data_[Lu8Pd4O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Lu  1.2700  1.7500  1.0010
  Pd  2.2000  1.4000  0.8462
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Cmce]
_cell_length_a [11.6301]
_cell_length_b [5.5348]
_cell_length_c [5.5310]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [64]
_chemical_formula_structural [Lu2PdO4]
_chemical_formula_sum '[Lu8 Pd4 O16]'
_cell_volume [356.0324]
_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
[
  Lu  Lu0  8  0.1615  0.0000  0.5000  1
  Pd  Pd1  4  0.0000  0.0000  0.0000  1
  O  O2  8  0.0000  0.1687  0.6687  1
  O  O3  8  0.2500  0.2407  0.2500  1
]