data_LiCd2Bi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.32
_cell_length_b   4.49
_cell_length_c   6.56
_cell_angle_alpha   90.0
_cell_angle_beta   98.08
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCd2Bi
_chemical_formula_sum   'Li1 Cd2 Bi1'
_cell_volume   96.92
_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  Li3  1  0.64  0.0  0.3  1.0
  Cd  Cd1  1  0.94  0.0  0.28  1.0
  Cd  Cd2  1  0.29  0.25  0.55  1.0
  Bi  Bi0  1  0.39  0.25  0.62  1.0

data_LiCd2Bi
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.32
_cell_length_b   4.49
_cell_length_c   6.56
_cell_angle_alpha   90.0
_cell_angle_beta   98.08
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCd2Bi
_chemical_formula_sum   'Li1 Cd2 Bi1'
_cell_volume   96.92
_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  0.64  0.0  0.3  1.0
  Cd  Cd1  1  0.29  0.25  0.55  1.0
  Cd  Cd2  1  0.94  0.0  0.28  1.0
  Bi  Bi3  1  0.39  0.25  0.62  1.0

Li Cd Cd Bi