data_SbBr2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.43
_cell_length_b   5.43
_cell_length_c   5.43
_cell_angle_alpha   128.04
_cell_angle_beta   128.04
_cell_angle_gamma   76.56
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SbBr2Cl
_chemical_formula_sum   'Sb1 Br2 Cl1'
_cell_volume   96.27
_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
  Sb  Sb3  1  0.38  0.0  0.13  1.0
  Br  Br0  1  0.0  0.0  0.26  1.0
  Br  Br1  1  0.0  0.38  0.13  1.0
  Cl  Cl2  1  0.0  0.0  0.0  1.0

data_SbBr2Cl
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.75
_cell_length_b   4.75
_cell_length_c   5.43
_cell_angle_alpha   115.98
_cell_angle_beta   115.98
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SbBr2Cl
_chemical_formula_sum   'Sb1 Br2 Cl1'
_cell_volume   96.27
_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
  Sb  Sb0  1  0.13  0.75  0.75  1.0
  Br  Br1  1  0.26  0.26  0.26  1.0
  Br  Br2  1  0.75  0.13  0.75  1.0
  Cl  Cl3  1  0.0  0.0  0.0  1.0

Sb Br Br Cl