TDT2MOL CCCCCC1CCCC2(CCCC(=O)C2CCCC)N1 56 57 0 0 0 0 0 5.3600 -0.4400 -0.3800 C 0 0 0 3 0 0 4.9000 0.8500 -0.9800 C 0 0 0 2 0 0 4.5700 1.8500 0.0900 C 0 0 0 2 0 0 3.5300 1.3200 1.0200 C 0 0 0 2 0 0 2.2600 1.0000 0.2800 C 0 0 0 2 0 0 1.1600 0.5800 1.2200 C 0 0 0 1 0 0 1.4500 -0.7400 1.8600 C 0 0 0 2 0 0 1.1300 -1.8600 0.9000 C 0 0 0 2 0 0 -0.3400 -1.7900 0.5600 C 0 0 0 2 0 0 -0.6400 -0.5100 -0.1400 C 0 0 0 0 0 0 -0.0600 -0.5100 -1.5300 C 0 0 0 2 0 0 -0.6300 -1.6100 -2.3900 C 0 0 0 2 0 0 -2.1200 -1.5300 -2.4800 C 0 0 0 2 0 0 -2.6800 -1.4500 -1.0800 C 0 0 0 0 0 0 -3.5200 -2.2500 -0.6500 O 0 0 0 0 0 0 -2.1400 -0.3100 -0.2500 C 0 0 0 1 0 0 -2.8100 -0.2400 1.0700 C 0 0 0 2 0 0 -4.2500 0.1600 0.9600 C 0 0 0 2 0 0 -4.3900 1.5500 0.4100 C 0 0 0 2 0 0 -5.8300 1.9800 0.4400 C 0 0 0 3 0 0 -0.1400 0.6100 0.6100 N 0 0 0 1 0 0 6.2300 -0.2500 0.2700 H 0 0 0 0 0 0 4.5600 -0.8900 0.2100 H 0 0 0 0 0 0 5.6600 -1.1400 -1.1800 H 0 0 0 0 0 0 5.6900 1.2600 -1.6300 H 0 0 0 0 0 0 4.0100 0.6600 -1.6100 H 0 0 0 0 0 0 4.2100 2.7800 -0.3800 H 0 0 0 0 0 0 5.4800 2.0800 0.6600 H 0 0 0 0 0 0 3.9100 0.4300 1.5500 H 0 0 0 0 0 0 3.3000 2.0900 1.7800 H 0 0 0 0 0 0 2.4800 0.1900 -0.4300 H 0 0 0 0 0 0 1.9500 1.9000 -0.2800 H 0 0 0 0 0 0 1.1100 1.3700 2.0200 H 0 0 0 0 0 0 2.5000 -0.8200 2.1800 H 0 0 0 0 0 0 0.8300 -0.8900 2.7700 H 0 0 0 0 0 0 1.7400 -1.7500 0.0000 H 0 0 0 0 0 0 1.3500 -2.8300 1.3700 H 0 0 0 0 0 0 -0.9000 -1.8700 1.5100 H 0 0 0 0 0 0 -0.6300 -2.6600 -0.0500 H 0 0 0 0 0 0 -0.2900 0.4600 -2.0100 H 0 0 0 0 0 0 1.0300 -0.6200 -1.4800 H 0 0 0 0 0 0 -0.3200 -2.6000 -2.0000 H 0 0 0 0 0 0 -0.1900 -1.5300 -3.4100 H 0 0 0 0 0 0 -2.4200 -0.6200 -3.0100 H 0 0 0 0 0 0 -2.5400 -2.4000 -2.9900 H 0 0 0 0 0 0 -2.3300 0.6200 -0.8200 H 0 0 0 0 0 0 -2.2900 0.4900 1.7100 H 0 0 0 0 0 0 -2.7600 -1.2300 1.5700 H 0 0 0 0 0 0 -4.7100 0.1300 1.9700 H 0 0 0 0 0 0 -4.7800 -0.5600 0.3100 H 0 0 0 0 0 0 -4.0500 1.5900 -0.6400 H 0 0 0 0 0 0 -3.7900 2.2500 1.0100 H 0 0 0 0 0 0 -6.1900 1.9500 1.4900 H 0 0 0 0 0 0 -6.4400 1.2900 -0.1700 H 0 0 0 0 0 0 -5.9200 3.0000 0.0600 H 0 0 0 0 0 0 -0.2900 1.4700 0.1200 H 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 21 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 16 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 10 21 1 0 22 1 1 0 23 1 1 0 24 1 1 0 25 2 1 0 26 2 1 0 27 3 1 0 28 3 1 0 29 4 1 0 30 4 1 0 31 5 1 0 32 5 1 0 33 6 1 0 34 7 1 0 35 7 1 0 36 8 1 0 37 8 1 0 38 9 1 0 39 9 1 0 40 11 1 0 41 11 1 0 42 12 1 0 43 12 1 0 44 13 1 0 45 13 1 0 46 16 1 0 47 17 1 0 48 17 1 0 49 18 1 0 50 18 1 0 51 19 1 0 52 19 1 0 53 20 1 0 54 20 1 0 55 20 1 0 56 21 1 0 M END $$$$