data_[Na4Bi12Pd24]
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 [Cmc2_1]
_cell_length_a [10.7460]
_cell_length_b [12.6698]
_cell_length_c [6.1148]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Na(BiPd2)3]
_chemical_formula_sum '[Na4 Bi12 Pd24]'
_cell_volume [832.5255]
_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  0.0000  0.1981  0.0071  1.0
  Bi  Bi1  8  0.2038  0.0703  0.4867  1.0
  Bi  Bi2  4  0.0000  0.4061  0.7318  1.0
  Pd  Pd3  8  0.1334  0.3997  0.3427  1.0
  Pd  Pd4  8  0.2271  0.2729  0.6977  1.0
  Pd  Pd5  4  0.0000  0.0040  0.7423  1.0
  Pd  Pd6  4  0.0000  0.2087  0.4791  1.0
]