data_[Ce8Cu8Pt16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Cu  1.9000  1.3500  0.8200
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [14.9434]
_cell_length_b [7.1511]
_cell_length_c [5.4461]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [CeCuPt2]
_chemical_formula_sum '[Ce8 Cu8 Pt16]'
_cell_volume [581.9787]
_cell_formula_units_Z [8]
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
[
  Ce  Ce0  4  0.1072  0.2500  0.7688  1
  Ce  Ce1  4  0.1424  0.7500  0.5139  1
  Cu  Cu2  4  0.0710  0.7500  0.0081  1
  Cu  Cu3  4  0.1802  0.2500  0.2807  1
  Pt  Pt4  8  0.0336  0.0475  0.2667  1
  Pt  Pt5  8  0.2157  0.5480  0.0438  1
]