data_La2CdTe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.8
_cell_length_b   5.8
_cell_length_c   5.8
_cell_angle_alpha   128.83
_cell_angle_beta   124.07
_cell_angle_gamma   79.21
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2CdTe
_chemical_formula_sum   'La2 Cd1 Te1'
_cell_volume   121.46
_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  0.5  0.0  0.25  1.0
  La  La2  1  0.0  0.72  0.21  1.0
  Cd  Cd0  1  0.0  0.0  0.0  1.0
  Te  Te3  1  0.0  0.0  0.46  1.0

data_La2CdTe
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.01
_cell_length_b   5.44
_cell_length_c   5.8
_cell_angle_alpha   117.97
_cell_angle_beta   115.58
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2CdTe
_chemical_formula_sum   'La2 Cd1 Te1'
_cell_volume   121.46
_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  0.25  0.75  1.0
  La  La1  1  0.28  0.49  0.49  1.0
  Cd  Cd2  1  0.0  0.0  0.0  1.0
  Te  Te3  1  0.0  0.46  0.46  1.0

La La Cd Te
La La Cd Te 0 2 o o o 0 3 + o o 1 3 o + o 1 2 o + o 2 3 o o o 