TDT2MOL CCN(CC)C(=O)c1ccccc1c2cccc3c2C(=O)c4ccccc4P3(=O)c5ccccc5 61 65 0 0 0 0 0 5.7700 1.2200 -1.0600 C 0 0 0 3 0 0 5.7400 -0.0700 -0.3200 C 0 0 0 2 0 0 4.4800 -0.7500 -0.5500 N 0 0 0 0 0 0 4.5400 -1.9200 -1.4400 C 0 0 0 2 0 0 5.1900 -3.0500 -0.7100 C 0 0 0 3 0 0 3.2000 -0.4200 0.0000 C 0 0 0 0 0 0 2.2400 -1.1800 -0.3600 O 0 0 0 0 0 0 2.8200 0.6900 0.9200 C 0 0 0 0 0 0 3.7000 1.6400 1.4400 C 0 0 0 1 0 0 3.2400 2.6400 2.3100 C 0 0 0 1 0 0 1.8900 2.7000 2.6700 C 0 0 0 1 0 0 1.0000 1.7500 2.1600 C 0 0 0 1 0 0 1.4600 0.7500 1.2900 C 0 0 0 0 0 0 0.5200 -0.2300 0.7700 C 0 0 0 0 0 0 0.7700 -1.6000 0.9300 C 0 0 0 1 0 0 -0.1300 -2.5400 0.4300 C 0 0 0 1 0 0 -1.2900 -2.1100 -0.2300 C 0 0 0 1 0 0 -1.5400 -0.7500 -0.3900 C 0 0 0 0 0 0 -0.6400 0.2000 0.1100 C 0 0 0 0 0 0 -0.8900 1.6700 -0.0500 C 0 0 0 0 0 0 0.0900 2.4500 -0.1400 O 0 0 0 0 0 0 -2.2800 2.2500 -0.1200 C 0 0 0 0 0 0 -2.5000 3.5500 0.3500 C 0 0 0 1 0 0 -3.7900 4.1000 0.2900 C 0 0 0 1 0 0 -4.8500 3.3500 -0.2400 C 0 0 0 1 0 0 -4.6200 2.0500 -0.7000 C 0 0 0 1 0 0 -3.3400 1.5000 -0.6400 C 0 0 0 0 0 0 -3.0300 -0.1700 -1.2300 P 0 0 0 0 0 0 -2.8100 -0.1700 -2.7100 O 0 0 0 0 0 0 -4.4200 -1.2300 -0.8000 C 0 0 0 0 0 0 -5.5900 -1.2000 -1.5600 C 0 0 0 1 0 0 -6.6700 -2.0200 -1.2300 C 0 0 0 1 0 0 -6.5800 -2.8800 -0.1300 C 0 0 0 1 0 0 -5.4100 -2.9100 0.6400 C 0 0 0 1 0 0 -4.3300 -2.0900 0.3100 C 0 0 0 1 0 0 4.9100 1.8500 -0.7900 H 0 0 0 0 0 0 6.7100 1.7600 -0.8400 H 0 0 0 0 0 0 5.7300 1.0300 -2.1500 H 0 0 0 0 0 0 5.9000 0.0700 0.7600 H 0 0 0 0 0 0 6.5600 -0.7300 -0.6800 H 0 0 0 0 0 0 3.5100 -2.2000 -1.7200 H 0 0 0 0 0 0 5.1200 -1.6600 -2.3300 H 0 0 0 0 0 0 4.6100 -3.3000 0.1900 H 0 0 0 0 0 0 5.2400 -3.9300 -1.3700 H 0 0 0 0 0 0 6.2100 -2.7600 -0.4100 H 0 0 0 0 0 0 4.7700 1.6400 1.1800 H 0 0 0 0 0 0 3.9600 3.3800 2.7000 H 0 0 0 0 0 0 1.5400 3.4800 3.3500 H 0 0 0 0 0 0 -0.0600 1.7800 2.4400 H 0 0 0 0 0 0 1.6800 -1.9300 1.4500 H 0 0 0 0 0 0 0.0600 -3.6100 0.5500 H 0 0 0 0 0 0 -2.0100 -2.8500 -0.6300 H 0 0 0 0 0 0 -1.6700 4.1400 0.7600 H 0 0 0 0 0 0 -3.9700 5.1200 0.6500 H 0 0 0 0 0 0 -5.8600 3.7900 -0.2800 H 0 0 0 0 0 0 -5.4600 1.4600 -1.1100 H 0 0 0 0 0 0 -5.6600 -0.5200 -2.4300 H 0 0 0 0 0 0 -7.5900 -1.9900 -1.8300 H 0 0 0 0 0 0 -7.4300 -3.5300 0.1400 H 0 0 0 0 0 0 -5.3400 -3.5900 1.5100 H 0 0 0 0 0 0 -3.4100 -2.1200 0.9100 H 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 3 6 1 0 6 7 2 0 6 8 1 0 8 13 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 19 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 28 1 0 18 19 2 0 19 20 1 0 20 21 2 0 20 22 1 0 22 27 1 0 22 23 2 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 28 30 1 0 30 35 1 0 30 31 2 0 31 32 1 0 32 33 2 0 33 34 1 0 34 35 2 0 36 1 1 0 37 1 1 0 38 1 1 0 39 2 1 0 40 2 1 0 41 4 1 0 42 4 1 0 43 5 1 0 44 5 1 0 45 5 1 0 46 9 1 0 47 10 1 0 48 11 1 0 49 12 1 0 50 15 1 0 51 16 1 0 52 17 1 0 53 23 1 0 54 24 1 0 55 25 1 0 56 26 1 0 57 31 1 0 58 32 1 0 59 33 1 0 60 34 1 0 61 35 1 0 M END $$$$