@MOLECULE FDBD03120 3 2 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0190 1.5493 0.0106 C.1 1 UNK -0.0151 2 S 0.0021 -0.0041 0.0020 S.2 1 UNK 0.0076 3 S1 -0.0401 3.1027 0.0191 S.2 1 UNK 0.0076 @BOND 1 1 2 2 2 1 3 2