data_[Na8B8Pd24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  B  2.0400  0.8500  0.4100
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.8529]
_cell_length_b [12.0366]
_cell_length_c [5.2776]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.4275]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [NaBPd3]
_chemical_formula_sum '[Na8 B8 Pd24]'
_cell_volume [625.3381]
_cell_formula_units_Z [8]
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  8  0.1335  0.4283  0.5708  1
  B  B1  4  0.0000  0.0671  0.7500  1
  B  B2  4  0.0000  0.2059  0.2500  1
  Pd  Pd3  8  0.1183  0.0655  0.0939  1
  Pd  Pd4  8  0.1225  0.1884  0.5926  1
  Pd  Pd5  8  0.1385  0.3050  0.0868  1
]