data_[Cu12Pd4Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cu  1.9000  1.3500  0.8200
  Pd  2.2000  1.4000  0.8462
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.2905]
_cell_length_b [3.7905]
_cell_length_c [5.2936]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.4824]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cu3PdRh]
_chemical_formula_sum '[Cu12 Pd4 Rh4]'
_cell_volume [263.7622]
_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
[
  Cu  Cu0  4  0.0014  0.0000  0.2444  1.0
  Cu  Cu1  4  0.0965  0.5000  0.0434  1.0
  Cu  Cu2  4  0.1967  0.0000  0.3430  1.0
  Pd  Pd3  4  0.1993  0.0000  0.8410  1.0
  Rh  Rh4  4  0.0968  0.5000  0.5368  1.0
]