TDT2MOL OC(=O)CC(NC(=O)Cc1ccccc1)c2cnc3ccccc3c2 43 45 0 0 0 0 0 -2.8600 -3.8300 -0.5800 O 0 0 0 1 0 0 -2.2400 -3.2400 0.4600 C 0 0 0 0 0 0 -2.9000 -2.8800 1.4500 O 0 0 0 0 0 0 -0.7600 -3.0200 0.4300 C 0 0 0 2 0 0 -0.4200 -1.9600 -0.5800 C 0 0 0 1 0 0 1.0100 -1.7800 -0.6700 N 0 0 0 1 0 0 1.8300 -1.6700 0.5200 C 0 0 0 0 0 0 1.3100 -1.7400 1.6500 O 0 0 0 0 0 0 3.3200 -1.4800 0.3900 C 0 0 0 2 0 0 3.6200 -0.0300 0.1600 C 0 0 0 0 0 0 4.4500 0.3500 -0.9000 C 0 0 0 1 0 0 4.7300 1.7000 -1.1100 C 0 0 0 1 0 0 4.1900 2.6700 -0.2700 C 0 0 0 1 0 0 3.3600 2.2900 0.8000 C 0 0 0 1 0 0 3.0800 0.9400 1.0100 C 0 0 0 1 0 0 -1.0800 -0.6700 -0.2000 C 0 0 0 0 0 0 -0.4400 0.2400 0.6500 C 0 0 0 1 0 0 -1.0700 1.4400 1.0000 N 0 0 0 0 0 0 -2.3400 1.7400 0.4900 C 0 0 0 0 0 0 -2.9600 2.9400 0.8400 C 0 0 0 1 0 0 -4.2300 3.2400 0.3300 C 0 0 0 1 0 0 -4.8700 2.3400 -0.5300 C 0 0 0 1 0 0 -4.2500 1.1400 -0.8700 C 0 0 0 1 0 0 -2.9800 0.8400 -0.3600 C 0 0 0 0 0 0 -2.3500 -0.3700 -0.7100 C 0 0 0 1 0 0 -2.5400 -3.4600 -1.4000 H 0 0 0 0 0 0 -0.4300 -2.7000 1.4300 H 0 0 0 0 0 0 -0.2500 -3.9600 0.1600 H 0 0 0 0 0 0 -0.7900 -2.2700 -1.5700 H 0 0 0 0 0 0 1.4500 -1.7200 -1.5700 H 0 0 0 0 0 0 3.8100 -1.8200 1.3200 H 0 0 0 0 0 0 3.6900 -2.0800 -0.4600 H 0 0 0 0 0 0 4.8800 -0.4200 -1.5600 H 0 0 0 0 0 0 5.3800 2.0000 -1.9500 H 0 0 0 0 0 0 4.4100 3.7400 -0.4400 H 0 0 0 0 0 0 2.9300 3.0600 1.4600 H 0 0 0 0 0 0 2.4200 0.6400 1.8500 H 0 0 0 0 0 0 0.5600 0.0100 1.0600 H 0 0 0 0 0 0 -2.4600 3.6600 1.5100 H 0 0 0 0 0 0 -4.7200 4.1900 0.6000 H 0 0 0 0 0 0 -5.8700 2.5700 -0.9300 H 0 0 0 0 0 0 -4.7500 0.4200 -1.5400 H 0 0 0 0 0 0 -2.8600 -1.0800 -1.3800 H 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 15 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 5 16 1 0 16 25 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 24 1 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 26 1 1 0 27 4 1 0 28 4 1 0 29 5 1 0 30 6 1 0 31 9 1 0 32 9 1 0 33 11 1 0 34 12 1 0 35 13 1 0 36 14 1 0 37 15 1 0 38 17 1 0 39 20 1 0 40 21 1 0 41 22 1 0 42 23 1 0 43 25 1 0 M END $$$$