# data_comp_list loop_ _chem_comp.id _chem_comp.three_letter_code _chem_comp.name _chem_comp.group _chem_comp.number_atoms_all _chem_comp.number_atoms_nh _chem_comp.desc_level DFI DFI '2,2-DIFLUOROSTATINE ' non-polymer 29 14 M # data_comp_DFI # loop_ _chem_comp_atom.comp_id _chem_comp_atom.atom_id _chem_comp_atom.type_symbol _chem_comp_atom.type_energy _chem_comp_atom.partial_charge DFI N N . 0.000 DFI CA C . 0.000 DFI CB C . 0.000 DFI CG C . 0.000 DFI CD1 C . 0.000 DFI CD2 C . 0.000 DFI CH C . 0.000 DFI OH O . 0.000 DFI CM C . 0.000 DFI F1 F . 0.000 DFI F2 F . 0.000 DFI C C . 0.000 DFI O O . 0.000 DFI OXT O . 0.000 DFI HN1 H . 0.000 DFI HN2 H . 0.000 DFI HA H . 0.000 DFI HB1 H . 0.000 DFI HB2 H . 0.000 DFI HG H . 0.000 DFI HD11 H . 0.000 DFI HD12 H . 0.000 DFI HD13 H . 0.000 DFI HD21 H . 0.000 DFI HD22 H . 0.000 DFI HD23 H . 0.000 DFI HC H . 0.000 DFI HH H . 0.000 DFI HXT H . 0.000 loop_ _chem_comp_bond.comp_id _chem_comp_bond.atom_id_1 _chem_comp_bond.atom_id_2 _chem_comp_bond.type DFI N CA single DFI N HN1 single DFI N HN2 single DFI CA CB single DFI CA CH single DFI CA HA single DFI CB CG single DFI CB HB1 single DFI CB HB2 single DFI CG CD1 single DFI CG CD2 single DFI CG HG single DFI CD1 HD11 single DFI CD1 HD12 single DFI CD1 HD13 single DFI CD2 HD21 single DFI CD2 HD22 single DFI CD2 HD23 single DFI CH CM single DFI CH OH single DFI CH HC single DFI OH HH single DFI CM C single DFI CM F1 single DFI CM F2 single DFI C O double DFI C OXT single DFI OXT HXT single