data_[Na4Bi8Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Bi  2.0200  1.6000  1.0350
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.4113]
_cell_length_b [3.8942]
_cell_length_c [9.6654]
_cell_angle_alpha [90.0000]
_cell_angle_beta [121.9005]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [NaBi2Pd3]
_chemical_formula_sum '[Na4 Bi8 Pd12]'
_cell_volume [524.4145]
_cell_formula_units_Z [4]
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  0.0925  0.0000  0.9650  1.0
  Bi  Bi1  4  0.0969  0.5000  0.2760  1.0
  Bi  Bi2  4  0.2141  0.0000  0.7976  1.0
  Pd  Pd3  4  0.0687  0.5000  0.6722  1.0
  Pd  Pd4  4  0.0770  0.0000  0.4614  1.0
  Pd  Pd5  4  0.2474  0.5000  0.6139  1.0
]