# generated using pymatgen data_Ba4Y2Cu6O13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.90917500 _cell_length_b 7.72064000 _cell_length_c 11.97204500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba4Y2Cu6O13 _chemical_formula_sum 'Ba4 Y2 Cu6 O13' _cell_volume 361.33227530 _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 0.24276900 0.18770000 1.0 Ba Ba1 1 0.50000000 0.75723100 0.81230000 1.0 Ba Ba2 1 0.50000000 0.75723100 0.18770000 1.0 Ba Ba3 1 0.50000000 0.24276900 0.81230000 1.0 Y Y4 1 0.50000000 0.74902300 0.50000000 1.0 Y Y5 1 0.50000000 0.25097700 0.50000000 1.0 Cu Cu6 1 0.00000000 0.50000000 0.35996700 1.0 Cu Cu7 1 0.00000000 0.50000000 0.64003300 1.0 Cu Cu8 1 0.00000000 0.00000000 0.35984500 1.0 Cu Cu9 1 0.00000000 0.00000000 0.64015500 1.0 Cu Cu10 1 0.00000000 0.50000000 0.00000000 1.0 Cu Cu11 1 0.00000000 0.00000000 0.00000000 1.0 O O12 1 0.00000000 0.50000000 0.14941500 1.0 O O13 1 0.00000000 0.50000000 0.85058500 1.0 O O14 1 0.00000000 0.00000000 0.15844200 1.0 O O15 1 0.00000000 0.00000000 0.84155800 1.0 O O16 1 0.50000000 0.50000000 0.37929700 1.0 O O17 1 0.50000000 0.50000000 0.62070300 1.0 O O18 1 0.50000000 0.00000000 0.37908600 1.0 O O19 1 0.50000000 0.00000000 0.62091400 1.0 O O20 1 0.00000000 0.25030600 0.62025800 1.0 O O21 1 0.00000000 0.74969400 0.37974200 1.0 O O22 1 0.00000000 0.25030600 0.37974200 1.0 O O23 1 0.00000000 0.74969400 0.62025800 1.0 O O24 1 0.50000000 0.00000000 0.00000000 1.0