data_[Ho8Cu4Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Cu  1.9000  1.3500  0.8200
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.2023]
_cell_length_b [3.8385]
_cell_length_c [11.0296]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.7381]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ho2CuPd2]
_chemical_formula_sum '[Ho8 Cu4 Pd8]'
_cell_volume [401.2147]
_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
[
  Ho  Ho0  4  0.0035  0.0000  0.6611  1.0
  Ho  Ho1  4  0.1807  0.0000  0.1090  1.0
  Cu  Cu2  4  0.1995  0.5000  0.3173  1.0
  Pd  Pd3  4  0.0395  0.5000  0.8876  1.0
  Pd  Pd4  4  0.1543  0.5000  0.5452  1.0
]