TDT2MOL CC(C)(C)N1C(O)c2cccn2C(=O)N1C(C)(C)*21F] 39 40 0 0 0 0 0 1.7500 -1.1900 0.6900 C 0 0 0 3 0 0 1.5100 0.0400 -0.1300 C 0 0 0 0 0 0 1.4900 1.2400 0.7800 C 0 0 0 3 0 0 2.6700 0.2100 -1.0900 C 0 0 0 3 0 0 0.3000 -0.0700 -0.9100 N 0 0 0 0 0 0 -0.1500 1.2300 -1.4000 C 0 0 0 1 0 0 -1.2100 1.0800 -2.2100 O 0 0 0 1 0 0 -0.5400 2.0300 -0.1800 C 0 0 0 0 0 0 -0.3400 3.3500 0.1800 C 0 0 0 1 0 0 -0.9100 3.5400 1.4500 C 0 0 0 1 0 0 -1.4800 2.3200 1.8700 C 0 0 0 1 0 0 -1.2500 1.3900 0.8700 N 0 0 0 0 0 0 -1.6000 -0.0100 0.7200 C 0 0 0 0 0 0 -2.5500 -0.4900 1.3400 O 0 0 0 0 0 0 -0.8100 -0.7500 -0.2600 N 0 0 0 0 0 0 -1.2100 -2.1000 -0.6200 C 0 0 0 0 0 0 -0.0800 -3.0700 -0.5700 C 0 0 0 3 0 0 -2.3300 -2.5500 0.2700 C 0 0 0 3 0 0 -1.7000 -2.0500 -1.9500 R 0 0 0 0 0 0 1.9600 -2.0600 0.0500 H 0 0 0 0 0 0 2.6300 -1.0500 1.3500 H 0 0 0 0 0 0 0.8700 -1.4000 1.3100 H 0 0 0 0 0 0 1.4000 2.1700 0.2000 H 0 0 0 0 0 0 2.4200 1.2900 1.3600 H 0 0 0 0 0 0 0.6400 1.1500 1.4800 H 0 0 0 0 0 0 2.5400 1.1200 -1.6800 H 0 0 0 0 0 0 3.6100 0.2900 -0.5200 H 0 0 0 0 0 0 2.7300 -0.6600 -1.7500 H 0 0 0 0 0 0 0.6600 1.7400 -1.9300 H 0 0 0 0 0 0 -0.9900 0.5000 -2.9300 H 0 0 0 0 0 0 0.1800 4.1200 -0.4000 H 0 0 0 0 0 0 -0.9200 4.4800 2.0200 H 0 0 0 0 0 0 -2.0000 2.1600 2.8200 H 0 0 0 0 0 0 0.3300 -3.1200 0.4500 H 0 0 0 0 0 0 0.7000 -2.7900 -1.2900 H 0 0 0 0 0 0 -0.4500 -4.0700 -0.8500 H 0 0 0 0 0 0 -2.0100 -2.5100 1.3200 H 0 0 0 0 0 0 -3.2200 -1.9200 0.1400 H 0 0 0 0 0 0 -2.6200 -3.5900 0.0200 H 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 2 5 1 0 5 15 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 12 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 13 14 2 0 13 15 1 0 15 16 1 0 16 17 1 0 16 18 1 0 16 19 1 0 20 1 1 0 21 1 1 0 22 1 1 0 23 3 1 0 24 3 1 0 25 3 1 0 26 4 1 0 27 4 1 0 28 4 1 0 29 6 1 0 30 7 1 0 31 9 1 0 32 10 1 0 33 11 1 0 34 17 1 0 35 17 1 0 36 17 1 0 37 18 1 0 38 18 1 0 39 18 1 0 M END $$$$