data_[Na6Pd2F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Pd  2.2000  1.4000  0.8462
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.0246]
_cell_length_b [5.7948]
_cell_length_c [5.6852]
_cell_angle_alpha [90.0000]
_cell_angle_beta [121.9360]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na3PdF6]
_chemical_formula_sum '[Na6 Pd2 F12]'
_cell_volume [280.2667]
_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
[
  Na  Na0  4  0.2460  0.0000  0.7175  1
  Na  Na1  2  0.0000  0.0000  0.0000  1
  Pd  Pd2  2  0.0000  0.5000  0.5000  1
  F  F3  8  0.0775  0.2606  0.3488  1
  F  F4  4  0.2400  0.5000  0.8765  1
]