# generated using pymatgen data_ZrSn _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.31523700 _cell_length_b 6.01815600 _cell_length_c 11.69274900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrSn _chemical_formula_sum 'Zr8 Sn8' _cell_volume 374.02678324 _cell_formula_units_Z 8 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 0.00000000 0.00000000 0.82803800 1.0 Zr Zr1 1 0.00000000 0.00000000 0.30606500 1.0 Zr Zr2 1 0.00000000 0.74878100 0.57395300 1.0 Zr Zr3 1 0.00000000 0.25121900 0.57395300 1.0 Zr Zr4 1 0.50000000 0.75121900 0.42604700 1.0 Zr Zr5 1 0.50000000 0.50000000 0.69393500 1.0 Zr Zr6 1 0.50000000 0.50000000 0.17196200 1.0 Zr Zr7 1 0.50000000 0.24878100 0.42604700 1.0 Sn Sn8 1 0.00000000 0.74502900 0.06734100 1.0 Sn Sn9 1 0.00000000 0.50000000 0.80014200 1.0 Sn Sn10 1 0.00000000 0.50000000 0.34503700 1.0 Sn Sn11 1 0.00000000 0.25497100 0.06734100 1.0 Sn Sn12 1 0.50000000 0.00000000 0.65496300 1.0 Sn Sn13 1 0.50000000 0.00000000 0.19985800 1.0 Sn Sn14 1 0.50000000 0.75497100 0.93265900 1.0 Sn Sn15 1 0.50000000 0.24502900 0.93265900 1.0