data_La3In
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.72
_cell_length_b   3.72
_cell_length_c   9.79
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La3In
_chemical_formula_sum   'La3 In1'
_cell_volume   135.11
_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  La1  1  0.86  0.86  0.58  1.0
  La  La2  1  0.0  0.0  0.89  1.0
  La  La3  1  0.86  0.86  0.21  1.0
  In  In0  1  0.0  0.0  0.0  1.0

data_La3In
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.25
_cell_length_b   5.25
_cell_length_c   9.79
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   La3In
_chemical_formula_sum   'La6 In2'
_cell_volume   270.21
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  0.0  0.0  0.89  1.0
  La  La1  2  0.36  0.5  0.21  1.0
  La  La2  2  0.36  0.5  0.58  1.0
  In  In3  2  0.0  0.0  0.0  1.0

La La La In
La3In crystallizes in the monoclinic Cm space group. There are three inequivalent La sites. In the first La site, La(1) is bonded to one La(2), one La(3), and four equivalent La(1) atoms to form a mixture of distorted edge and corner-sharing LaLa6 octahedra. The corner-sharing octahedra are not tilted. The La(1)-La(2) bond length is 3.16 Å. The La(1)-La(3) bond length is 3.65 Å. All La(1)-La(1) bond lengths are 3.72 Å. In the second La site, La(2) is bonded in a single-bond geometry to one La(1) and one In(1) atom. The La(2)-In(1) bond length is 1.04 Å. In the third La site, La(3) is bonded in a single-bond geometry to one La(1) and one In(1) atom. The La(3)-In(1) bond length is 2.16 Å. In(1) is bonded in a distorted bent 150 degrees geometry to one La(2) and one La(3) atom.