TDT2MOL CCOC(=O)CCC(=O)CC(=O)c1ccccc1 34 34 0 0 0 0 0 -5.5200 -0.0300 -0.0900 C 0 0 0 3 0 0 -4.7800 1.2800 0.0300 C 0 0 0 2 0 0 -3.6200 1.2000 -0.6600 O 0 0 0 0 0 0 -2.8700 0.2100 -0.1300 C 0 0 0 0 0 0 -3.0500 -0.1100 1.0600 O 0 0 0 0 0 0 -1.8300 -0.4800 -0.9600 C 0 0 0 2 0 0 -1.1500 -1.5300 -0.1400 C 0 0 0 2 0 0 -0.4600 -0.8900 1.0300 C 0 0 0 0 0 0 -0.8900 -1.1000 2.1900 O 0 0 0 0 0 0 0.7200 0.0100 0.8200 C 0 0 0 2 0 0 1.8000 -0.7400 0.1000 C 0 0 0 0 0 0 1.5600 -1.8600 -0.4000 O 0 0 0 0 0 0 3.1800 -0.1500 -0.0100 C 0 0 0 0 0 0 3.4600 1.1000 0.5500 C 0 0 0 1 0 0 4.7400 1.6400 0.4400 C 0 0 0 1 0 0 5.7400 0.9400 -0.2300 C 0 0 0 1 0 0 5.4600 -0.3100 -0.8000 C 0 0 0 1 0 0 4.1800 -0.8600 -0.6900 C 0 0 0 1 0 0 -5.7400 -0.2300 -1.1500 H 0 0 0 0 0 0 -6.4700 0.0400 0.4700 H 0 0 0 0 0 0 -4.9000 -0.8400 0.3200 H 0 0 0 0 0 0 -5.4000 2.0800 -0.3900 H 0 0 0 0 0 0 -4.5800 1.4900 1.0800 H 0 0 0 0 0 0 -1.0900 0.2500 -1.3200 H 0 0 0 0 0 0 -2.3200 -0.9600 -1.8300 H 0 0 0 0 0 0 -0.4000 -2.0500 -0.7500 H 0 0 0 0 0 0 -1.8900 -2.2600 0.2200 H 0 0 0 0 0 0 1.1000 0.3500 1.8000 H 0 0 0 0 0 0 0.4100 0.8800 0.2200 H 0 0 0 0 0 0 2.6700 1.6500 1.0900 H 0 0 0 0 0 0 4.9600 2.6300 0.8900 H 0 0 0 0 0 0 6.7500 1.3700 -0.3200 H 0 0 0 0 0 0 6.2500 -0.8600 -1.3300 H 0 0 0 0 0 0 3.9600 -1.8400 -1.1300 H 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 18 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 19 1 1 0 20 1 1 0 21 1 1 0 22 2 1 0 23 2 1 0 24 6 1 0 25 6 1 0 26 7 1 0 27 7 1 0 28 10 1 0 29 10 1 0 30 14 1 0 31 15 1 0 32 16 1 0 33 17 1 0 34 18 1 0 M END $$$$