data_[Li20Zn4Pd4]
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
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.3521]
_cell_length_b [5.0940]
_cell_length_c [9.6082]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.0444]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Li5ZnPd]
_chemical_formula_sum '[Li20 Zn4 Pd4]'
_cell_volume [450.7134]
_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  0.1457  0.4940  0.0258  1.0
  Li  Li1  8  0.2375  0.0254  0.7010  1.0
  Li  Li2  4  0.0000  0.2670  0.7500  1.0
  Zn  Zn3  4  0.0000  0.0000  0.0000  1.0
  Pd  Pd4  4  0.0000  0.2313  0.2500  1.0
]