data_CdFeBi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.85
_cell_length_b   4.54
_cell_length_c   5.71
_cell_angle_alpha   90.0
_cell_angle_beta   108.99
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdFeBi2
_chemical_formula_sum   'Cd1 Fe1 Bi2'
_cell_volume   94.24
_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
  Cd  Cd2  1  0.75  0.27  0.59  1.0
  Fe  Fe3  1  0.94  0.0  0.04  1.0
  Bi  Bi0  1  0.63  0.27  0.96  1.0
  Bi  Bi1  1  0.74  0.0  0.9  1.0

data_CdFeBi2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.85
_cell_length_b   4.54
_cell_length_c   5.71
_cell_angle_alpha   90.0
_cell_angle_beta   108.99
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdFeBi2
_chemical_formula_sum   'Cd1 Fe1 Bi2'
_cell_volume   94.24
_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
  Cd  Cd0  1  0.75  0.27  0.59  1.0
  Fe  Fe1  1  0.94  0.0  0.04  1.0
  Bi  Bi2  1  0.63  0.27  0.96  1.0
  Bi  Bi3  1  0.74  0.0  0.9  1.0

Cd Fe Bi Bi