@MOLECULE FDBD01950 3 2 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0133 1.1318 0.0083 C.1 1 UNK 0.0464 2 N 0.0021 -0.0041 0.0020 N.1 1 UNK -0.2001 3 H -0.0268 2.1257 0.0138 H 1 UNK 0.1537 @BOND 1 1 2 3 2 1 3 1