data_[Cd2Sn2Hg4Bi2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Sn  1.9600  1.4500  0.8300
  Hg  2.0000  1.5000  1.2450
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.2674]
_cell_length_b [4.7690]
_cell_length_c [8.8064]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.6250]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CdSnHg2Bi]
_chemical_formula_sum '[Cd2 Sn2 Hg4 Bi2]'
_cell_volume [290.8854]
_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  2  0.1769  0.7500  0.2861  1.0
  Sn  Sn1  2  0.3917  0.2500  0.8420  1.0
  Hg  Hg2  2  0.1245  0.2500  0.4813  1.0
  Hg  Hg3  2  0.4953  0.2500  0.3505  1.0
  Bi  Bi4  2  0.1643  0.7500  0.9335  1.0
]