data_[Pd6Pt6Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [3.9377]
_cell_length_b [3.9476]
_cell_length_c [15.6741]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Pd3Pt3Rh2]
_chemical_formula_sum '[Pd6 Pt6 Rh4]'
_cell_volume [243.6460]
_cell_formula_units_Z [2]
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
[
  Pd  Pd0  4  0.0000  0.0000  0.3721  1.0
  Pd  Pd1  2  0.0000  0.5000  0.0000  1.0
  Pt  Pt2  4  0.0000  0.0000  0.1280  1.0
  Rh  Rh3  4  0.0000  0.5000  0.2505  1.0
  Pt  Pt4  2  0.0000  0.5000  0.5000  1.0
]