# 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 IMU IMU 'MONO-[5-(2-AMINO-4-OXO-4,5-DIHYDRO-3' non-polymer 40 24 M # data_comp_IMU # 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 IMU P P . 0.000 IMU C2 C . 0.000 IMU O1P O . 0.000 IMU O2P O . 0.000 IMU O3P O . 0.000 IMU O5* O . 0.000 IMU C5* C . 0.000 IMU C4* C . 0.000 IMU N4* N . 0.000 IMU C3* C . 0.000 IMU O3* O . 0.000 IMU C2* C . 0.000 IMU O2* O . 0.000 IMU C1* C . 0.000 IMU C9 C . 0.000 IMU C8 C . 0.000 IMU N7 N . 0.000 IMU C5 C . 0.000 IMU C6 C . 0.000 IMU O6 O . 0.000 IMU N1 N . 0.000 IMU N2 N . 0.000 IMU N3 N . 0.000 IMU C4 C . 0.000 IMU PHO1 H . 0.000 IMU PHO3 H . 0.000 IMU H5*1 H . 0.000 IMU H5*2 H . 0.000 IMU H4* H . 0.000 IMU HN4* H . 0.000 IMU H3* H . 0.000 IMU HO3* H . 0.000 IMU H2* H . 0.000 IMU HO2* H . 0.000 IMU H1* H . 0.000 IMU H8 H . 0.000 IMU HN7 H . 0.000 IMU HN1 H . 0.000 IMU HN21 H . 0.000 IMU HN22 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 IMU P O1P single IMU P O2P double IMU P O3P single IMU P O5* single IMU C2 N1 single IMU C2 N2 single IMU C2 N3 double IMU O1P PHO1 single IMU O3P PHO3 single IMU O5* C5* single IMU C5* C4* single IMU C5* H5*1 single IMU C5* H5*2 single IMU C4* N4* single IMU C4* C3* single IMU C4* H4* single IMU N4* C1* single IMU N4* HN4* single IMU C3* O3* single IMU C3* C2* single IMU C3* H3* single IMU O3* HO3* single IMU C2* O2* single IMU C2* C1* single IMU C2* H2* single IMU O2* HO2* single IMU C1* C9 single IMU C1* H1* single IMU C9 C8 double IMU C9 C4 single IMU C8 N7 single IMU C8 H8 single IMU N7 C5 single IMU N7 HN7 single IMU C5 C6 single IMU C5 C4 double IMU C6 O6 double IMU C6 N1 single IMU N1 HN1 single IMU N2 HN21 single IMU N2 HN22 single IMU N3 C4 single