data_[Cd6In4Ga2Hg12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.0181]
_cell_length_b [10.7280]
_cell_length_c [9.4296]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.5279]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cd3In2GaHg6]
_chemical_formula_sum '[Cd6 In4 Ga2 Hg12]'
_cell_volume [594.2931]
_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
[
  Cd  Cd0  4  0.0000  0.1785  0.5000  1
  Cd  Cd1  2  0.0000  0.5000  0.5000  1
  In  In2  4  0.0000  0.3402  0.0000  1
  Ga  Ga3  2  0.0000  0.0000  0.0000  1
  Hg  Hg4  8  0.2386  0.1619  0.2480  1
  Hg  Hg5  4  0.2350  0.0000  0.7396  1
]