data_[Bi4Pd4O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Bi  2.0200  1.6000  1.0350
  Pd  2.2000  1.4000  0.8462
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pmna]
_cell_length_a [4.1770]
_cell_length_b [4.9580]
_cell_length_c [12.5753]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [53]
_chemical_formula_structural [BiPdO2]
_chemical_formula_sum '[Bi4 Pd4 O8]'
_cell_volume [260.4270]
_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
[
  Bi  Bi0  4  0.0000  0.1783  0.8656  1
  Pd  Pd1  4  0.0000  0.3131  0.4277  1
  O  O2  4  0.0000  0.0338  0.6833  1
  O  O3  4  0.0000  0.2367  0.0656  1
]