TDT2MOL Oc1c(*)cc(cc1C(=O)*)N(=O)=OO)=OO)=O 17 17 0 0 0 0 0 -1.8500 -2.1700 -0.1800 O 0 0 0 1 0 0 -0.8300 -1.2300 -0.0500 C 0 0 0 0 0 0 0.4400 -1.7000 0.3000 C 0 0 0 0 0 0 0.6200 -3.0300 0.5000 R 0 0 0 0 0 0 1.5200 -0.8200 0.4500 C 0 0 0 1 0 0 1.3200 0.5500 0.2500 C 0 0 0 0 0 0 0.0600 1.0300 -0.1100 C 0 0 0 1 0 0 -1.0300 0.1400 -0.2600 C 0 0 0 0 0 0 -2.3400 0.7400 -0.6400 C 0 0 0 0 0 0 -3.3700 0.0500 -0.8100 O 0 0 0 0 0 0 -2.4200 2.1300 -0.8200 R 0 0 0 0 0 0 2.3900 1.4500 0.3900 N 0 0 0 0 0 0 3.5600 1.0000 0.7200 O 0 0 0 0 0 0 2.2000 2.7200 0.2000 O 0 0 0 0 0 0 -2.6700 -1.7600 -0.4200 H 0 0 0 0 0 0 2.5100 -1.2000 0.7300 H 0 0 0 0 0 0 -0.1000 2.1000 -0.2700 H 0 0 0 0 0 0 1 2 1 0 2 8 1 0 2 3 2 0 3 4 1 0 3 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 9 11 1 0 6 12 1 0 12 13 2 0 12 14 2 0 15 1 1 0 16 5 1 0 17 7 1 0 M END $$$$