data_Zn2FeBi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.93
_cell_length_b   8.93
_cell_length_c   8.93
_cell_angle_alpha   20.4
_cell_angle_beta   20.4
_cell_angle_gamma   20.4
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zn2FeBi
_chemical_formula_sum   'Zn2 Fe1 Bi1'
_cell_volume   75.66
_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
  Zn  Zn2  1  0.0  0.0  0.2  1.0
  Zn  Zn3  1  0.0  0.0  0.02  1.0
  Fe  Fe1  1  0.0  0.0  0.0  1.0
  Bi  Bi0  1  0.0  0.0  0.11  1.0

data_Zn2FeBi
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.48
_cell_length_b   3.16
_cell_length_c   8.93
_cell_angle_alpha   90.0
_cell_angle_beta   101.8
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Zn2FeBi
_chemical_formula_sum   'Zn4 Fe2 Bi2'
_cell_volume   151.33
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Zn  Zn0  2  -0.0  0.0  0.8  1.0
  Zn  Zn1  2  -0.0  0.0  0.98  1.0
  Fe  Fe2  2  0.0  0.0  0.0  1.0
  Bi  Bi3  2  -0.0  0.0  0.89  1.0

Zn Zn Fe Bi