data_[La8Cd4Ru8]
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
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [10.5346]
_cell_length_b [5.5357]
_cell_length_c [8.5603]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.6493]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [La2CdRu2]
_chemical_formula_sum '[La8 Cd4 Ru8]'
_cell_volume [472.9948]
_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  0.1471  0.3533  0.1416  1.0
  Cd  Cd1  4  0.0000  0.1291  0.7500  1.0
  Ru  Ru2  8  0.1467  0.1672  0.5275  1.0
]