# generated using pymatgen data_MgFeCuO2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.12505171 _cell_length_b 3.12505171 _cell_length_c 7.90349559 _cell_angle_alpha 78.11260987 _cell_angle_beta 78.11260987 _cell_angle_gamma 60.23942184 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgFeCuO2 _chemical_formula_sum 'Mg1 Fe1 Cu1 O2' _cell_volume 65.07723528 _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 0.40700100 0.40700100 0.78757800 1.0 Fe Fe1 1 0.51535000 0.51535000 0.44543700 1.0 Cu Cu2 1 0.97228300 0.97228300 0.08575200 1.0 O O3 1 0.11390400 0.11390400 0.66892900 1.0 O O4 1 0.88729600 0.88729600 0.33522000 1.0