data_La2InAs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.38
_cell_length_b   6.38
_cell_length_c   6.38
_cell_angle_alpha   138.31
_cell_angle_beta   138.31
_cell_angle_gamma   60.43
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2InAs
_chemical_formula_sum   'La2 In1 As1'
_cell_volume   113.76
_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  La2  1  0.0  0.0  0.52  1.0
  La  La3  1  0.0  0.27  0.76  1.0
  In  In1  1  0.27  0.0  0.76  1.0
  As  As0  1  0.0  0.0  0.0  1.0

data_La2InAs
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.54
_cell_length_b   4.54
_cell_length_c   6.38
_cell_angle_alpha   110.84
_cell_angle_beta   110.84
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2InAs
_chemical_formula_sum   'La2 In1 As1'
_cell_volume   113.76
_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  0.48  0.0  0.48  1.0
  La  La1  1  0.51  0.27  0.51  1.0
  In  In2  1  0.24  0.0  0.51  1.0
  As  As3  1  0.0  0.0  0.0  1.0

La La In As