data_La2InCu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.53
_cell_length_b   5.53
_cell_length_c   5.53
_cell_angle_alpha   125.6
_cell_angle_beta   122.41
_cell_angle_gamma   83.21
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2InCu
_chemical_formula_sum   'La2 In1 Cu1'
_cell_volume   111.41
_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  0.53  0.0  0.02  1.0
  La  La3  1  0.0  0.66  0.12  1.0
  In  In1  1  0.0  0.0  0.14  1.0
  Cu  Cu0  1  0.0  0.0  0.0  1.0

data_La2InCu
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.06
_cell_length_b   5.33
_cell_length_c   5.53
_cell_angle_alpha   118.79
_cell_angle_beta   117.2
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2InCu
_chemical_formula_sum   'La2 In1 Cu1'
_cell_volume   111.41
_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  0.02  0.49  1.0
  La  La1  1  0.34  0.45  0.45  1.0
  In  In2  1  0.0  0.14  0.14  1.0
  Cu  Cu3  1  0.0  0.0  0.0  1.0

La La In Cu