data_[La16Cd4Re4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Cd  1.6900  1.5500  1.0900
  Re  1.9000  1.3500  0.7125
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.2077]
_cell_length_b [13.6790]
_cell_length_c [6.4046]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.6446]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [La4CdRe]
_chemical_formula_sum '[La16 Cd4 Re4]'
_cell_volume [759.7227]
_cell_formula_units_Z [4]
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
[
  La  La0  8  0.1078  0.1680  0.5547  1
  La  La1  8  0.2196  0.4221  0.8748  1
  Cd  Cd2  4  0.0000  0.3775  0.2500  1
  Re  Re3  4  0.0000  0.0014  0.2500  1
]