data_[Ce6Sb6Pt6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Sb  2.0500  1.4500  0.8300
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Pmma]
_cell_length_a [13.2128]
_cell_length_b [4.1667]
_cell_length_c [8.4576]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [51]
_chemical_formula_structural [CeSbPt]
_chemical_formula_sum '[Ce6 Sb6 Pt6]'
_cell_volume [465.6318]
_cell_formula_units_Z [6]
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  0.0910  0.5000  0.3393  1
  Ce  Ce1  2  0.2500  0.5000  0.7930  1
  Sb  Sb2  4  0.0980  0.0000  0.6492  1
  Sb  Sb3  2  0.2500  0.0000  0.0946  1
  Pt  Pt4  4  0.0978  0.5000  0.0313  1
  Pt  Pt5  2  0.2500  0.0000  0.4183  1
]