TDT2MOL O=N(=O)c1cc2ccccc2n1S(=O)(=O)c3ccccc3 31 33 0 0 0 0 0 1.3800 0.9300 2.9200 O 0 0 0 0 0 0 1.0700 0.8500 1.6600 N 0 0 0 0 0 0 1.9800 1.0200 0.7500 O 0 0 0 0 0 0 -0.2500 0.5700 1.2900 C 0 0 0 0 0 0 -1.3400 0.3600 2.1600 C 0 0 0 1 0 0 -2.4600 0.1200 1.3800 C 0 0 0 0 0 0 -3.7800 -0.1500 1.7400 C 0 0 0 1 0 0 -4.7400 -0.3500 0.7400 C 0 0 0 1 0 0 -4.3600 -0.2900 -0.6100 C 0 0 0 1 0 0 -3.0300 -0.0300 -0.9600 C 0 0 0 1 0 0 -2.0900 0.1800 0.0400 C 0 0 0 0 0 0 -0.7300 0.4600 -0.0300 N 0 0 0 0 0 0 0.2100 0.6300 -1.4300 S 0 0 0 0 0 0 -0.3800 -0.1300 -2.5100 O 0 0 0 0 0 0 0.2600 2.0400 -1.8000 O 0 0 0 0 0 0 1.8800 0.0400 -1.1100 C 0 0 0 0 0 0 2.9800 0.7600 -1.6000 C 0 0 0 1 0 0 4.2800 0.3000 -1.3500 C 0 0 0 1 0 0 4.4800 -0.8700 -0.6100 C 0 0 0 1 0 0 3.3800 -1.5900 -0.1200 C 0 0 0 1 0 0 2.0800 -1.1300 -0.3700 C 0 0 0 1 0 0 -1.2800 0.3900 3.2600 H 0 0 0 0 0 0 -4.0800 -0.1900 2.8000 H 0 0 0 0 0 0 -5.7800 -0.5600 1.0100 H 0 0 0 0 0 0 -5.1200 -0.4600 -1.4000 H 0 0 0 0 0 0 -2.7500 0.0200 -2.0200 H 0 0 0 0 0 0 2.8200 1.6800 -2.1800 H 0 0 0 0 0 0 5.1400 0.8600 -1.7300 H 0 0 0 0 0 0 5.5000 -1.2300 -0.4100 H 0 0 0 0 0 0 3.5300 -2.5100 0.4600 H 0 0 0 0 0 0 1.2100 -1.6900 0.0100 H 0 0 0 0 0 0 1 2 2 0 2 3 2 0 2 4 1 0 4 12 1 0 4 5 2 0 5 6 1 0 6 11 1 0 6 7 2 0 7 8 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 2 0 13 16 1 0 16 21 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 22 5 1 0 23 7 1 0 24 8 1 0 25 9 1 0 26 10 1 0 27 17 1 0 28 18 1 0 29 19 1 0 30 20 1 0 31 21 1 0 M END $$$$