TDT2MOL C1Nc2ccc3cc4ccccc4nc3c2CN1c5ccc6cc7ccccc7nc6c5 52 58 0 0 0 0 0 0.1800 1.2000 -2.4500 C 0 0 0 2 0 0 -0.9300 2.1300 -2.4400 N 0 0 0 1 0 0 -2.1500 1.7700 -1.8600 C 0 0 0 0 0 0 -3.2700 2.5900 -2.0600 C 0 0 0 1 0 0 -4.5100 2.2400 -1.4900 C 0 0 0 1 0 0 -4.6200 1.0700 -0.7300 C 0 0 0 0 0 0 -5.8500 0.7200 -0.1600 C 0 0 0 1 0 0 -5.9600 -0.4500 0.6000 C 0 0 0 0 0 0 -7.1900 -0.8000 1.1700 C 0 0 0 1 0 0 -7.3000 -1.9700 1.9300 C 0 0 0 1 0 0 -6.1800 -2.7900 2.1300 C 0 0 0 1 0 0 -4.9500 -2.4400 1.5600 C 0 0 0 1 0 0 -4.8400 -1.2700 0.8000 C 0 0 0 0 0 0 -3.6100 -0.9200 0.2300 N 0 0 0 0 0 0 -3.5000 0.2500 -0.5300 C 0 0 0 0 0 0 -2.2700 0.6000 -1.1000 C 0 0 0 0 0 0 -1.0800 -0.2900 -0.8800 C 0 0 0 2 0 0 0.1400 0.4000 -1.2400 N 0 0 0 0 0 0 1.3600 -0.0600 -0.7100 C 0 0 0 0 0 0 1.5100 -1.4000 -0.3300 C 0 0 0 1 0 0 2.7300 -1.8500 0.1900 C 0 0 0 1 0 0 3.7900 -0.9500 0.3500 C 0 0 0 0 0 0 5.0100 -1.4000 0.8700 C 0 0 0 1 0 0 6.0800 -0.5100 1.0300 C 0 0 0 0 0 0 7.3000 -0.9600 1.5500 C 0 0 0 1 0 0 8.3600 -0.0700 1.7000 C 0 0 0 1 0 0 8.2200 1.2700 1.3300 C 0 0 0 1 0 0 7.0000 1.7200 0.8100 C 0 0 0 1 0 0 5.9300 0.8300 0.6500 C 0 0 0 0 0 0 4.7100 1.2800 0.1300 N 0 0 0 0 0 0 3.6500 0.3900 -0.0300 C 0 0 0 0 0 0 2.4300 0.8400 -0.5500 C 0 0 0 1 0 0 1.1300 1.7500 -2.4900 H 0 0 0 0 0 0 0.1000 0.5400 -3.3200 H 0 0 0 0 0 0 -0.8200 3.0400 -2.8300 H 0 0 0 0 0 0 -3.1800 3.5000 -2.6600 H 0 0 0 0 0 0 -5.3800 2.8800 -1.6500 H 0 0 0 0 0 0 -6.7300 1.3600 -0.3200 H 0 0 0 0 0 0 -8.0700 -0.1600 1.0100 H 0 0 0 0 0 0 -8.2700 -2.2500 2.3800 H 0 0 0 0 0 0 -6.2700 -3.7100 2.7300 H 0 0 0 0 0 0 -4.0700 -3.0800 1.7100 H 0 0 0 0 0 0 -1.0400 -0.5800 0.1800 H 0 0 0 0 0 0 -1.1800 -1.2000 -1.5000 H 0 0 0 0 0 0 0.6700 -2.1000 -0.4600 H 0 0 0 0 0 0 2.8400 -2.9000 0.4800 H 0 0 0 0 0 0 5.1300 -2.4600 1.1600 H 0 0 0 0 0 0 7.4100 -2.0200 1.8400 H 0 0 0 0 0 0 9.3200 -0.4200 2.1200 H 0 0 0 0 0 0 9.0500 1.9700 1.4500 H 0 0 0 0 0 0 6.8800 2.7800 0.5200 H 0 0 0 0 0 0 2.3100 1.8900 -0.8500 H 0 0 0 0 0 0 1 18 1 0 1 2 1 0 2 3 1 0 3 16 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 15 1 0 6 7 1 0 7 8 2 0 8 13 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 18 19 1 0 19 32 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 31 1 0 22 23 1 0 23 24 2 0 24 29 1 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 28 29 1 0 29 30 2 0 30 31 1 0 31 32 2 0 33 1 1 0 34 1 1 0 35 2 1 0 36 4 1 0 37 5 1 0 38 7 1 0 39 9 1 0 40 10 1 0 41 11 1 0 42 12 1 0 43 17 1 0 44 17 1 0 45 20 1 0 46 21 1 0 47 23 1 0 48 25 1 0 49 26 1 0 50 27 1 0 51 28 1 0 52 32 1 0 M END $$$$