# generated using pymatgen data_Zr5InSnBi2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.90727109 _cell_length_b 8.90727042 _cell_length_c 5.97397766 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.88994125 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr5InSnBi2 _chemical_formula_sum 'Zr10 In2 Sn2 Bi4' _cell_volume 410.92646222 _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 0.66713569 0.33052179 0.00314017 1.0 Zr Zr1 1 0.33052179 0.66713569 0.00314017 1.0 Zr Zr2 1 0.33052179 0.66713569 0.49685983 1.0 Zr Zr3 1 0.66713569 0.33052179 0.49685983 1.0 Zr Zr4 1 0.72239473 0.72239473 0.75000000 1.0 Zr Zr5 1 0.27844334 0.99963627 0.75000000 1.0 Zr Zr6 1 0.99963627 0.27844334 0.75000000 1.0 Zr Zr7 1 0.27920061 0.27920061 0.25000000 1.0 Zr Zr8 1 0.72053374 0.00543617 0.25000000 1.0 Zr Zr9 1 0.00543617 0.72053374 0.25000000 1.0 In In10 1 0.00011118 0.00011118 0.00224953 1.0 In In11 1 0.00011118 0.00011118 0.49775047 1.0 Sn Sn12 1 0.38310700 0.00083908 0.25000000 1.0 Sn Sn13 1 0.00083908 0.38310700 0.25000000 1.0 Bi Bi14 1 0.38488189 0.38488189 0.75000000 1.0 Bi Bi15 1 0.61350764 0.99886670 0.75000000 1.0 Bi Bi16 1 0.99886670 0.61350764 0.75000000 1.0 Bi Bi17 1 0.61761652 0.61761652 0.25000000 1.0