data_LiBi2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.09
_cell_length_b   6.09
_cell_length_c   6.09
_cell_angle_alpha   138.12
_cell_angle_beta   128.59
_cell_angle_gamma   68.39
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiBi2Pb
_chemical_formula_sum   'Li1 Bi2 Pb1'
_cell_volume   116.1
_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
  Bi  Bi0  1  0.18  0.0  0.4  1.0
  Bi  Bi1  1  0.0  0.64  0.64  1.0
  Pb  Pb3  1  0.0  0.0  0.04  1.0

data_LiBi2Pb
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.36
_cell_length_b   5.29
_cell_length_c   6.09
_cell_angle_alpha   115.7
_cell_angle_beta   110.94
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiBi2Pb
_chemical_formula_sum   'Li1 Bi2 Pb1'
_cell_volume   116.1
_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
  Bi  Bi1  1  0.36  0.0  0.0  1.0
  Bi  Bi2  1  0.78  0.6  0.78  1.0
  Pb  Pb3  1  0.96  0.96  0.96  1.0

Li Bi Bi Pb