data_[Ba4Na6Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Na  0.9300  1.8000  1.1600
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.9186]
_cell_length_b [4.6112]
_cell_length_c [8.3548]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.4668]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba2Na3Pd2]
_chemical_formula_sum '[Ba4 Na6 Pd4]'
_cell_volume [457.0884]
_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
[
  Ba  Ba0  4  0.1269  0.5000  0.3673  1
  Na  Na1  4  0.1725  0.5000  0.8534  1
  Na  Na2  2  0.0000  0.0000  0.0000  1
  Pd  Pd3  4  0.0795  0.0000  0.6340  1
]