# 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 U05 U05 '6,11-DIHYDRO-11-ETHYL-6-METHYL-9-NIT' non-polymer 36 22 M # data_comp_U05 # 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 U05 N1 N . 0.000 U05 C2 C . 0.000 U05 C3 C . 0.000 U05 C4 C . 0.000 U05 C4A C . 0.000 U05 C5 C . 0.000 U05 O13 O . 0.000 U05 N6 N . 0.000 U05 C12 C . 0.000 U05 C6A C . 0.000 U05 C7 C . 0.000 U05 C8 C . 0.000 U05 C9 C . 0.000 U05 N N . 0.000 U05 O1 O . 0.000 U05 O2 O . 0.000 U05 C10 C . 0.000 U05 C11 C . 0.000 U05 N11 N . 0.000 U05 C14 C . 0.000 U05 C15 C . 0.000 U05 C1A C . 0.000 U05 H2 H . 0.000 U05 H3 H . 0.000 U05 H4 H . 0.000 U05 H121 H . 0.000 U05 H122 H . 0.000 U05 H123 H . 0.000 U05 H7 H . 0.000 U05 H8 H . 0.000 U05 H10 H . 0.000 U05 H141 H . 0.000 U05 H142 H . 0.000 U05 H151 H . 0.000 U05 H152 H . 0.000 U05 H153 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 U05 N1 C2 double U05 N1 C1A single U05 C2 C3 single U05 C2 H2 single U05 C3 C4 double U05 C3 H3 single U05 C4 C4A single U05 C4 H4 single U05 C4A C5 single U05 C4A C1A double U05 C5 N6 single U05 C5 O13 double U05 N6 C6A single U05 N6 C12 single U05 C12 H121 single U05 C12 H122 single U05 C12 H123 single U05 C6A C7 double U05 C6A C11 single U05 C7 C8 single U05 C7 H7 single U05 C8 C9 double U05 C8 H8 single U05 C9 C10 single U05 C9 N single U05 N O1 double U05 N O2 double U05 C10 C11 double U05 C10 H10 single U05 C11 N11 single U05 N11 C1A single U05 N11 C14 single U05 C14 C15 single U05 C14 H141 single U05 C14 H142 single U05 C15 H151 single U05 C15 H152 single U05 C15 H153 single