# 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 NEV NEV 'NEVIRAPINE ' non-polymer 34 20 M # data_comp_NEV # 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 NEV N1 N . 0.000 NEV C2 C . 0.000 NEV C3 C . 0.000 NEV C4 C . 0.000 NEV C4A C . 0.000 NEV N5 N . 0.000 NEV C6 C . 0.000 NEV C6A C . 0.000 NEV C7 C . 0.000 NEV C8 C . 0.000 NEV C9 C . 0.000 NEV N10 N . 0.000 NEV C10 C . 0.000 NEV N11 N . 0.000 NEV C11 C . 0.000 NEV C12 C . 0.000 NEV O13 O . 0.000 NEV C14 C . 0.000 NEV C15 C . 0.000 NEV C16 C . 0.000 NEV H2 H . 0.000 NEV H3 H . 0.000 NEV HN5 H . 0.000 NEV H7 H . 0.000 NEV H8 H . 0.000 NEV H9 H . 0.000 NEV H121 H . 0.000 NEV H122 H . 0.000 NEV H123 H . 0.000 NEV H14 H . 0.000 NEV H151 H . 0.000 NEV H152 H . 0.000 NEV H161 H . 0.000 NEV H162 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 NEV N1 C2 double NEV N1 C11 single NEV C2 C3 single NEV C2 H2 single NEV C3 C4 double NEV C3 H3 single NEV C4 C4A single NEV C4 C12 single NEV C4A N5 single NEV C4A C11 double NEV N5 C6 single NEV N5 HN5 single NEV C6 C6A single NEV C6 O13 double NEV C6A C7 double NEV C6A C10 single NEV C7 C8 single NEV C7 H7 single NEV C8 C9 double NEV C8 H8 single NEV C9 N10 single NEV C9 H9 single NEV N10 C10 double NEV C10 N11 single NEV N11 C11 single NEV N11 C14 single NEV C12 H121 single NEV C12 H122 single NEV C12 H123 single NEV C14 C15 single NEV C14 C16 single NEV C14 H14 single NEV C15 C16 single NEV C15 H151 single NEV C15 H152 single NEV C16 H161 single NEV C16 H162 single