# 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 DFP DFP 'DIISOPROPYLPHOSPHONO GROUP ' non-polymer 24 10 M # data_comp_DFP # 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 DFP C1 C . 0.000 DFP C2 C . 0.000 DFP C3 C . 0.000 DFP 'C1'' C . 0.000 DFP 'C2'' C . 0.000 DFP 'C3'' C . 0.000 DFP P P . 0.000 DFP O1P O . 0.000 DFP O2P O . 0.000 DFP O3P O . 0.000 DFP H1 H . 0.000 DFP H21 H . 0.000 DFP H22 H . 0.000 DFP H23 H . 0.000 DFP H31 H . 0.000 DFP H32 H . 0.000 DFP H33 H . 0.000 DFP 'H1'' H . 0.000 DFP 'H2'1' H . 0.000 DFP 'H2'2' H . 0.000 DFP 'H2'3' H . 0.000 DFP 'H3'1' H . 0.000 DFP 'H3'2' H . 0.000 DFP 'H3'3' 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 DFP C1 O1P single DFP C1 C2 single DFP C1 C3 single DFP C1 H1 single DFP C2 H21 single DFP C2 H22 single DFP C2 H23 single DFP C3 H31 single DFP C3 H32 single DFP C3 H33 single DFP 'C1'' O2P single DFP 'C1'' 'C2'' single DFP 'C1'' 'C3'' single DFP 'C1'' 'H1'' single DFP 'C2'' 'H2'1' single DFP 'C2'' 'H2'2' single DFP 'C2'' 'H2'3' single DFP 'C3'' 'H3'1' single DFP 'C3'' 'H3'2' single DFP 'C3'' 'H3'3' single DFP P O1P single DFP P O2P single DFP P O3P double