data_[Cu4Pd2O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cu  1.9000  1.3500  0.8200
  Pd  2.2000  1.4000  0.8462
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.7263]
_cell_length_b [3.2218]
_cell_length_c [4.9902]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.3071]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cu2PdO4]
_chemical_formula_sum '[Cu4 Pd2 O8]'
_cell_volume [159.5475]
_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
[
  Cu  Cu0  4  0.1891  0.5000  0.6626  1.0
  Pd  Pd1  2  0.0000  0.0000  0.0000  1.0
  O  O2  4  0.1032  0.5000  0.9218  1.0
  O  O3  4  0.1432  0.0000  0.4128  1.0
]