# generated using pymatgen data_NdIn2Cu4Ni5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.22592246 _cell_length_b 8.22592246 _cell_length_c 4.96747680 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural NdIn2Cu4Ni5 _chemical_formula_sum 'Nd2 In4 Cu8 Ni10' _cell_volume 336.12829290 _cell_formula_units_Z 2 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 Nd Nd0 1 0.00000000 0.00000000 0.00000000 1.0 Nd Nd1 1 0.50000000 0.50000000 0.00000000 1.0 In In2 1 0.12357042 0.62357042 0.00000000 1.0 In In3 1 0.87642958 0.37642958 0.00000000 1.0 In In4 1 0.62357042 0.87642958 0.00000000 1.0 In In5 1 0.37642958 0.12357042 0.00000000 1.0 Cu Cu6 1 0.20845665 0.06727977 0.50000000 1.0 Cu Cu7 1 0.79154335 0.93272023 0.50000000 1.0 Cu Cu8 1 0.06727977 0.79154335 0.50000000 1.0 Cu Cu9 1 0.70845665 0.43272023 0.50000000 1.0 Cu Cu10 1 0.93272023 0.20845665 0.50000000 1.0 Cu Cu11 1 0.29154335 0.56727977 0.50000000 1.0 Cu Cu12 1 0.56727977 0.70845665 0.50000000 1.0 Cu Cu13 1 0.43272023 0.29154335 0.50000000 1.0 Ni Ni14 1 0.50000000 0.00000000 0.50000000 1.0 Ni Ni15 1 0.00000000 0.50000000 0.50000000 1.0 Ni Ni16 1 0.67438609 0.17438609 0.24787847 1.0 Ni Ni17 1 0.32561391 0.82561391 0.75212153 1.0 Ni Ni18 1 0.32561391 0.82561391 0.24787847 1.0 Ni Ni19 1 0.17438609 0.32561391 0.24787847 1.0 Ni Ni20 1 0.17438609 0.32561391 0.75212153 1.0 Ni Ni21 1 0.67438609 0.17438609 0.75212153 1.0 Ni Ni22 1 0.82561391 0.67438609 0.75212153 1.0 Ni Ni23 1 0.82561391 0.67438609 0.24787847 1.0