data_[Na8Hg10Pd6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Hg  2.0000  1.5000  1.2450
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.0570]
_cell_length_b [5.2565]
_cell_length_c [9.6790]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.5400]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na4Hg5Pd3]
_chemical_formula_sum '[Na8 Hg10 Pd6]'
_cell_volume [558.8867]
_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
[
  Na  Na0  4  0.1473  0.0000  0.7703  1
  Na  Na1  4  0.2342  0.0000  0.4086  1
  Hg  Hg2  4  0.1079  0.0000  0.1322  1
  Hg  Hg3  4  0.1353  0.5000  0.9570  1
  Hg  Hg4  2  0.0000  0.5000  0.5000  1
  Pd  Pd5  4  0.0748  0.5000  0.2397  1
  Pd  Pd6  2  0.0000  0.0000  0.5000  1
]