data_BSbCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.43
_cell_length_b   5.97
_cell_length_c   3.55
_cell_angle_alpha   80.66
_cell_angle_beta   66.32
_cell_angle_gamma   33.02
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BSbCl
_chemical_formula_sum   'B1 Sb1 Cl1'
_cell_volume   63.63
_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
  B  B0  1  0.85  0.03  0.15  1.0
  Sb  Sb2  1  0.85  0.03  0.2  1.0
  Cl  Cl1  1  0.85  0.03  0.33  1.0

data_BSbCl
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.71
_cell_length_b   11.34
_cell_length_c   3.55
_cell_angle_alpha   90.0
_cell_angle_beta   121.48
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   BSbCl
_chemical_formula_sum   'B2 Sb2 Cl2'
_cell_volume   127.27
_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
  B  B0  2  0.47  0.5  1.0  1.0
  Sb  Sb1  2  0.42  0.5  0.95  1.0
  Cl  Cl2  2  0.28  0.5  0.81  1.0

B Sb Cl
B Sb Cl 0 1 o o o 1 2 o o o 