data_[Ho2Be7Au12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Be  1.5700  1.0500  0.5900
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P-3]
_cell_length_a [9.9104]
_cell_length_b [9.9104]
_cell_length_c [3.9543]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [147]
_chemical_formula_structural [Ho2Be7Au12]
_chemical_formula_sum '[Ho2 Be7 Au12]'
_cell_volume [336.3458]
_cell_formula_units_Z [1]
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  2  0.3333  0.6667  0.7524  1
  Be  Be1  6  0.1127  0.4000  0.2524  1
  Be  Be2  1  0.0000  0.0000  0.5000  1
  Au  Au3  6  0.0810  0.6212  0.2494  1
  Au  Au4  6  0.1198  0.8600  0.7519  1
]