data_[Cs2Cd1Hg6Pd1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Cd  1.6900  1.5500  1.0900
  Hg  2.0000  1.5000  1.2450
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [7.6102]
_cell_length_b [7.6102]
_cell_length_c [6.5964]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Cs2CdHg6Pd]
_chemical_formula_sum '[Cs2 Cd1 Hg6 Pd1]'
_cell_volume [330.8480]
_cell_formula_units_Z [1]
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
[
  Cs  Cs0  2  0.3333  0.6667  0.6974  1.0
  Cd  Cd1  1  0.0000  0.0000  0.5000  1.0
  Hg  Hg2  6  0.1902  0.8098  0.1951  1.0
  Pd  Pd3  1  0.0000  0.0000  0.0000  1.0
]