data_[Ho12Hg4Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Hg  2.0000  1.5000  1.2450
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.2668]
_cell_length_b [8.1062]
_cell_length_c [11.8403]
_cell_angle_alpha [90.0000]
_cell_angle_beta [121.4763]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Ho6Hg2Au]
_chemical_formula_sum '[Ho12 Hg4 Au2]'
_cell_volume [512.9770]
_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  0.0749  0.7086  0.9383  1
  Ho  Ho1  4  0.2971  0.1563  0.9446  1
  Ho  Ho2  4  0.3724  0.5478  0.7321  1
  Hg  Hg3  4  0.1549  0.6124  0.2293  1
  Au  Au4  2  0.5000  0.0000  0.5000  1
]