data_[Li2Cd4In2Hg4]
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 [Pmc2_1]
_cell_length_a [4.4180]
_cell_length_b [8.8017]
_cell_length_c [7.2214]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [26]
_chemical_formula_structural [LiCd2InHg2]
_chemical_formula_sum '[Li2 Cd4 In2 Hg4]'
_cell_volume [280.8123]
_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
[
  Li  Li0  2  0.5000  0.3211  0.6534  1.0
  Cd  Cd1  2  0.0000  0.1722  0.3820  1.0
  Cd  Cd2  2  0.5000  0.0182  0.0893  1.0
  In  In3  2  0.0000  0.4836  0.9197  1.0
  Hg  Hg4  2  0.0000  0.1566  0.8232  1.0
  Hg  Hg5  2  0.5000  0.3588  0.1780  1.0
]