data_[Pt4Rh8]
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
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.2496]
_cell_length_b [2.7499]
_cell_length_c [6.5788]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.9398]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [PtRh2]
_chemical_formula_sum '[Pt4 Rh8]'
_cell_volume [178.2943]
_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
[
  Pt  Pt0  4  0.0272  0.0000  0.8030  1.0
  Rh  Rh1  4  0.1430  0.5000  0.5297  1.0
  Rh  Rh2  4  0.1970  0.5000  0.1402  1.0
]