data_[Pt12Rh4Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pt  2.2800  1.3500  0.8050
  Rh  2.2800  1.3500  0.7450
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.1487]
_cell_length_b [5.9484]
_cell_length_c [9.7877]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.0403]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Pt6Rh2Au]
_chemical_formula_sum '[Pt12 Rh4 Au2]'
_cell_volume [298.6032]
_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
[
  Pt  Pt0  4  0.0303  0.1886  0.4280  1
  Rh  Rh1  4  0.1606  0.1814  0.6934  1
  Pt  Pt2  4  0.2879  0.5834  0.4190  1
  Pt  Pt3  4  0.3398  0.5930  0.7240  1
  Au  Au4  2  0.5000  0.0000  0.5000  1
]