# generated using pymatgen data_Ba4NdY(CuO2)8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.92237400 _cell_length_b 3.92689400 _cell_length_c 27.54331400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba4NdY(CuO2)8 _chemical_formula_sum 'Ba4 Nd1 Y1 Cu8 O16' _cell_volume 424.24269506 _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 0.13648600 1.0 Ba Ba1 1 0.00000000 0.50000000 0.63660100 1.0 Ba Ba2 1 0.00000000 0.50000000 0.36339900 1.0 Ba Ba3 1 0.50000000 0.50000000 0.86351400 1.0 Nd Nd4 1 0.00000000 0.50000000 0.50000000 1.0 Y Y5 1 0.50000000 0.50000000 0.00000000 1.0 Cu Cu6 1 0.00000000 0.00000000 0.06237600 1.0 Cu Cu7 1 0.50000000 0.00000000 0.56315000 1.0 Cu Cu8 1 0.50000000 0.00000000 0.43685000 1.0 Cu Cu9 1 0.00000000 0.00000000 0.93762400 1.0 Cu Cu10 1 0.00000000 0.00000000 0.21257100 1.0 Cu Cu11 1 0.50000000 0.00000000 0.71258000 1.0 Cu Cu12 1 0.50000000 0.00000000 0.28742000 1.0 Cu Cu13 1 0.00000000 0.00000000 0.78742900 1.0 O O14 1 0.50000000 0.00000000 0.21855100 1.0 O O15 1 0.00000000 0.00000000 0.71858800 1.0 O O16 1 0.00000000 0.00000000 0.28141200 1.0 O O17 1 0.50000000 0.00000000 0.78144900 1.0 O O18 1 0.50000000 0.00000000 0.05263000 1.0 O O19 1 0.00000000 0.00000000 0.55497300 1.0 O O20 1 0.00000000 0.00000000 0.44502700 1.0 O O21 1 0.50000000 0.00000000 0.94737000 1.0 O O22 1 0.00000000 0.00000000 0.14552900 1.0 O O23 1 0.50000000 0.00000000 0.64567500 1.0 O O24 1 0.50000000 0.00000000 0.35432500 1.0 O O25 1 0.00000000 0.00000000 0.85447100 1.0 O O26 1 0.00000000 0.50000000 0.05270000 1.0 O O27 1 0.50000000 0.50000000 0.55500100 1.0 O O28 1 0.50000000 0.50000000 0.44499900 1.0 O O29 1 0.00000000 0.50000000 0.94730000 1.0