# generated using pymatgen data_ZrSn _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.27208407 _cell_length_b 8.27208407 _cell_length_c 5.45692600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 141.00628093 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrSn _chemical_formula_sum 'Zr5 Sn5' _cell_volume 234.95838535 _cell_formula_units_Z 5 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 0.05989900 0.44541100 0.00000000 1.0 Zr Zr1 1 0.98976700 0.60056000 0.50000000 1.0 Zr Zr2 1 0.87173600 0.87173600 0.50000000 1.0 Zr Zr3 1 0.44541100 0.05989900 0.00000000 1.0 Zr Zr4 1 0.60056000 0.98976700 0.50000000 1.0 Sn Sn5 1 0.21185300 0.43294500 0.50000000 1.0 Sn Sn6 1 0.85620600 0.63854500 0.00000000 1.0 Sn Sn7 1 0.63854500 0.85620600 0.00000000 1.0 Sn Sn8 1 0.22641200 0.22641200 0.00000000 1.0 Sn Sn9 1 0.43294500 0.21185300 0.50000000 1.0