# generated using pymatgen data_Zr3Ta2ZnSn3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.51069909 _cell_length_b 8.51062983 _cell_length_c 5.71951112 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.01289373 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr3Ta2ZnSn3 _chemical_formula_sum 'Zr6 Ta4 Zn2 Sn6' _cell_volume 358.72367196 _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 0.72989447 0.72989909 0.75000000 1.0 Zr Zr1 1 0.27011789 0.99999865 0.75000000 1.0 Zr Zr2 1 0.99998582 0.27005650 0.75000000 1.0 Zr Zr3 1 0.27010553 0.27010091 0.25000000 1.0 Zr Zr4 1 0.72988211 0.00000135 0.25000000 1.0 Zr Zr5 1 0.00001418 0.72994350 0.25000000 1.0 Ta Ta6 1 0.66662326 0.33329541 0.00000014 1.0 Ta Ta7 1 0.33337674 0.66670459 0.99999986 1.0 Ta Ta8 1 0.33337674 0.66670459 0.50000014 1.0 Ta Ta9 1 0.66662326 0.33329541 0.49999986 1.0 Zn Zn10 1 0.00000000 0.00000000 0.00000000 1.0 Zn Zn11 1 0.00000000 0.00000000 0.50000000 1.0 Sn Sn12 1 0.38752770 0.38748564 0.75000000 1.0 Sn Sn13 1 0.61251024 0.99995018 0.75000000 1.0 Sn Sn14 1 0.99999305 0.61235025 0.75000000 1.0 Sn Sn15 1 0.61247230 0.61251436 0.25000000 1.0 Sn Sn16 1 0.38748976 0.00004982 0.25000000 1.0 Sn Sn17 1 0.00000695 0.38764975 0.25000000 1.0