data_[Cd4In4Ag12Hg4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
  Ag  1.9300  1.6000  1.0867
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.3593]
_cell_length_b [4.8436]
_cell_length_c [5.5122]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.7367]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CdInAg3Hg]
_chemical_formula_sum '[Cd4 In4 Ag12 Hg4]'
_cell_volume [497.4992]
_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
[
  Cd  Cd0  4  0.1217  0.5000  0.2742  1.0
  In  In1  4  0.2075  0.5000  0.8425  1.0
  Ag  Ag2  4  0.0522  0.5000  0.7330  1.0
  Ag  Ag3  4  0.1326  0.0000  0.9553  1.0
  Ag  Ag4  4  0.2067  0.0000  0.5311  1.0
  Hg  Hg5  4  0.0371  0.0000  0.2985  1.0
]