data_LaInAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.67
_cell_length_b   5.67
_cell_length_c   5.67
_cell_angle_alpha   137.2
_cell_angle_beta   127.3
_cell_angle_gamma   70.14
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaInAu2
_chemical_formula_sum   'La1 In1 Au2'
_cell_volume   96.73
_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  0.07  0.0  0.3  1.0
  In  In2  1  0.0  0.0  0.82  1.0
  Au  Au0  1  0.0  0.0  0.15  1.0
  Au  Au1  1  0.0  0.52  0.3  1.0

data_LaInAu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.14
_cell_length_b   5.03
_cell_length_c   5.67
_cell_angle_alpha   116.35
_cell_angle_beta   111.4
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaInAu2
_chemical_formula_sum   'La1 In1 Au2'
_cell_volume   96.73
_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  0.3  0.23  1.0
  In  In1  1  0.0  0.82  0.82  1.0
  Au  Au2  1  0.0  0.15  0.15  1.0
  Au  Au3  1  0.48  0.78  0.78  1.0

La In Au Au