data_[Li20Zn4Ni4]
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
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [7.0906]
_cell_length_b [6.6658]
_cell_length_c [9.5603]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.0893]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Li5ZnNi]
_chemical_formula_sum '[Li20 Zn4 Ni4]'
_cell_volume [447.3688]
_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
[
  Li  Li0  8  0.1672  0.3583  0.0818  1.0
  Li  Li1  8  0.2191  0.3279  0.3788  1.0
  Li  Li2  4  0.0000  0.3378  0.7500  1.0
  Zn  Zn3  4  0.0000  0.0513  0.2500  1.0
  Ni  Ni4  4  0.0000  0.0000  0.0000  1.0
]