TDT2MOL Nc1ccccc1I 14 14 0 0 0 0 0 -2.2600 -0.1600 0.1400 N 0 0 0 2 0 0 -0.8700 -0.0300 0.0600 C 0 0 0 0 0 0 -0.2800 1.2200 0.2600 C 0 0 0 1 0 0 1.1100 1.3600 0.1800 C 0 0 0 1 0 0 1.9100 0.2500 -0.1000 C 0 0 0 1 0 0 1.3200 -1.0100 -0.3000 C 0 0 0 1 0 0 -0.0700 -1.1400 -0.2200 C 0 0 0 0 0 0 -0.9400 -2.9800 -0.5200 I 0 0 0 0 0 0 -2.6900 -1.0600 0.0000 H 0 0 0 0 0 0 -2.8300 0.6400 0.3400 H 0 0 0 0 0 0 -0.9100 2.1000 0.4900 H 0 0 0 0 0 0 1.5700 2.3500 0.3400 H 0 0 0 0 0 0 3.0000 0.3600 -0.1600 H 0 0 0 0 0 0 1.9500 -1.8800 -0.5200 H 0 0 0 0 0 0 1 2 1 0 2 7 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 9 1 1 0 10 1 1 0 11 3 1 0 12 4 1 0 13 5 1 0 14 6 1 0 M END $$$$