data_[Al4In4Hg4Cl16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  In  1.7800  1.5500  0.9400
  Hg  2.0000  1.5000  1.2450
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.7299]
_cell_length_b [9.8683]
_cell_length_c [8.9244]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.2579]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [AlInHgCl4]
_chemical_formula_sum '[Al4 In4 Hg4 Cl16]'
_cell_volume [1081.5926]
_cell_formula_units_Z [4]
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
[
  Al  Al0  4  0.1517  0.5000  0.2642  1.0
  In  In1  4  0.2446  0.0000  0.1322  1.0
  Hg  Hg2  4  0.0265  0.0000  0.8095  1.0
  Cl  Cl3  8  0.1728  0.3260  0.1244  1.0
  Cl  Cl4  4  0.0094  0.5000  0.7025  1.0
  Cl  Cl5  4  0.2270  0.0000  0.5176  1.0
]