TDT2MOL Cc1ccc2[nH]c3cnccc3c2c1Br 24 26 0 0 0 0 0 3.7100 0.6000 0.3400 C 0 0 0 3 0 0 2.3900 -0.0300 -0.0100 C 0 0 0 0 0 0 2.3600 -1.2600 -0.6900 C 0 0 0 1 0 0 1.1300 -1.8500 -1.0300 C 0 0 0 1 0 0 -0.0500 -1.2000 -0.6700 C 0 0 0 0 0 0 -1.3800 -1.5600 -0.8700 N 0 0 0 1 0 0 -2.1700 -0.5500 -0.3200 C 0 0 0 0 0 0 -3.5600 -0.4200 -0.2400 C 0 0 0 1 0 0 -4.1000 0.7100 0.3900 N 0 0 0 0 0 0 -3.2500 1.6900 0.9300 C 0 0 0 1 0 0 -1.8600 1.5400 0.8500 C 0 0 0 1 0 0 -1.3300 0.4200 0.2300 C 0 0 0 0 0 0 -0.0200 0.0200 0.0100 C 0 0 0 0 0 0 1.2000 0.6100 0.3400 C 0 0 0 0 0 0 1.2500 2.2700 1.2700 Br 0 0 0 0 0 0 4.3900 0.5300 -0.5200 H 0 0 0 0 0 0 4.1400 0.0700 1.2000 H 0 0 0 0 0 0 3.5500 1.6500 0.6000 H 0 0 0 0 0 0 3.3000 -1.7600 -0.9700 H 0 0 0 0 0 0 1.1100 -2.8100 -1.5600 H 0 0 0 0 0 0 -1.7100 -2.3800 -1.3400 H 0 0 0 0 0 0 -4.2200 -1.1800 -0.6700 H 0 0 0 0 0 0 -3.6800 2.5700 1.4200 H 0 0 0 0 0 0 -1.2000 2.3100 1.2900 H 0 0 0 0 0 0 1 2 1 0 2 14 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 13 1 0 5 6 1 0 6 7 1 0 7 12 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 16 1 1 0 17 1 1 0 18 1 1 0 19 3 1 0 20 4 1 0 21 6 1 0 22 8 1 0 23 10 1 0 24 11 1 0 M END $$$$