data_[Ho6In4Hg8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  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 [11.1030]
_cell_length_b [4.9010]
_cell_length_c [9.2838]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.6502]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ho3(InHg2)2]
_chemical_formula_sum '[Ho6 In4 Hg8]'
_cell_volume [447.4961]
_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
[
  Ho  Ho0  4  0.1656  0.5000  0.6715  1.0
  Ho  Ho1  2  0.0000  0.0000  0.0000  1.0
  In  In2  4  0.1087  0.5000  0.2741  1.0
  Hg  Hg3  4  0.0877  0.0000  0.4231  1.0
  Hg  Hg4  4  0.1926  0.5000  0.0231  1.0
]