data_[Ce20Ag4Hg4Os8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Ag  1.9300  1.6000  1.0867
  Hg  2.0000  1.5000  1.2450
  Os  2.2000  1.3000  0.6730
]
_symmetry_space_group_name_H-M [I4/mcm]
_cell_length_a [7.8016]
_cell_length_b [7.8016]
_cell_length_c [14.9128]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [140]
_chemical_formula_structural [Ce5AgHgOs2]
_chemical_formula_sum '[Ce20 Ag4 Hg4 Os8]'
_cell_volume [907.6632]
_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
[
  Ce  Ce0  16  0.2108  0.2892  0.3771  1.0
  Ce  Ce1  4  0.0000  0.0000  0.0000  1.0
  Ag  Ag2  4  0.0000  0.5000  0.2500  1.0
  Hg  Hg3  4  0.0000  0.0000  0.2500  1.0
  Os  Os4  8  0.1187  0.6187  0.5000  1.0
]