@MOLECULE FDBD01939 3 2 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0143 1.2038 0.0087 C.1 1 UNK 0.1783 2 O 0.0021 -0.0041 0.0020 O.2 1 UNK -0.2232 3 S -0.0354 2.7572 0.0172 S.2 1 UNK 0.0449 @BOND 1 1 2 2 2 1 3 2