# 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 ERG ERG 'ERGOSTEROL ' non-polymer 73 29 M # data_comp_ERG # 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 ERG C1 C . 0.000 ERG C2 C . 0.000 ERG C3 C . 0.000 ERG C4 C . 0.000 ERG C5 C . 0.000 ERG C6 C . 0.000 ERG C7 C . 0.000 ERG C8 C . 0.000 ERG C9 C . 0.000 ERG C10 C . 0.000 ERG C11 C . 0.000 ERG C12 C . 0.000 ERG C13 C . 0.000 ERG C14 C . 0.000 ERG C15 C . 0.000 ERG C16 C . 0.000 ERG C17 C . 0.000 ERG C18 C . 0.000 ERG C19 C . 0.000 ERG C20 C . 0.000 ERG C21 C . 0.000 ERG C22 C . 0.000 ERG C23 C . 0.000 ERG C24 C . 0.000 ERG C25 C . 0.000 ERG C26 C . 0.000 ERG C27 C . 0.000 ERG C28 C . 0.000 ERG O1 O . 0.000 ERG H11 H . 0.000 ERG H12 H . 0.000 ERG H21 H . 0.000 ERG H22 H . 0.000 ERG H3 H . 0.000 ERG H41 H . 0.000 ERG H42 H . 0.000 ERG H6 H . 0.000 ERG H7 H . 0.000 ERG H9 H . 0.000 ERG H111 H . 0.000 ERG H112 H . 0.000 ERG H121 H . 0.000 ERG H122 H . 0.000 ERG H14 H . 0.000 ERG H151 H . 0.000 ERG H152 H . 0.000 ERG H161 H . 0.000 ERG H162 H . 0.000 ERG H17 H . 0.000 ERG H181 H . 0.000 ERG H182 H . 0.000 ERG H183 H . 0.000 ERG H191 H . 0.000 ERG H192 H . 0.000 ERG H193 H . 0.000 ERG H20 H . 0.000 ERG H211 H . 0.000 ERG H212 H . 0.000 ERG H213 H . 0.000 ERG H_22 H . 0.000 ERG H23 H . 0.000 ERG H24 H . 0.000 ERG H25 H . 0.000 ERG H261 H . 0.000 ERG H262 H . 0.000 ERG H263 H . 0.000 ERG H271 H . 0.000 ERG H272 H . 0.000 ERG H273 H . 0.000 ERG H281 H . 0.000 ERG H282 H . 0.000 ERG H283 H . 0.000 ERG HO1 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 ERG C1 C2 single ERG C1 C10 single ERG C1 H11 single ERG C1 H12 single ERG C2 C3 single ERG C2 H21 single ERG C2 H22 single ERG C3 C4 single ERG C3 O1 single ERG C3 H3 single ERG C4 C5 single ERG C4 H41 single ERG C4 H42 single ERG C5 C6 double ERG C5 C10 single ERG C6 C7 single ERG C6 H6 single ERG C7 C8 double ERG C7 H7 single ERG C8 C9 single ERG C8 C14 single ERG C9 C10 single ERG C9 C11 single ERG C9 H9 single ERG C10 C19 single ERG C11 C12 single ERG C11 H111 single ERG C11 H112 single ERG C12 C13 single ERG C12 H121 single ERG C12 H122 single ERG C13 C14 single ERG C13 C17 single ERG C13 C18 single ERG C14 C15 single ERG C14 H14 single ERG C15 C16 single ERG C15 H151 single ERG C15 H152 single ERG C16 C17 single ERG C16 H161 single ERG C16 H162 single ERG C17 C20 single ERG C17 H17 single ERG C18 H181 single ERG C18 H182 single ERG C18 H183 single ERG C19 H191 single ERG C19 H192 single ERG C19 H193 single ERG C20 C21 single ERG C20 C22 single ERG C20 H20 single ERG C21 H211 single ERG C21 H212 single ERG C21 H213 single ERG C22 C23 double ERG C22 H_22 single ERG C23 C24 single ERG C23 H23 single ERG C24 C25 single ERG C24 C28 single ERG C24 H24 single ERG C25 C26 single ERG C25 C27 single ERG C25 H25 single ERG C26 H261 single ERG C26 H262 single ERG C26 H263 single ERG C27 H271 single ERG C27 H272 single ERG C27 H273 single ERG C28 H281 single ERG C28 H282 single ERG C28 H283 single ERG O1 HO1 single