data_[Li10Zn10Cu4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Zn  1.6500  1.3500  0.8800
  Cu  1.9000  1.3500  0.8200
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.5222]
_cell_length_b [4.3948]
_cell_length_c [11.2851]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.0839]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li5Zn5Cu2]
_chemical_formula_sum '[Li10 Zn10 Cu4]'
_cell_volume [361.8517]
_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
[
  Li  Li0  4  0.1912  0.5000  0.0811  1
  Li  Li1  4  0.2323  0.0000  0.6767  1
  Li  Li2  2  0.0000  0.5000  0.5000  1
  Zn  Zn3  4  0.1070  0.5000  0.8020  1
  Zn  Zn4  4  0.1426  0.0000  0.4390  1
  Zn  Zn5  2  0.0000  0.0000  0.0000  1
  Cu  Cu6  4  0.0624  0.0000  0.2163  1
]