data_[La16Ga4Sb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ga  1.8100  1.3000  0.7600
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.9378]
_cell_length_b [4.9361]
_cell_length_c [8.3016]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.9861]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La8Ga2Sb]
_chemical_formula_sum '[La16 Ga4 Sb2]'
_cell_volume [686.2936]
_cell_formula_units_Z [2]
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  0.0534  0.0000  0.7421  1.0
  La  La1  4  0.1089  0.5000  0.4398  1.0
  La  La2  4  0.1629  0.0000  0.2543  1.0
  La  La3  4  0.1716  0.5000  0.9270  1.0
  Ga  Ga4  4  0.2167  0.0000  0.6758  1.0
  Sb  Sb5  2  0.0000  0.5000  0.0000  1.0
]