data_[Ca4Pd2W2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Pd  2.2000  1.4000  0.8462
  W  2.3600  1.3500  0.7667
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [5.6196]
_cell_length_b [8.1326]
_cell_length_c [6.1123]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [Ca2PdWO6]
_chemical_formula_sum '[Ca4 Pd2 W2 O12]'
_cell_volume [279.3440]
_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
[
  Ca  Ca0  4  0.0000  0.2534  0.5765  1
  Pd  Pd1  2  0.0000  0.5000  0.9825  1
  W  W2  2  0.0000  0.0000  0.9731  1
  O  O3  4  0.0000  0.2376  0.9580  1
  O  O4  4  0.2242  0.0000  0.7233  1
  O  O5  4  0.2428  0.5000  0.6793  1
]