data_[Ho4Si8Ni12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Si  1.9000  1.1000  0.5400
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.4408]
_cell_length_b [3.7754]
_cell_length_c [6.9473]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.1911]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [HoSi2Ni3]
_chemical_formula_sum '[Ho4 Si8 Ni12]'
_cell_volume [342.7425]
_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
[
  Ho  Ho0  4  0.1535  0.0000  0.0692  1.0
  Si  Si1  4  0.0199  0.5000  0.1819  1.0
  Si  Si2  4  0.1863  0.0000  0.6674  1.0
  Ni  Ni3  4  0.0379  0.0000  0.3671  1.0
  Ni  Ni4  4  0.0932  0.5000  0.6716  1.0
  Ni  Ni5  4  0.1834  0.5000  0.4397  1.0
]