data_LaBi2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.7
_cell_length_b   3.7
_cell_length_c   8.85
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   103.8
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaBi2Au
_chemical_formula_sum   'La1 Bi2 Au1'
_cell_volume   117.7
_cell_formula_units_Z   1
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  La3  1  0.0  0.0  0.21  1.0
  Bi  Bi1  1  0.0  0.0  0.2  1.0
  Bi  Bi2  1  0.28  0.0  0.58  1.0
  Au  Au0  1  0.28  0.0  0.29  1.0

data_LaBi2Au
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.7
_cell_length_b   3.7
_cell_length_c   8.85
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   103.8
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaBi2Au
_chemical_formula_sum   'La1 Bi2 Au1'
_cell_volume   117.7
_cell_formula_units_Z   1
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  1  0.0  0.0  0.21  1.0
  Bi  Bi1  1  0.0  0.0  0.2  1.0
  Bi  Bi2  1  0.28  0.0  0.58  1.0
  Au  Au3  1  0.28  0.0  0.29  1.0

La Bi Bi Au