data_[Ga4Cu8Pd20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ga  1.8100  1.3000  0.7600
  Cu  1.9000  1.3500  0.8200
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [I4/mcm]
_cell_length_a [6.4375]
_cell_length_b [6.4375]
_cell_length_c [11.4288]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [140]
_chemical_formula_structural [GaCu2Pd5]
_chemical_formula_sum '[Ga4 Cu8 Pd20]'
_cell_volume [473.6209]
_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
[
  Ga  Ga0  4  0.0000  0.0000  0.2500  1.0
  Cu  Cu1  8  0.1352  0.3648  0.5000  1.0
  Pd  Pd2  16  0.1567  0.3433  0.8431  1.0
  Pd  Pd3  4  0.0000  0.0000  0.0000  1.0
]