data_[Li1Cd2In2Hg2]
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 [P-1]
_cell_length_a [5.0252]
_cell_length_b [5.2734]
_cell_length_c [7.2655]
_cell_angle_alpha [106.1018]
_cell_angle_beta [107.8101]
_cell_angle_gamma [94.0256]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [LiCd2(InHg)2]
_chemical_formula_sum '[Li1 Cd2 In2 Hg2]'
_cell_volume [173.5687]
_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  0.0000  1.0
  Cd  Cd1  2  0.1192  0.5922  0.2241  1.0
  In  In2  2  0.2426  0.1836  0.4807  1.0
  Hg  Hg3  2  0.4084  0.7521  0.8119  1.0
]