data_[Li2Cd4In4Hg2]
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 [4.3560]
_cell_length_b [9.4344]
_cell_length_c [6.8872]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [26]
_chemical_formula_structural [LiCd2In2Hg]
_chemical_formula_sum '[Li2 Cd4 In4 Hg2]'
_cell_volume [283.0386]
_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  0.3442  0.6318  1.0
  Cd  Cd1  2  0.0000  0.1666  0.3924  1.0
  Cd  Cd2  2  0.5000  0.0027  0.6259  1.0
  In  In3  2  0.0000  0.1697  0.8635  1.0
  In  In4  2  0.5000  0.3351  0.1379  1.0
  Hg  Hg5  2  0.0000  0.4919  0.3940  1.0
]