# generated using pymatgen data_MgMn3Cu3O8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.74659452 _cell_length_b 7.74659502 _cell_length_c 7.74659532 _cell_angle_alpha 46.71969355 _cell_angle_beta 46.71968758 _cell_angle_gamma 46.71968663 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgMn3Cu3O8 _chemical_formula_sum 'Mg1 Mn3 Cu3 O8' _cell_volume 225.08017987 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Mg Mg0 1 0.68906065 0.68906065 0.68906065 1.0 Mn Mn1 1 0.13260842 0.63433314 0.63433314 1.0 Mn Mn2 1 0.63433314 0.13260842 0.63433314 1.0 Mn Mn3 1 0.63433314 0.63433314 0.13260842 1.0 Cu Cu4 1 0.06453422 0.06453422 0.06453422 1.0 Cu Cu5 1 0.20572846 0.20572846 0.20572846 1.0 Cu Cu6 1 0.56943749 0.56943749 0.56943749 1.0 O O7 1 0.42661838 0.42661838 0.42661838 1.0 O O8 1 0.36774561 0.36774561 0.84853330 1.0 O O9 1 0.36774561 0.84853330 0.36774561 1.0 O O10 1 0.84853330 0.36774561 0.36774561 1.0 O O11 1 0.42723582 0.89535952 0.89535952 1.0 O O12 1 0.89535952 0.42723582 0.89535952 1.0 O O13 1 0.89535952 0.89535952 0.42723582 1.0 O O14 1 0.84136773 0.84136773 0.84136773 1.0