data_[Li1Cd4In2Hg2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  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 [P3m1]
_cell_length_a [3.3830]
_cell_length_b [3.3830]
_cell_length_c [22.0078]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [156]
_chemical_formula_structural [LiCd4(InHg)2]
_chemical_formula_sum '[Li1 Cd4 In2 Hg2]'
_cell_volume [218.1245]
_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
[
  Li  Li0  1  0.0000  0.0000  0.6747  1.0
  Cd  Cd1  1  0.0000  0.0000  0.2395  1.0
  Cd  Cd2  1  0.0000  0.0000  0.4577  1.0
  Cd  Cd3  1  0.6667  0.3333  0.1277  1.0
  Cd  Cd4  1  0.6667  0.3333  0.9082  1.0
  In  In5  1  0.6667  0.3333  0.5717  1.0
  In  In6  1  0.6667  0.3333  0.7771  1.0
  Hg  Hg7  1  0.0000  0.0000  0.0181  1.0
  Hg  Hg8  1  0.6667  0.3333  0.3481  1.0
]