data_B5Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.33
_cell_length_b   4.33
_cell_length_c   6.75
_cell_angle_alpha   108.04
_cell_angle_beta   108.04
_cell_angle_gamma   41.15
_symmetry_Int_Tables_number   1
_chemical_formula_structural   B5Cl
_chemical_formula_sum   'B5 Cl1'
_cell_volume   78.63
_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  0.58  0.0  0.38  1.0
  B  B1  1  0.1  0.0  0.55  1.0
  B  B2  1  0.29  0.0  0.46  1.0
  B  B3  1  0.62  0.0  0.6  1.0
  B  B4  1  0.38  0.0  0.73  1.0
  Cl  Cl5  1  0.83  0.0  0.44  1.0

data_B5Cl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.05
_cell_length_b   4.33
_cell_length_c   6.75
_cell_angle_alpha   108.04
_cell_angle_beta   90.0
_cell_angle_gamma   110.58
_symmetry_Int_Tables_number   1
_chemical_formula_structural   B5Cl
_chemical_formula_sum   'B5 Cl1'
_cell_volume   78.63
_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  0.0  0.38  0.4  1.0
  B  B1  1  0.0  0.42  0.62  1.0
  B  B2  1  0.0  0.62  0.27  1.0
  B  B3  1  0.0  0.71  0.54  1.0
  B  B4  1  0.0  0.9  0.45  1.0
  Cl  Cl5  1  0.0  0.17  0.56  1.0

B B B B B Cl