TDT2MOL CCOC(=O)CC1CN(C(C)c2ccccc2)C(=O)C1C(=O)C 46 47 0 0 0 0 0 -5.6000 0.5000 -0.3400 C 0 0 0 3 0 0 -4.5700 1.4100 0.2600 C 0 0 0 2 0 0 -3.3700 0.7900 0.2800 O 0 0 0 0 0 0 -3.4500 -0.3100 1.0600 C 0 0 0 0 0 0 -4.4300 -0.4600 1.8200 O 0 0 0 0 0 0 -2.3700 -1.3500 1.0100 C 0 0 0 2 0 0 -1.2400 -0.8600 0.1700 C 0 0 0 1 0 0 -0.0800 -1.8300 0.1500 C 0 0 0 2 0 0 1.0800 -0.9800 -0.1600 N 0 0 0 0 0 0 2.3200 -1.4600 -0.6800 C 0 0 0 1 0 0 2.3800 -1.2800 -2.1700 C 0 0 0 3 0 0 3.4600 -0.6800 -0.0500 C 0 0 0 0 0 0 3.6300 -0.7100 1.3300 C 0 0 0 1 0 0 4.6800 0.0000 1.9200 C 0 0 0 1 0 0 5.5500 0.7500 1.1100 C 0 0 0 1 0 0 5.3700 0.7800 -0.2700 C 0 0 0 1 0 0 4.3200 0.0600 -0.8600 C 0 0 0 1 0 0 0.7600 0.4100 0.1500 C 0 0 0 0 0 0 1.4800 1.3900 0.0200 O 0 0 0 0 0 0 -0.6800 0.4500 0.6900 C 0 0 0 1 0 0 -1.3700 1.6700 0.2300 C 0 0 0 0 0 0 -1.8800 2.4700 1.0600 O 0 0 0 0 0 0 -1.4800 1.9800 -1.2300 C 0 0 0 3 0 0 -5.6800 -0.4100 0.2600 H 0 0 0 0 0 0 -6.5800 1.0100 -0.3700 H 0 0 0 0 0 0 -5.3000 0.2400 -1.3700 H 0 0 0 0 0 0 -4.4900 2.3300 -0.3400 H 0 0 0 0 0 0 -4.8700 1.6800 1.2900 H 0 0 0 0 0 0 -2.7700 -2.2900 0.6000 H 0 0 0 0 0 0 -2.0100 -1.5400 2.0400 H 0 0 0 0 0 0 -1.6000 -0.7000 -0.8600 H 0 0 0 0 0 0 -0.1700 -2.6200 -0.5900 H 0 0 0 0 0 0 0.1000 -2.2600 1.1500 H 0 0 0 0 0 0 2.4500 -2.5200 -0.4400 H 0 0 0 0 0 0 2.2600 -0.2100 -2.4200 H 0 0 0 0 0 0 3.3400 -1.6500 -2.5500 H 0 0 0 0 0 0 1.5600 -1.8500 -2.6300 H 0 0 0 0 0 0 2.9500 -1.3000 1.9600 H 0 0 0 0 0 0 4.8300 -0.0200 3.0100 H 0 0 0 0 0 0 6.3800 1.3100 1.5700 H 0 0 0 0 0 0 6.0600 1.3600 -0.9100 H 0 0 0 0 0 0 4.1800 0.0800 -1.9500 H 0 0 0 0 0 0 -0.5900 0.4300 1.7900 H 0 0 0 0 0 0 -0.5000 1.8400 -1.7100 H 0 0 0 0 0 0 -1.8100 3.0300 -1.3600 H 0 0 0 0 0 0 -2.2200 1.3100 -1.6900 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 20 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 10 12 1 0 12 17 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 9 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 24 1 1 0 25 1 1 0 26 1 1 0 27 2 1 0 28 2 1 0 29 6 1 0 30 6 1 0 31 7 1 0 32 8 1 0 33 8 1 0 34 10 1 0 35 11 1 0 36 11 1 0 37 11 1 0 38 13 1 0 39 14 1 0 40 15 1 0 41 16 1 0 42 17 1 0 43 20 1 0 44 23 1 0 45 23 1 0 46 23 1 0 M END $$$$