data_[Na4Ga12Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Ga  1.8100  1.3000  0.7600
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [8.1494]
_cell_length_b [4.1314]
_cell_length_c [11.5776]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [NaGa3Pd]
_chemical_formula_sum '[Na4 Ga12 Pd4]'
_cell_volume [389.7966]
_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  0.1723  0.2500  0.0008  1.0
  Ga  Ga1  4  0.0622  0.2500  0.4132  1.0
  Ga  Ga2  4  0.0835  0.7500  0.2057  1.0
  Ga  Ga3  4  0.1639  0.7500  0.7817  1.0
  Pd  Pd4  4  0.1251  0.2500  0.6341  1.0
]