data_[Zr2Pt16Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  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 [14.3500]
_cell_length_b [3.9787]
_cell_length_c [6.3157]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.4090]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Zr(Pt4Rh)2]
_chemical_formula_sum '[Zr2 Pt16 Rh4]'
_cell_volume [347.6239]
_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
[
  Zr  Zr0  2  0.0000  0.5000  0.0000  1
  Pt  Pt1  4  0.0472  0.0000  0.7256  1
  Pt  Pt2  4  0.0937  0.5000  0.4483  1
  Pt  Pt3  4  0.1361  0.0000  0.1843  1
  Pt  Pt4  4  0.1837  0.5000  0.9139  1
  Rh  Rh5  4  0.2237  0.0000  0.6285  1
]