# generated using pymatgen data_Al4Cu2O7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.99435914 _cell_length_b 5.99435914 _cell_length_c 5.99435914 _cell_angle_alpha 60.00000000 _cell_angle_beta 60.00000000 _cell_angle_gamma 60.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Al4Cu2O7 _chemical_formula_sum 'Al4 Cu2 O7' _cell_volume 152.30469139 _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 Al Al0 1 0.61967500 0.61967500 0.14097400 1.0 Al Al1 1 0.61967500 0.14097400 0.61967500 1.0 Al Al2 1 0.14097400 0.61967500 0.61967500 1.0 Al Al3 1 0.61967500 0.61967500 0.61967500 1.0 Cu Cu4 1 0.25000000 0.25000000 0.25000000 1.0 Cu Cu5 1 0.00000000 0.00000000 0.00000000 1.0 O O6 1 0.75000000 0.75000000 0.75000000 1.0 O O7 1 0.74063700 0.74063700 0.25936300 1.0 O O8 1 0.25936300 0.25936300 0.74063700 1.0 O O9 1 0.74063700 0.25936300 0.74063700 1.0 O O10 1 0.25936300 0.74063700 0.74063700 1.0 O O11 1 0.74063700 0.25936300 0.25936300 1.0 O O12 1 0.25936300 0.74063700 0.25936300 1.0