data_[Ce16Ru4Pt2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Ru  2.2000  1.3000  0.6610
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.4291]
_cell_length_b [5.3492]
_cell_length_c [6.2024]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.7605]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ce8Ru2Pt]
_chemical_formula_sum '[Ce16 Ru4 Pt2]'
_cell_volume [540.7082]
_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
[
  Ce  Ce0  4  0.0217  0.0000  0.2619  1.0
  Ce  Ce1  4  0.0971  0.5000  0.6905  1.0
  Ce  Ce2  4  0.1782  0.5000  0.3169  1.0
  Ce  Ce3  4  0.2059  0.0000  0.0898  1.0
  Ru  Ru4  4  0.1624  0.0000  0.5809  1.0
  Pt  Pt5  2  0.0000  0.5000  0.0000  1.0
]