# 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 CEF CEF 'CEFOTAXIME GROUP ' non-polymer 47 30 M # data_comp_CEF # 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 CEF S1 S . 0.000 CEF C2 C . 0.000 CEF C3 C . 0.000 CEF 'C3'' C . 0.000 CEF 'C2'' C . 0.000 CEF 'O1'' O . 0.000 CEF 'O2'' O . 0.000 CEF 'C1'' C . 0.000 CEF C4 C . 0.000 CEF 'C4'' C . 0.000 CEF O4A O . 0.000 CEF O4B O . 0.000 CEF N5 N . 0.000 CEF C6 C . 0.000 CEF C7 C . 0.000 CEF C8 C . 0.000 CEF O9 O . 0.000 CEF N10 N . 0.000 CEF C11 C . 0.000 CEF O12 O . 0.000 CEF C13 C . 0.000 CEF N16 N . 0.000 CEF O17 O . 0.000 CEF C18 C . 0.000 CEF C14 C . 0.000 CEF C15 C . 0.000 CEF S16 S . 0.000 CEF C17 C . 0.000 CEF N18 N . 0.000 CEF N19 N . 0.000 CEF H21 H . 0.000 CEF H22 H . 0.000 CEF 'H3'1' H . 0.000 CEF 'H3'2' H . 0.000 CEF 'H1'1' H . 0.000 CEF 'H1'2' H . 0.000 CEF 'H1'3' H . 0.000 CEF HO4 H . 0.000 CEF H6 H . 0.000 CEF H7 H . 0.000 CEF HN1 H . 0.000 CEF H181 H . 0.000 CEF H182 H . 0.000 CEF H183 H . 0.000 CEF H15 H . 0.000 CEF HN81 H . 0.000 CEF HN82 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 CEF S1 C2 single CEF S1 C6 single CEF C2 C3 single CEF C2 H21 single CEF C2 H22 single CEF C3 C4 double CEF C3 'C3'' single CEF 'C3'' 'C2'' single CEF 'C3'' 'H3'1' single CEF 'C3'' 'H3'2' single CEF 'C2'' 'O1'' double CEF 'C2'' 'O2'' single CEF 'O2'' 'C1'' single CEF 'C1'' 'H1'1' single CEF 'C1'' 'H1'2' single CEF 'C1'' 'H1'3' single CEF C4 N5 single CEF C4 'C4'' single CEF 'C4'' O4A double CEF 'C4'' O4B single CEF O4B HO4 single CEF N5 C6 single CEF C6 C7 single CEF C6 H6 single CEF C7 C8 single CEF C7 N10 single CEF C7 H7 single CEF C8 O9 double CEF N10 C11 single CEF N10 HN1 single CEF C11 C13 single CEF C11 O12 double CEF C13 C14 single CEF C13 N16 double CEF N16 O17 single CEF O17 C18 single CEF C18 H181 single CEF C18 H182 single CEF C18 H183 single CEF C14 C15 double CEF C14 N19 single CEF C15 S16 single CEF C15 H15 single CEF S16 C17 single CEF C17 N18 single CEF C17 N19 double CEF N18 HN81 single CEF N18 HN82 single