data_[Cr4Cu8Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cr  1.6600  1.4000  0.9400
  Cu  1.9000  1.3500  0.8200
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [4.0299]
_cell_length_b [12.0773]
_cell_length_c [6.9635]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [CrCu2Pd3]
_chemical_formula_sum '[Cr4 Cu8 Pd12]'
_cell_volume [338.9132]
_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
[
  Cr  Cr0  4  0.0000  0.3408  0.0000  1
  Cu  Cu1  4  0.0000  0.3301  0.5000  1
  Cu  Cu2  2  0.0000  0.0000  0.0000  1
  Cu  Cu3  2  0.0000  0.0000  0.5000  1
  Pd  Pd4  8  0.0000  0.1672  0.2480  1
  Pd  Pd5  4  0.0000  0.5000  0.2587  1
]