data_LaInPb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.21
_cell_length_b   6.21
_cell_length_c   6.21
_cell_angle_alpha   134.91
_cell_angle_beta   134.91
_cell_angle_gamma   65.66
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaInPb2
_chemical_formula_sum   'La1 In1 Pb2'
_cell_volume   118.04
_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  0.38  0.0  0.61  1.0
  In  In0  1  0.0  0.0  0.0  1.0
  Pb  Pb2  1  0.0  0.0  0.21  1.0
  Pb  Pb3  1  0.0  0.38  0.61  1.0

data_LaInPb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.76
_cell_length_b   4.76
_cell_length_c   6.21
_cell_angle_alpha   112.54
_cell_angle_beta   112.54
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaInPb2
_chemical_formula_sum   'La1 In1 Pb2'
_cell_volume   118.04
_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  0.39  0.0  0.77  1.0
  In  In1  1  0.0  0.0  0.0  1.0
  Pb  Pb2  1  0.77  0.38  0.77  1.0
  Pb  Pb3  1  0.79  0.0  0.79  1.0

La In Pb Pb
La In Pb Pb 0 2 o o o 1 2 o o o 2 3 o o o 