TDT2MOL C1OC(=NC1c2ccccc2)c3cccc4c5cccc(C6=NC(CO6)c7ccccc7)c5oc34 57 63 0 0 0 0 0 4.7300 2.0400 0.2400 C 0 0 0 2 0 0 4.5000 1.7800 -1.1000 O 0 0 0 0 0 0 3.2300 1.3100 -1.2100 C 0 0 0 0 0 0 2.6500 1.0600 -0.1100 N 0 0 0 0 0 0 3.6200 1.3700 0.9900 C 0 0 0 1 0 0 3.9800 0.0700 1.6300 C 0 0 0 0 0 0 3.8600 -1.1200 0.9100 C 0 0 0 1 0 0 4.2000 -2.3400 1.5100 C 0 0 0 1 0 0 4.6400 -2.3700 2.8400 C 0 0 0 1 0 0 4.7600 -1.1700 3.5600 C 0 0 0 1 0 0 4.4200 0.0500 2.9600 C 0 0 0 1 0 0 2.5600 1.1200 -2.5300 C 0 0 0 0 0 0 3.2500 1.4200 -3.7100 C 0 0 0 1 0 0 2.6300 1.2400 -4.9500 C 0 0 0 1 0 0 1.3100 0.7600 -5.0200 C 0 0 0 1 0 0 0.6300 0.4600 -3.8500 C 0 0 0 0 0 0 -0.6400 -0.0100 -3.6200 C 0 0 0 0 0 0 -1.6700 -0.3600 -4.4900 C 0 0 0 1 0 0 -2.8900 -0.8200 -3.9700 C 0 0 0 1 0 0 -3.0600 -0.9400 -2.5900 C 0 0 0 1 0 0 -2.0300 -0.6000 -1.7100 C 0 0 0 0 0 0 -2.2200 -0.7300 -0.2400 C 0 0 0 0 0 0 -3.3100 -1.1500 0.2600 N 0 0 0 0 0 0 -3.1400 -1.1500 1.7500 C 0 0 0 1 0 0 -1.8400 -0.4400 1.9100 C 0 0 0 2 0 0 -1.2600 -0.4100 0.6600 O 0 0 0 0 0 0 -4.3400 -0.4900 2.3400 C 0 0 0 0 0 0 -4.2700 0.1200 3.6000 C 0 0 0 1 0 0 -5.4000 0.7400 4.1400 C 0 0 0 1 0 0 -6.6000 0.7500 3.4300 C 0 0 0 1 0 0 -6.6800 0.1500 2.1700 C 0 0 0 1 0 0 -5.5500 -0.4700 1.6200 C 0 0 0 1 0 0 -0.8200 -0.1300 -2.2400 C 0 0 0 0 0 0 0.3500 0.2700 -1.6100 O 0 0 0 0 0 0 1.2600 0.6400 -2.6100 C 0 0 0 0 0 0 4.7300 3.1300 0.3400 H 0 0 0 0 0 0 5.7300 1.6600 0.4800 H 0 0 0 0 0 0 3.0900 2.0100 1.7000 H 0 0 0 0 0 0 3.5100 -1.1100 -0.1300 H 0 0 0 0 0 0 4.1100 -3.2800 0.9500 H 0 0 0 0 0 0 4.9100 -3.3200 3.3200 H 0 0 0 0 0 0 5.1100 -1.1900 4.6000 H 0 0 0 0 0 0 4.5100 0.9800 3.5200 H 0 0 0 0 0 0 4.2800 1.7900 -3.6600 H 0 0 0 0 0 0 3.1800 1.4800 -5.8800 H 0 0 0 0 0 0 0.8300 0.6200 -6.0000 H 0 0 0 0 0 0 -1.5400 -0.2700 -5.5800 H 0 0 0 0 0 0 -3.7100 -1.1000 -4.6500 H 0 0 0 0 0 0 -4.0200 -1.3100 -2.1900 H 0 0 0 0 0 0 -3.1100 -2.2100 2.0400 H 0 0 0 0 0 0 -1.1400 -0.9300 2.5900 H 0 0 0 0 0 0 -1.9600 0.6100 2.2200 H 0 0 0 0 0 0 -3.3200 0.1100 4.1600 H 0 0 0 0 0 0 -5.3400 1.2100 5.1300 H 0 0 0 0 0 0 -7.4900 1.2400 3.8600 H 0 0 0 0 0 0 -7.6200 0.1600 1.6100 H 0 0 0 0 0 0 -5.6100 -0.9500 0.6300 H 0 0 0 0 0 0 1 5 1 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 11 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 3 12 1 0 12 35 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 35 2 0 16 17 1 0 17 33 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 1 0 22 26 1 0 22 23 2 0 23 24 1 0 24 25 1 0 25 26 1 0 24 27 1 0 27 32 1 0 27 28 2 0 28 29 1 0 29 30 2 0 30 31 1 0 31 32 2 0 21 33 2 0 33 34 1 0 34 35 1 0 36 1 1 0 37 1 1 0 38 5 1 0 39 7 1 0 40 8 1 0 41 9 1 0 42 10 1 0 43 11 1 0 44 13 1 0 45 14 1 0 46 15 1 0 47 18 1 0 48 19 1 0 49 20 1 0 50 24 1 0 51 25 1 0 52 25 1 0 53 28 1 0 54 29 1 0 55 30 1 0 56 31 1 0 57 32 1 0 M END $$$$