# generated using pymatgen data_ZrCuSn _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.32630118 _cell_length_b 6.69380110 _cell_length_c 7.71846262 _cell_angle_alpha 89.99977880 _cell_angle_beta 90.00001638 _cell_angle_gamma 90.00000335 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrCuSn _chemical_formula_sum 'Zr4 Cu4 Sn4' _cell_volume 223.52204329 _cell_formula_units_Z 4 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 0.25000005 0.49987832 0.71195450 1.0 Zr Zr1 1 0.25000000 -0.00012013 0.78804720 1.0 Zr Zr2 1 0.74999997 0.50012001 0.28804639 1.0 Zr Zr3 1 0.74999980 0.00012133 0.21195490 1.0 Cu Cu4 1 0.24999881 0.19333706 0.41280523 1.0 Cu Cu5 1 0.25000093 0.69333886 0.08719394 1.0 Cu Cu6 1 0.74999950 0.80666233 0.58719708 1.0 Cu Cu7 1 0.75000102 0.30666359 0.91280334 1.0 Sn Sn8 1 0.24999967 0.78113117 0.41268454 1.0 Sn Sn9 1 0.25000042 0.28113178 0.08731556 1.0 Sn Sn10 1 0.74999937 0.21886733 0.58731585 1.0 Sn Sn11 1 0.75000047 0.71886834 0.91268346 1.0