data_Cd2FeCo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.33
_cell_length_b   5.33
_cell_length_c   5.33
_cell_angle_alpha   146.35
_cell_angle_beta   128.77
_cell_angle_gamma   62.7
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2FeCo
_chemical_formula_sum   'Cd2 Fe1 Co1'
_cell_volume   64.71
_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  0.54  0.0  0.13  1.0
  Cd  Cd1  1  0.0  0.0  0.66  1.0
  Fe  Fe3  1  0.0  0.0  0.58  1.0
  Co  Co2  1  0.54  0.0  0.29  1.0

data_Cd2FeCo
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.08
_cell_length_b   4.61
_cell_length_c   5.33
_cell_angle_alpha   115.62
_cell_angle_beta   106.82
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2FeCo
_chemical_formula_sum   'Cd2 Fe1 Co1'
_cell_volume   64.71
_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  0.34  0.34  0.34  1.0
  Cd  Cd1  1  0.41  0.87  0.41  1.0
  Fe  Fe2  1  0.42  0.42  0.42  1.0
  Co  Co3  1  0.25  0.71  0.25  1.0

Cd Cd Fe Co
Cd Cd Fe Co 0 3 o o o 1 2 o o o 