data_[Ba4Cd10Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Cd  1.6900  1.5500  1.0900
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.6706]
_cell_length_b [6.0976]
_cell_length_c [8.6564]
_cell_angle_alpha [90.0000]
_cell_angle_beta [126.4329]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba2Cd5Pd4]
_chemical_formula_sum '[Ba4 Cd10 Pd8]'
_cell_volume [580.5460]
_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
[
  Ba  Ba0  4  0.2273  0.5000  0.7942  1.0
  Cd  Cd1  8  0.0502  0.2543  0.2520  1.0
  Cd  Cd2  2  0.0000  0.0000  0.5000  1.0
  Pd  Pd3  4  0.1240  0.5000  0.0564  1.0
  Pd  Pd4  4  0.2240  0.0000  0.5542  1.0
]