# generated using pymatgen data_Mn4Al(CuO4)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.31892491 _cell_length_b 6.31892491 _cell_length_c 6.31892491 _cell_angle_alpha 109.47122063 _cell_angle_beta 109.47122063 _cell_angle_gamma 109.47122063 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn4Al(CuO4)3 _chemical_formula_sum 'Mn4 Al1 Cu3 O12' _cell_volume 194.22614644 _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 Mn Mn0 1 0.00000000 0.00000000 0.50000000 1.0 Mn Mn1 1 0.00000000 0.50000000 0.00000000 1.0 Mn Mn2 1 0.50000000 0.00000000 0.00000000 1.0 Mn Mn3 1 0.50000000 0.50000000 0.50000000 1.0 Al Al4 1 0.00000000 0.00000000 0.00000000 1.0 Cu Cu5 1 0.00000000 0.50000000 0.50000000 1.0 Cu Cu6 1 0.50000000 0.00000000 0.50000000 1.0 Cu Cu7 1 0.50000000 0.50000000 0.00000000 1.0 O O8 1 0.29337900 0.12233500 0.82895600 1.0 O O9 1 0.70662100 0.87766500 0.17104400 1.0 O O10 1 0.70662100 0.53557700 0.82895600 1.0 O O11 1 0.46442300 0.17104400 0.29337900 1.0 O O12 1 0.17104400 0.29337900 0.46442300 1.0 O O13 1 0.82895600 0.29337900 0.12233500 1.0 O O14 1 0.87766500 0.17104400 0.70662100 1.0 O O15 1 0.82895600 0.70662100 0.53557700 1.0 O O16 1 0.29337900 0.46442300 0.17104400 1.0 O O17 1 0.53557700 0.82895600 0.70662100 1.0 O O18 1 0.17104400 0.70662100 0.87766500 1.0 O O19 1 0.12233500 0.82895600 0.29337900 1.0