data_[In10Hg12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  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 [7.2962]
_cell_length_b [12.0665]
_cell_length_c [7.2907]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.8695]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [In5Hg6]
_chemical_formula_sum '[In10 Hg12]'
_cell_volume [617.4123]
_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
[
  In  In0  4  0.0000  0.2267  0.5000  1.0
  In  In1  4  0.0000  0.3535  0.0000  1.0
  In  In2  2  0.0000  0.5000  0.5000  1.0
  Hg  Hg3  8  0.1733  0.1314  0.1897  1.0
  Hg  Hg4  4  0.1860  0.0000  0.7136  1.0
]