data_[La12Ho4Ga8]
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
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [Ibam]
_cell_length_a [6.6887]
_cell_length_b [16.1801]
_cell_length_c [6.6291]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [72]
_chemical_formula_structural [La3HoGa2]
_chemical_formula_sum '[La12 Ho4 Ga8]'
_cell_volume [717.4268]
_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  8  0.2453  0.1812  0.5000  1
  La  La1  4  0.0000  0.5000  0.2500  1
  Ho  Ho2  4  0.0000  0.0000  0.2500  1
  Ga  Ga3  8  0.2360  0.1280  0.0000  1
]