data_[Ce6In4Pt6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  In  1.7800  1.5500  0.9400
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [3.6121]
_cell_length_b [4.9323]
_cell_length_c [21.2038]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Ce3In2Pt3]
_chemical_formula_sum '[Ce6 In4 Pt6]'
_cell_volume [377.7611]
_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  0.0000  0.0000  0.3790  1
  Ce  Ce1  2  0.0000  0.5000  0.5000  1
  In  In2  4  0.0000  0.5000  0.2705  1
  Pt  Pt3  4  0.0000  0.0000  0.1141  1
  Pt  Pt4  2  0.0000  0.5000  0.0000  1
]