data_[Li2Cd4In4Hg14]
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 [C2/m]
_cell_length_a [7.7823]
_cell_length_b [6.3196]
_cell_length_c [12.5844]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0433]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [LiCd2In2Hg7]
_chemical_formula_sum '[Li2 Cd4 In4 Hg14]'
_cell_volume [618.9059]
_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  0.0000  0.0000  0.0000  1.0
  Cd  Cd1  4  0.0000  0.5000  0.3100  1.0
  In  In2  4  0.0093  0.0000  0.6849  1.0
  Hg  Hg3  8  0.2457  0.2482  0.1502  1.0
  Hg  Hg4  4  0.2330  0.5000  0.5023  1.0
  Hg  Hg5  2  0.0000  0.5000  0.0000  1.0
]