data_[La4Ho12In8]
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
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.3795]
_cell_length_b [5.4102]
_cell_length_c [9.2284]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.7419]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [LaHo3In2]
_chemical_formula_sum '[La4 Ho12 In8]'
_cell_volume [717.0342]
_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  0.1321  0.0000  0.1725  1
  Ho  Ho1  4  0.0612  0.0000  0.7142  1
  Ho  Ho2  4  0.1153  0.5000  0.5407  1
  Ho  Ho3  4  0.1934  0.5000  0.9914  1
  In  In4  4  0.0163  0.5000  0.1673  1
  In  In5  4  0.2257  0.0000  0.5956  1
]