data_[Mg2Cd10Hg8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Cd  1.6900  1.5500  1.0900
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.8213]
_cell_length_b [4.4372]
_cell_length_c [6.3414]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.2807]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [MgCd5Hg4]
_chemical_formula_sum '[Mg2 Cd10 Hg8]'
_cell_volume [462.4814]
_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
[
  Mg  Mg0  2  0.0000  0.5000  0.0000  1
  Cd  Cd1  4  0.1048  0.0000  0.7990  1
  Cd  Cd2  4  0.2007  0.5000  0.5988  1
  Cd  Cd3  2  0.0000  0.5000  0.5000  1
  Hg  Hg4  4  0.0883  0.0000  0.2912  1
  Hg  Hg5  4  0.1960  0.5000  0.1043  1
]