1.6400 1.3200 H 0 0 0 0 0 0 -3.5800 -1.0700 2.4400 H 0 0 0 0 0 0 -3.1000 -0.6100 -2.4900 H 0 0 0 0 0 0 -4.0700 1.6200 -2.6400 H 0 0 0 0 0 0 -5.3000 0.3700 -2.6900 H 0 0 0 0 0 0 -6.2200 1.9200 -1.0900 H 0 0 0 0 0 0 -4.6300 2.3000 -0.4100 H 0 0 0 0 0 0 -5.3900 -1.4500 1.0100 H 0 0 0 0 0 0 -2.3700 -2.2600 -0.4100 H 0 0 0 0 0 0 -3.3100 -3.0200 -1.6800 H 0 0 0 0 0 0 -3.8300 -3.2100 0.0200 H 0 0 0 0 0 0 -6.0000 -2.5500 -1.0100 H 0 0 0 0 0 0 -5.2900 -1.9800 -2.5600 H 0 0 0 0 0 0 -6.2800 -0.8800 -1.5300 H 0 0 0 0 0 0 1 2 1 0 2 8 1 0 2 3 1 0 2 4 1 0 4 10 1 0 4 5 1 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 8 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 16 25 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 25 1 0 20 21 1 0 20 22 1 0 22 23 1 0 23 33 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 28 34 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 31 33 1 0 33 34 1 0 34 35 1 0 34 36 1 0 37 1 1 0 38 1 1 0 39 1 1 0 40 3 1 0 41 3 1 0 42 3 1 0 43 5 1 0 44 5 1 0 45 5 1 0 46 6 1 0 47 6 1 0 48 7 1 0 49 7 1 0 50 15 1 0 51 15 1 0 52 16 1 0 53 17 1 0 54 17 1 0 55 18 1 0 56 18 1 0 57 19 1 0 58 19 1 0 59 21 1 0 60 21 1 0 61 21 1 0 62 22 1 0 63 22 1 0 64 23 1 0 65 28 1 0 66 29 1 0 67 29 1 0 68 30 1 0 69 30 1 0 70 33 1 0 71 35 1 0 72 35 1 0 73 35 1 0 74 36 1 0 75 36 1 0 76 36 1 0 M END $$$$