data_[Bi4Pd4O12]
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 [P2_1/m]
_cell_length_a [5.8355]
_cell_length_b [7.4601]
_cell_length_c [6.3518]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.8761]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [BiPdO3]
_chemical_formula_sum '[Bi4 Pd4 O12]'
_cell_volume [267.2459]
_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  2  0.0375  0.7500  0.0660  1.0
  Bi  Bi1  2  0.4889  0.2500  0.4513  1.0
  Pd  Pd2  2  0.0000  0.0000  0.5000  1.0
  Pd  Pd3  2  0.5000  0.0000  0.0000  1.0
  O  O4  4  0.1467  0.5365  0.8300  1.0
  O  O5  4  0.3737  0.5501  0.2670  1.0
  O  O6  2  0.1471  0.2500  0.5267  1.0
  O  O7  2  0.3888  0.2500  0.0514  1.0
]