# generated using pymatgen data_Ba4Nd2Cu6NiO15 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.94340500 _cell_length_b 3.90975500 _cell_length_c 25.11209191 _cell_angle_alpha 85.53523307 _cell_angle_beta 85.49672498 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba4Nd2Cu6NiO15 _chemical_formula_sum 'Ba4 Nd2 Cu6 Ni1 O15' _cell_volume 384.79806722 _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 0.54184800 0.54184800 0.91630400 1.0 Ba Ba1 1 0.45784400 0.45784400 0.08431300 1.0 Ba Ba2 1 0.69297900 0.69297900 0.61404100 1.0 Ba Ba3 1 0.30710700 0.30710700 0.38578700 1.0 Nd Nd4 1 0.61721800 0.61721800 0.76556300 1.0 Nd Nd5 1 0.38212700 0.38212700 0.23574500 1.0 Cu Cu6 1 0.23797100 0.23797100 0.52405800 1.0 Cu Cu7 1 0.76229700 0.76229700 0.47540700 1.0 Cu Cu8 1 0.99991100 0.99991100 0.00017800 1.0 Cu Cu9 1 0.08108800 0.08108800 0.83782400 1.0 Cu Cu10 1 0.91899100 0.91899100 0.16201800 1.0 Cu Cu11 1 0.15401600 0.15401600 0.69196800 1.0 Ni Ni12 1 0.84404100 0.84404100 0.31191700 1.0 O O13 1 0.58733000 0.08733000 0.82533900 1.0 O O14 1 0.41283400 0.91283400 0.17433100 1.0 O O15 1 0.03754800 0.03754800 0.92490300 1.0 O O16 1 0.96268600 0.96268600 0.07462800 1.0 O O17 1 0.24668800 0.74668800 0.50662500 1.0 O O18 1 0.75376700 0.25376700 0.49246700 1.0 O O19 1 0.19806300 0.19806300 0.60387500 1.0 O O20 1 0.80312500 0.80312500 0.39375000 1.0 O O21 1 0.14802700 0.64802700 0.70394500 1.0 O O22 1 0.85214400 0.35214400 0.29571100 1.0 O O23 1 0.08689200 0.58689200 0.82621600 1.0 O O24 1 0.91321200 0.41321200 0.17357700 1.0 O O25 1 0.64836100 0.14836100 0.70327900 1.0 O O26 1 0.35179000 0.85179000 0.29642000 1.0 O O27 1 0.50009500 0.00009500 0.99981000 1.0