data_Co2BiSb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.69
_cell_length_b   4.69
_cell_length_c   4.69
_cell_angle_alpha   125.31
_cell_angle_beta   116.91
_cell_angle_gamma   88.25
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co2BiSb
_chemical_formula_sum   'Co2 Bi1 Sb1'
_cell_volume   71.06
_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
  Co  Co1  1  0.15  0.0  0.48  1.0
  Co  Co2  1  0.0  0.45  0.88  1.0
  Bi  Bi0  1  0.0  0.0  0.36  1.0
  Sb  Sb3  1  0.0  0.0  0.0  1.0

data_Co2BiSb
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.31
_cell_length_b   4.69
_cell_length_c   4.69
_cell_angle_alpha   63.09
_cell_angle_beta   62.66
_cell_angle_gamma   62.66
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co2BiSb
_chemical_formula_sum   'Co2 Bi1 Sb1'
_cell_volume   71.06
_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
  Co  Co0  1  0.0  0.85  0.48  1.0
  Co  Co1  1  0.45  -0.0  0.43  1.0
  Bi  Bi2  1  0.0  -0.0  0.36  1.0
  Sb  Sb3  1  0.0  0.0  0.0  1.0

Co Co Bi Sb
Co Co Bi Sb 0 2 o o o 0 1 o - - 0 1 o o o 0 3 o o o 1 3 o + + 1 3 o o + 1 2 o + + 1 2 o o o 2 3 o o o 