# generated using pymatgen data_Ba8PrY3(Cu3O7)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.85647700 _cell_length_b 3.93759600 _cell_length_c 47.28324300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba8PrY3(Cu3O7)4 _chemical_formula_sum 'Ba8 Pr1 Y3 Cu12 O28' _cell_volume 718.00779055 _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 0.17023700 1.0 Ba Ba1 1 0.50000000 0.50000000 0.92031000 1.0 Ba Ba2 1 0.50000000 0.50000000 0.67035100 1.0 Ba Ba3 1 0.50000000 0.50000000 0.41959700 1.0 Ba Ba4 1 0.50000000 0.50000000 0.32964900 1.0 Ba Ba5 1 0.50000000 0.50000000 0.07969000 1.0 Ba Ba6 1 0.50000000 0.50000000 0.82976300 1.0 Ba Ba7 1 0.50000000 0.50000000 0.58040300 1.0 Pr Pr8 1 0.50000000 0.50000000 0.50000000 1.0 Y Y9 1 0.50000000 0.50000000 0.24998800 1.0 Y Y10 1 0.50000000 0.50000000 0.00000000 1.0 Y Y11 1 0.50000000 0.50000000 0.75001200 1.0 Cu Cu12 1 0.00000000 0.00000000 0.37472900 1.0 Cu Cu13 1 0.00000000 0.00000000 0.12500100 1.0 Cu Cu14 1 0.00000000 0.00000000 0.87499900 1.0 Cu Cu15 1 0.00000000 0.00000000 0.62527100 1.0 Cu Cu16 1 0.00000000 0.00000000 0.21300200 1.0 Cu Cu17 1 0.00000000 0.00000000 0.96302100 1.0 Cu Cu18 1 0.00000000 0.00000000 0.71303300 1.0 Cu Cu19 1 0.00000000 0.00000000 0.46109400 1.0 Cu Cu20 1 0.00000000 0.00000000 0.28696700 1.0 Cu Cu21 1 0.00000000 0.00000000 0.03697900 1.0 Cu Cu22 1 0.00000000 0.00000000 0.78699800 1.0 Cu Cu23 1 0.00000000 0.00000000 0.53890600 1.0 O O24 1 0.50000000 0.00000000 0.21978800 1.0 O O25 1 0.50000000 0.00000000 0.96979200 1.0 O O26 1 0.50000000 0.00000000 0.71981200 1.0 O O27 1 0.50000000 0.00000000 0.46749600 1.0 O O28 1 0.50000000 0.00000000 0.28018800 1.0 O O29 1 0.50000000 0.00000000 0.03020800 1.0 O O30 1 0.50000000 0.00000000 0.78021200 1.0 O O31 1 0.50000000 0.00000000 0.53250400 1.0 O O32 1 0.00000000 0.00000000 0.16476100 1.0 O O33 1 0.00000000 0.00000000 0.91473000 1.0 O O34 1 0.00000000 0.00000000 0.66496900 1.0 O O35 1 0.00000000 0.00000000 0.41430000 1.0 O O36 1 0.00000000 0.00000000 0.33503100 1.0 O O37 1 0.00000000 0.00000000 0.08527000 1.0 O O38 1 0.00000000 0.00000000 0.83523900 1.0 O O39 1 0.00000000 0.00000000 0.58570000 1.0 O O40 1 0.00000000 0.50000000 0.37458400 1.0 O O41 1 0.00000000 0.50000000 0.12495000 1.0 O O42 1 0.00000000 0.50000000 0.87505000 1.0 O O43 1 0.00000000 0.50000000 0.62541600 1.0 O O44 1 0.00000000 0.50000000 0.21951000 1.0 O O45 1 0.00000000 0.50000000 0.96953000 1.0 O O46 1 0.00000000 0.50000000 0.71954300 1.0 O O47 1 0.00000000 0.50000000 0.46718000 1.0 O O48 1 0.00000000 0.50000000 0.28045700 1.0 O O49 1 0.00000000 0.50000000 0.03047000 1.0 O O50 1 0.00000000 0.50000000 0.78049000 1.0 O O51 1 0.00000000 0.50000000 0.53282000 1.0