data_[Cd4In2Ag2Hg1]
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 [P3m1]
_cell_length_a [3.1722]
_cell_length_b [3.1722]
_cell_length_c [23.6771]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [156]
_chemical_formula_structural [Cd4In2Ag2Hg]
_chemical_formula_sum '[Cd4 In2 Ag2 Hg1]'
_cell_volume [206.3392]
_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
[
  Cd  Cd0  1  0.0000  0.0000  0.2363  1.0
  Cd  Cd1  1  0.0000  0.0000  0.4354  1.0
  Cd  Cd2  1  0.6667  0.3333  0.1285  1.0
  Cd  Cd3  1  0.6667  0.3333  0.9282  1.0
  In  In4  1  0.6667  0.3333  0.5538  1.0
  In  In5  1  0.6667  0.3333  0.7994  1.0
  Ag  Ag6  1  0.0000  0.0000  0.0291  1.0
  Ag  Ag7  1  0.6667  0.3333  0.3354  1.0
  Hg  Hg8  1  0.0000  0.0000  0.6767  1.0
]