# generated using pymatgen data_Ba4PrLu(Cu3O7)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.85332897 _cell_length_b 3.93705867 _cell_length_c 23.77502289 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba4PrLu(Cu3O7)2 _chemical_formula_sum 'Ba4 Pr1 Lu1 Cu6 O14' _cell_volume 360.68569477 _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 Ba Ba0 1 0.50000000 0.50000000 0.09179982 1.0 Ba Ba1 1 0.50000000 0.50000000 0.58868215 1.0 Ba Ba2 1 0.50000000 0.50000000 0.40820018 1.0 Ba Ba3 1 0.50000000 0.50000000 0.91131785 1.0 Pr Pr4 1 0.50000000 0.50000000 0.75000000 1.0 Lu Lu5 1 0.50000000 0.50000000 0.25000000 1.0 Cu Cu6 1 -0.00000000 -0.00000000 0.17910919 1.0 Cu Cu7 1 0.00000000 -0.00000000 0.67240848 1.0 Cu Cu8 1 0.00000000 0.00000000 0.32089081 1.0 Cu Cu9 1 -0.00000000 0.00000000 0.82759152 1.0 Cu Cu10 1 -0.00000000 -0.00000000 0.00132987 1.0 Cu Cu11 1 0.00000000 0.00000000 0.49867013 1.0 O O12 1 -0.00000000 0.50000000 0.19210581 1.0 O O13 1 -0.00000000 0.50000000 0.68424572 1.0 O O14 1 0.00000000 0.50000000 0.30789419 1.0 O O15 1 0.00000000 0.50000000 0.81575428 1.0 O O16 1 0.00000000 0.00000000 0.08056986 1.0 O O17 1 -0.00000000 0.00000000 0.57760133 1.0 O O18 1 0.00000000 -0.00000000 0.41943014 1.0 O O19 1 -0.00000000 0.00000000 0.92239867 1.0 O O20 1 0.00000000 0.50000000 0.00174865 1.0 O O21 1 -0.00000000 0.50000000 0.49825135 1.0 O O22 1 0.50000000 0.00000000 0.19255743 1.0 O O23 1 0.50000000 -0.00000000 0.68496578 1.0 O O24 1 0.50000000 0.00000000 0.30744257 1.0 O O25 1 0.50000000 -0.00000000 0.81503422 1.0