data_[La4Sb4Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Sb  2.0500  1.4500  0.8300
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [16.8862]
_cell_length_b [4.5050]
_cell_length_c [4.5524]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.5332]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [LaSbAu]
_chemical_formula_sum '[La4 Sb4 Au4]'
_cell_volume [333.6652]
_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  2  0.1686  0.0000  0.6600  1.0
  La  La1  2  0.4133  0.0000  0.3859  1.0
  Sb  Sb2  2  0.0020  0.0000  0.9272  1.0
  Sb  Sb3  2  0.2461  0.5000  0.2335  1.0
  Au  Au4  2  0.0792  0.5000  0.2280  1.0
  Au  Au5  2  0.3376  0.5000  0.8236  1.0
]