data_LiInBi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.64
_cell_length_b   5.64
_cell_length_c   5.64
_cell_angle_alpha   142.45
_cell_angle_beta   133.23
_cell_angle_gamma   61.46
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiInBi
_chemical_formula_sum   'Li1 In1 Bi1'
_cell_volume   78.87
_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  0.44  1.0
  In  In1  1  0.0  0.0  0.26  1.0
  Bi  Bi0  1  0.0  0.0  0.0  1.0

data_LiInBi
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.63
_cell_length_b   4.48
_cell_length_c   5.64
_cell_angle_alpha   113.39
_cell_angle_beta   108.77
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiInBi
_chemical_formula_sum   'Li1 In1 Bi1'
_cell_volume   78.87
_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  0.56  0.56  0.56  1.0
  In  In1  1  0.74  0.74  0.74  1.0
  Bi  Bi2  1  1.0  1.0  1.0  1.0

Li In Bi
Li In Bi 0 1 o o o 1 2 o o o 