data_[La24Cu8Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Cu  1.9000  1.3500  0.8200
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [9.9991]
_cell_length_b [10.1661]
_cell_length_c [10.2891]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [La6Cu2Pd]
_chemical_formula_sum '[La24 Cu8 Pd4]'
_cell_volume [1045.9156]
_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
[
  La  La0  8  0.0000  0.3198  0.2415  1
  La  La1  8  0.1947  0.0000  0.3303  1
  La  La2  8  0.2357  0.1695  0.0000  1
  Cu  Cu3  4  0.0000  0.0000  0.1195  1
  Cu  Cu4  4  0.0000  0.1523  0.5000  1
  Pd  Pd5  2  0.0000  0.5000  0.0000  1
  Pd  Pd6  2  0.0000  0.5000  0.5000  1
]