data_[Cd28In2Hg2]
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
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [10.4032]
_cell_length_b [6.7973]
_cell_length_c [10.4807]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [Cd14InHg]
_chemical_formula_sum '[Cd28 In2 Hg2]'
_cell_volume [741.1249]
_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
[
  Cd  Cd0  8  0.2458  0.2442  0.6264  1
  Cd  Cd1  4  0.0000  0.2473  0.4687  1
  Cd  Cd2  4  0.2468  0.0000  0.8786  1
  Cd  Cd3  4  0.2503  0.0000  0.3721  1
  Cd  Cd4  4  0.5000  0.2421  0.7785  1
  Cd  Cd5  2  0.0000  0.0000  0.2174  1
  Cd  Cd6  2  0.0000  0.0000  0.7206  1
  In  In7  2  0.5000  0.0000  0.0352  1
  Hg  Hg8  2  0.5000  0.0000  0.5252  1
]