data_[La4Ho12Ni8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ho  1.2300  1.7500  1.0410
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.2623]
_cell_length_b [3.9188]
_cell_length_c [11.6005]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.4634]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [LaHo3Ni2]
_chemical_formula_sum '[La4 Ho12 Ni8]'
_cell_volume [609.5334]
_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
[
  La  La0  4  0.1519  0.0000  0.7481  1
  Ho  Ho1  4  0.0816  0.5000  0.9475  1
  Ho  Ho2  4  0.0859  0.5000  0.4374  1
  Ho  Ho3  4  0.1532  0.0000  0.2486  1
  Ni  Ni4  4  0.2310  0.0000  0.0543  1
  Ni  Ni5  4  0.2319  0.0000  0.5480  1
]