data_BaCdFe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.99
_cell_length_b   6.99
_cell_length_c   6.99
_cell_angle_alpha   34.34
_cell_angle_beta   34.34
_cell_angle_gamma   34.34
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaCdFe2
_chemical_formula_sum   'Ba1 Cd1 Fe2'
_cell_volume   97.12
_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
  Ba  Ba0  1  0.0  0.0  0.12  1.0
  Cd  Cd1  1  0.0  0.0  0.91  1.0
  Fe  Fe2  1  0.0  0.0  0.14  1.0
  Fe  Fe3  1  0.0  0.0  0.96  1.0

data_BaCdFe2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   7.15
_cell_length_b   4.13
_cell_length_c   6.99
_cell_angle_alpha   90.0
_cell_angle_beta   109.93
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   BaCdFe2
_chemical_formula_sum   'Ba2 Cd2 Fe4'
_cell_volume   194.24
_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
  Ba  Ba0  2  -0.0  0.0  0.88  1.0
  Cd  Cd1  2  -0.0  0.0  0.09  1.0
  Fe  Fe2  2  -0.0  0.0  0.86  1.0
  Fe  Fe3  2  -0.0  0.0  0.04  1.0

Ba Cd Fe Fe