# generated using pymatgen data_Al5(CuO4)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.79439241 _cell_length_b 5.79439241 _cell_length_c 14.16514491 _cell_angle_alpha 89.69949516 _cell_angle_beta 89.69949516 _cell_angle_gamma 59.67204847 _symmetry_Int_Tables_number 1 _chemical_formula_structural Al5(CuO4)3 _chemical_formula_sum 'Al10 Cu6 O24' _cell_volume 410.50156865 _cell_formula_units_Z 2 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 0.33430100 0.33430100 0.83576600 1.0 Al Al1 1 0.66569900 0.66569900 0.16423400 1.0 Al Al2 1 0.16368100 0.16368100 0.66592500 1.0 Al Al3 1 0.83631900 0.83631900 0.33407500 1.0 Al Al4 1 0.83120200 0.33483200 0.83615300 1.0 Al Al5 1 0.50000000 0.00000000 0.50000000 1.0 Al Al6 1 0.16879800 0.66516800 0.16384700 1.0 Al Al7 1 0.33483200 0.83120200 0.83615300 1.0 Al Al8 1 0.00000000 0.50000000 0.50000000 1.0 Al Al9 1 0.66516800 0.16879800 0.16384700 1.0 Cu Cu10 1 0.83263700 0.83263700 0.95694700 1.0 Cu Cu11 1 0.50153300 0.50153300 0.62020800 1.0 Cu Cu12 1 0.16455100 0.16455100 0.29406800 1.0 Cu Cu13 1 0.83544900 0.83544900 0.70593200 1.0 Cu Cu14 1 0.49846700 0.49846700 0.37979200 1.0 Cu Cu15 1 0.16736300 0.16736300 0.04305300 1.0 O O16 1 0.02102900 0.46030600 0.75471700 1.0 O O17 1 0.65787000 0.13516700 0.41439900 1.0 O O18 1 0.34115200 0.81856700 0.09811200 1.0 O O19 1 0.18143300 0.65884800 0.90188800 1.0 O O20 1 0.86483300 0.34213000 0.58560100 1.0 O O21 1 0.53969400 0.97897100 0.24528300 1.0 O O22 1 0.65918800 0.65918800 0.90218300 1.0 O O23 1 0.31610900 0.31610900 0.57948800 1.0 O O24 1 0.98010800 0.98010800 0.24537300 1.0 O O25 1 0.50016100 0.50016100 0.76338500 1.0 O O26 1 0.18191700 0.18191700 0.42671400 1.0 O O27 1 0.83364200 0.83364200 0.09529800 1.0 O O28 1 0.01989200 0.01989200 0.75462700 1.0 O O29 1 0.68389100 0.68389100 0.42051200 1.0 O O30 1 0.34081200 0.34081200 0.09781700 1.0 O O31 1 0.16635800 0.16635800 0.90470200 1.0 O O32 1 0.81808300 0.81808300 0.57328600 1.0 O O33 1 0.49983900 0.49983900 0.23661500 1.0 O O34 1 0.65884800 0.18143300 0.90188800 1.0 O O35 1 0.34213000 0.86483300 0.58560100 1.0 O O36 1 0.97897100 0.53969400 0.24528300 1.0 O O37 1 0.46030600 0.02102900 0.75471700 1.0 O O38 1 0.13516700 0.65787000 0.41439900 1.0 O O39 1 0.81856700 0.34115200 0.09811200 1.0