TDT2MOL Cc1cc2c(C#N)c3ccccn3c(=O)c2c(C)n1 30 32 0 0 0 0 0 4.3200 -1.3300 0.4900 C 0 0 0 3 0 0 3.0200 -0.6200 0.2400 C 0 0 0 0 0 0 1.8100 -1.3000 0.4400 C 0 0 0 1 0 0 0.6000 -0.6500 0.2100 C 0 0 0 0 0 0 -0.6100 -1.3300 0.4000 C 0 0 0 0 0 0 -0.6100 -2.7600 0.8500 C 0 0 0 0 0 0 -0.7600 -3.8000 1.3200 N 0 0 0 0 0 0 -1.8300 -0.6700 0.1700 C 0 0 0 0 0 0 -3.0400 -1.3600 0.3600 C 0 0 0 1 0 0 -4.2500 -0.7000 0.1400 C 0 0 0 1 0 0 -4.2600 0.6300 -0.2800 C 0 0 0 1 0 0 -3.0500 1.3200 -0.4700 C 0 0 0 1 0 0 -1.8400 0.6600 -0.2500 N 0 0 0 0 0 0 -0.6300 1.3400 -0.4400 C 0 0 0 0 0 0 -0.6300 2.5300 -0.8100 O 0 0 0 0 0 0 0.5900 0.6900 -0.2100 C 0 0 0 0 0 0 1.8000 1.3700 -0.4000 C 0 0 0 0 0 0 1.7900 2.8000 -0.8500 C 0 0 0 3 0 0 3.0100 0.7100 -0.1700 N 0 0 0 0 0 0 5.1300 -0.5800 0.5900 H 0 0 0 0 0 0 4.5400 -1.9900 -0.3600 H 0 0 0 0 0 0 4.2500 -1.9200 1.4100 H 0 0 0 0 0 0 1.8200 -2.3500 0.7700 H 0 0 0 0 0 0 -3.0300 -2.4100 0.6900 H 0 0 0 0 0 0 -5.2000 -1.2400 0.2900 H 0 0 0 0 0 0 -5.2200 1.1500 -0.4600 H 0 0 0 0 0 0 -3.0600 2.3700 -0.8000 H 0 0 0 0 0 0 1.4100 3.4300 -0.0400 H 0 0 0 0 0 0 1.1300 2.9000 -1.7300 H 0 0 0 0 0 0 2.8100 3.1100 -1.1100 H 0 0 0 0 0 0 1 2 1 0 2 19 1 0 2 3 2 0 3 4 1 0 4 16 2 0 4 5 1 0 5 6 1 0 6 7 3 0 5 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 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 17 19 2 0 20 1 1 0 21 1 1 0 22 1 1 0 23 3 1 0 24 9 1 0 25 10 1 0 26 11 1 0 27 12 1 0 28 18 1 0 29 18 1 0 30 18 1 0 M END $$$$