data_[La4Ho16Al4]
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
  Al  1.6100  1.2500  0.6750
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.8269]
_cell_length_b [13.8639]
_cell_length_c [6.2128]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.0945]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [LaHo4Al]
_chemical_formula_sum '[La4 Ho16 Al4]'
_cell_volume [718.4640]
_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  0.0000  0.4010  0.7500  1
  Ho  Ho1  8  0.1008  0.1821  0.0490  1
  Ho  Ho2  8  0.2241  0.3878  0.3701  1
  Al  Al3  4  0.0000  0.0007  0.2500  1
]