TDT2MOL c1c[nH]cn1 9 9 0 0 0 0 0 0.6000 -1.1300 0.0300 C 0 0 0 1 0 0 0.9700 0.2200 0.0600 C 0 0 0 1 0 0 -0.1900 0.9900 -0.0100 N 0 0 0 1 0 0 -1.2900 0.1100 -0.0800 C 0 0 0 1 0 0 -0.7900 -1.2000 -0.0500 N 0 0 0 0 0 0 1.2900 -1.9900 0.0700 H 0 0 0 0 0 0 2.0000 0.6000 0.1200 H 0 0 0 0 0 0 -0.2400 1.9900 -0.0100 H 0 0 0 0 0 0 -2.3400 0.4100 -0.1400 H 0 0 0 0 0 0 1 5 1 0 1 2 2 0 2 3 1 0 3 4 1 0 4 5 2 0 6 1 1 0 7 2 1 0 8 3 1 0 9 4 1 0 M END $$$$