# generated using pymatgen data_Ba6Pr2Y(CuO2)12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.93820300 _cell_length_b 3.91559800 _cell_length_c 41.54960195 _cell_angle_alpha 92.70075199 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba6Pr2Y(CuO2)12 _chemical_formula_sum 'Ba6 Pr2 Y1 Cu12 O24' _cell_volume 640.00063717 _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 0.54522600 0.09045300 1.0 Ba Ba1 1 0.50000000 0.21222300 0.42444600 1.0 Ba Ba2 1 0.50000000 0.87887000 0.75773900 1.0 Ba Ba3 1 0.50000000 0.12113000 0.24226100 1.0 Ba Ba4 1 0.50000000 0.78777700 0.57555400 1.0 Ba Ba5 1 0.50000000 0.45477400 0.90954700 1.0 Pr Pr6 1 0.50000000 0.16669400 0.33338700 1.0 Pr Pr7 1 0.50000000 0.83330600 0.66661300 1.0 Y Y8 1 0.50000000 0.50000000 0.00000000 1.0 Cu Cu9 1 0.00000000 0.07077300 0.14154500 1.0 Cu Cu10 1 0.00000000 0.73756300 0.47512700 1.0 Cu Cu11 1 0.00000000 0.40428400 0.80856800 1.0 Cu Cu12 1 0.00000000 0.59571600 0.19143200 1.0 Cu Cu13 1 0.00000000 0.26243700 0.52487300 1.0 Cu Cu14 1 0.00000000 0.92922700 0.85845500 1.0 Cu Cu15 1 0.00000000 0.02058500 0.04116900 1.0 Cu Cu16 1 0.00000000 0.68825200 0.37650200 1.0 Cu Cu17 1 0.00000000 0.35491400 0.70982900 1.0 Cu Cu18 1 0.00000000 0.64508600 0.29017100 1.0 Cu Cu19 1 0.00000000 0.31174800 0.62349800 1.0 Cu Cu20 1 0.00000000 0.97941500 0.95883100 1.0 O O21 1 0.00000000 0.04847800 0.09695700 1.0 O O22 1 0.00000000 0.71536700 0.43073300 1.0 O O23 1 0.00000000 0.38204900 0.76409900 1.0 O O24 1 0.00000000 0.61795100 0.23590100 1.0 O O25 1 0.00000000 0.28463300 0.56926700 1.0 O O26 1 0.00000000 0.95152200 0.90304300 1.0 O O27 1 0.50000000 0.01748100 0.03496100 1.0 O O28 1 0.50000000 0.68540100 0.37080300 1.0 O O29 1 0.50000000 0.35207000 0.70414000 1.0 O O30 1 0.50000000 0.64793000 0.29586000 1.0 O O31 1 0.50000000 0.31459900 0.62919700 1.0 O O32 1 0.50000000 0.98251900 0.96503900 1.0 O O33 1 0.00000000 0.57289100 0.14578300 1.0 O O34 1 0.00000000 0.23962700 0.47925400 1.0 O O35 1 0.00000000 0.90638300 0.81276600 1.0 O O36 1 0.00000000 0.09361700 0.18723400 1.0 O O37 1 0.00000000 0.76037300 0.52074600 1.0 O O38 1 0.00000000 0.42710900 0.85421700 1.0 O O39 1 0.00000000 0.51726900 0.03453800 1.0 O O40 1 0.00000000 0.18515300 0.37030400 1.0 O O41 1 0.00000000 0.85181500 0.70363100 1.0 O O42 1 0.00000000 0.14818500 0.29636900 1.0 O O43 1 0.00000000 0.81484700 0.62969600 1.0 O O44 1 0.00000000 0.48273100 0.96546200 1.0