data_[Na2Be4Pd2F16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Be  1.5700  1.0500  0.5900
  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 [7.8738]
_cell_length_b [5.4463]
_cell_length_c [7.1792]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.9288]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [NaBe2PdF8]
_chemical_formula_sum '[Na2 Be4 Pd2 F16]'
_cell_volume [307.6952]
_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  2  0.0000  0.0000  0.5000  1.0
  Be  Be1  4  0.1373  0.5000  0.7650  1.0
  Pd  Pd2  2  0.0000  0.0000  0.0000  1.0
  F  F3  8  0.0235  0.2608  0.7833  1.0
  F  F4  4  0.2298  0.5000  0.5906  1.0
  F  F5  4  0.2465  0.0000  0.0414  1.0
]