# generated using pymatgen data_Zr5AlNi4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.24026700 _cell_length_b 7.24026700 _cell_length_c 6.61255100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr5AlNi4 _chemical_formula_sum 'Zr10 Al2 Ni8' _cell_volume 346.63961895 _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 Zr Zr0 1 0.32042200 0.82042200 0.25000000 1.0 Zr Zr1 1 0.67957800 0.17957800 0.25000000 1.0 Zr Zr2 1 0.17957800 0.32042200 0.75000000 1.0 Zr Zr3 1 0.82042200 0.67957800 0.75000000 1.0 Zr Zr4 1 0.83873800 0.66126200 0.25000000 1.0 Zr Zr5 1 0.16126200 0.33873800 0.25000000 1.0 Zr Zr6 1 0.66126200 0.16126200 0.75000000 1.0 Zr Zr7 1 0.33873800 0.83873800 0.75000000 1.0 Zr Zr8 1 0.00000000 0.00000000 0.00000000 1.0 Zr Zr9 1 0.50000000 0.50000000 0.50000000 1.0 Al Al10 1 0.00000000 0.00000000 0.50000000 1.0 Al Al11 1 0.50000000 0.50000000 0.00000000 1.0 Ni Ni12 1 0.12481500 0.62455000 0.97609500 1.0 Ni Ni13 1 0.87518500 0.37545000 0.97609500 1.0 Ni Ni14 1 0.37518500 0.12455000 0.47609500 1.0 Ni Ni15 1 0.62481500 0.87545000 0.47609500 1.0 Ni Ni16 1 0.87545000 0.37518500 0.52390500 1.0 Ni Ni17 1 0.12455000 0.62481500 0.52390500 1.0 Ni Ni18 1 0.62455000 0.87518500 0.02390500 1.0 Ni Ni19 1 0.37545000 0.12481500 0.02390500 1.0