data_[Li12Ho4Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ho  1.2300  1.7500  1.0410
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.3831]
_cell_length_b [4.0472]
_cell_length_c [9.1643]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.9057]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li3HoAu2]
_chemical_formula_sum '[Li12 Ho4 Au8]'
_cell_volume [442.7471]
_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
[
  Li  Li0  4  0.0696  0.0000  0.4154  1.0
  Li  Li1  4  0.0733  0.5000  0.6876  1.0
  Li  Li2  4  0.2329  0.5000  0.5833  1.0
  Ho  Ho3  4  0.1227  0.0000  0.9994  1.0
  Au  Au4  4  0.0748  0.5000  0.2104  1.0
  Au  Au5  4  0.2054  0.0000  0.7626  1.0
]