data_La2In
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.31
_cell_length_b   12.31
_cell_length_c   12.31
_cell_angle_alpha   162.62
_cell_angle_beta   158.83
_cell_angle_gamma   27.52
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2In
_chemical_formula_sum   'La4 In2'
_cell_volume   201.0
_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  La2  1  0.0  0.39  0.58  1.0
  La  La3  1  0.86  0.87  0.38  1.0
  La  La4  1  0.0  0.39  0.21  1.0
  La  La5  1  0.86  0.87  0.74  1.0
  In  In0  1  0.86  0.13  0.82  1.0
  In  In1  1  0.0  0.13  0.14  1.0

data_La2In
_symmetry_space_group_name_H-M   P-1
_cell_length_a   3.72
_cell_length_b   4.52
_cell_length_c   12.31
_cell_angle_alpha   100.59
_cell_angle_beta   98.69
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   La2In
_chemical_formula_sum   'La4 In2'
_cell_volume   201.0
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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  0.24  0.48  0.41  1.0
  La  La1  2  0.24  0.84  0.77  1.0
  In  In2  2  0.5  0.34  0.41  1.0

La La La La In In