# 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 STR STR 'PROGESTERONE ' non-polymer 53 23 M # data_comp_STR # 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 STR C1 C . 0.000 STR C2 C . 0.000 STR C3 C . 0.000 STR O3 O . 0.000 STR C4 C . 0.000 STR C5 C . 0.000 STR C6 C . 0.000 STR C7 C . 0.000 STR C8 C . 0.000 STR C9 C . 0.000 STR C10 C . 0.000 STR C11 C . 0.000 STR C12 C . 0.000 STR C13 C . 0.000 STR C14 C . 0.000 STR C15 C . 0.000 STR C16 C . 0.000 STR C17 C . 0.000 STR C18 C . 0.000 STR C19 C . 0.000 STR C20 C . 0.000 STR O20 O . 0.000 STR C21 C . 0.000 STR H11 H . 0.000 STR H12 H . 0.000 STR H21 H . 0.000 STR H22 H . 0.000 STR H4 H . 0.000 STR H61 H . 0.000 STR H62 H . 0.000 STR H71 H . 0.000 STR H72 H . 0.000 STR H8 H . 0.000 STR H9 H . 0.000 STR H111 H . 0.000 STR H112 H . 0.000 STR H121 H . 0.000 STR H122 H . 0.000 STR H14 H . 0.000 STR H151 H . 0.000 STR H152 H . 0.000 STR H161 H . 0.000 STR H162 H . 0.000 STR H17 H . 0.000 STR H181 H . 0.000 STR H182 H . 0.000 STR H183 H . 0.000 STR H191 H . 0.000 STR H192 H . 0.000 STR H193 H . 0.000 STR H211 H . 0.000 STR H212 H . 0.000 STR H213 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 STR C1 C2 single STR C1 C10 single STR C1 H11 single STR C1 H12 single STR C2 C3 single STR C2 H21 single STR C2 H22 single STR C3 C4 single STR C3 O3 double STR C4 C5 double STR C4 H4 single STR C5 C6 single STR C5 C10 single STR C6 C7 single STR C6 H61 single STR C6 H62 single STR C7 C8 single STR C7 H71 single STR C7 H72 single STR C8 C9 single STR C8 C14 single STR C8 H8 single STR C9 C10 single STR C9 C11 single STR C9 H9 single STR C10 C19 single STR C11 C12 single STR C11 H111 single STR C11 H112 single STR C12 C13 single STR C12 H121 single STR C12 H122 single STR C13 C14 single STR C13 C17 single STR C13 C18 single STR C14 C15 single STR C14 H14 single STR C15 C16 single STR C15 H151 single STR C15 H152 single STR C16 C17 single STR C16 H161 single STR C16 H162 single STR C17 C20 single STR C17 H17 single STR C18 H181 single STR C18 H182 single STR C18 H183 single STR C19 H191 single STR C19 H192 single STR C19 H193 single STR C20 C21 single STR C20 O20 double STR C21 H211 single STR C21 H212 single STR C21 H213 single