data_[Hf12Pd6O2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hf  1.3000  1.5500  0.8500
  Pd  2.2000  1.4000  0.8462
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.7530]
_cell_length_b [7.3070]
_cell_length_c [10.2105]
_cell_angle_alpha [90.0000]
_cell_angle_beta [120.0590]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Hf6Pd3O]
_chemical_formula_sum '[Hf12 Pd6 O2]'
_cell_volume [371.4983]
_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
[
  Hf  Hf0  4  0.0637  0.0600  0.2370  1
  Hf  Hf1  4  0.2075  0.7265  0.0713  1
  Hf  Hf2  4  0.3825  0.1456  0.0454  1
  Pd  Pd3  4  0.3185  0.1021  0.7162  1
  Pd  Pd4  2  0.5000  0.0000  0.5000  1
  O  O5  2  0.0000  0.0000  0.0000  1
]