data_LiZn2Bi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.2
_cell_length_b   5.2
_cell_length_c   4.92
_cell_angle_alpha   96.2
_cell_angle_beta   96.2
_cell_angle_gamma   37.76
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiZn2Bi
_chemical_formula_sum   'Li1 Zn2 Bi1'
_cell_volume   80.88
_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  Li1  1  0.0  0.0  0.0  1.0
  Zn  Zn2  1  0.24  0.0  0.02  1.0
  Zn  Zn3  1  0.04  0.0  0.87  1.0
  Bi  Bi0  1  0.64  0.0  0.44  1.0

data_LiZn2Bi
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.37
_cell_length_b   4.92
_cell_length_c   5.2
_cell_angle_alpha   96.2
_cell_angle_beta   108.88
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiZn2Bi
_chemical_formula_sum   'Li1 Zn2 Bi1'
_cell_volume   80.88
_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
  Zn  Zn1  1  0.0  0.02  0.24  1.0
  Zn  Zn2  1  0.0  0.87  0.04  1.0
  Bi  Bi3  1  0.0  0.44  0.64  1.0

Li Zn Zn Bi