data_CdCoSb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.61
_cell_length_b   6.61
_cell_length_c   6.61
_cell_angle_alpha   153.12
_cell_angle_beta   153.12
_cell_angle_gamma   38.37
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdCoSb
_chemical_formula_sum   'Cd1 Co1 Sb1'
_cell_volume   59.05
_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  0.0  0.0  0.09  1.0
  Co  Co1  1  0.0  0.0  0.07  1.0
  Sb  Sb2  1  0.0  0.0  0.83  1.0

data_CdCoSb
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.35
_cell_length_b   4.35
_cell_length_c   6.61
_cell_angle_alpha   90.0
_cell_angle_beta   109.19
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   CdCoSb
_chemical_formula_sum   'Cd2 Co2 Sb2'
_cell_volume   118.1
_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
  Cd  Cd0  2  0.09  0.0  0.09  1.0
  Co  Co1  2  0.07  0.0  0.07  1.0
  Sb  Sb2  2  0.33  0.5  0.83  1.0

Cd Co Sb