data_LiLa2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.7
_cell_length_b   6.7
_cell_length_c   6.7
_cell_angle_alpha   144.9
_cell_angle_beta   129.52
_cell_angle_gamma   62.97
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiLa2Pb
_chemical_formula_sum   'Li1 La2 Pb1'
_cell_volume   131.92
_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
  Li  Li2  1  0.0  0.0  0.0  1.0
  La  La0  1  0.02  0.0  0.86  1.0
  La  La1  1  0.0  0.86  0.86  1.0
  Pb  Pb3  1  0.0  0.0  0.71  1.0

data_LiLa2Pb
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.04
_cell_length_b   5.71
_cell_length_c   6.7
_cell_angle_alpha   115.24
_cell_angle_beta   107.55
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiLa2Pb
_chemical_formula_sum   'Li1 La2 Pb1'
_cell_volume   131.92
_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
  Li  Li0  1  0.0  0.0  0.0  1.0
  La  La1  1  0.0  0.86  0.84  1.0
  La  La2  1  0.14  1.0  1.0  1.0
  Pb  Pb3  1  0.0  0.71  0.71  1.0

Li La La Pb