data_[Ba8Zn4Pd4O20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Zn  1.6500  1.3500  0.8800
  Pd  2.2000  1.4000  0.8462
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [3.4468]
_cell_length_b [15.4969]
_cell_length_c [10.6702]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Ba2ZnPdO5]
_chemical_formula_sum '[Ba8 Zn4 Pd4 O20]'
_cell_volume [569.9551]
_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
[
  Ba  Ba0  4  0.0000  0.1131  0.6865  1.0
  Ba  Ba1  4  0.0000  0.1262  0.3024  1.0
  Zn  Zn2  4  0.0000  0.4400  0.4550  1.0
  Pd  Pd3  4  0.0000  0.2146  0.0157  1.0
  O  O4  4  0.0000  0.0790  0.0404  1.0
  O  O5  4  0.0000  0.2820  0.6333  1.0
  O  O6  4  0.0000  0.3005  0.3973  1.0
  O  O7  4  0.0000  0.3460  0.9990  1.0
  O  O8  4  0.0000  0.4955  0.2943  1.0
]