data_LaBCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.11
_cell_length_b   4.11
_cell_length_c   6.63
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaBCl
_chemical_formula_sum   'La1 B1 Cl1'
_cell_volume   96.91
_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
  La  La2  1  0.05  0.19  0.65  1.0
  B  B0  1  0.0  0.0  0.74  1.0
  Cl  Cl1  1  0.0  0.37  0.87  1.0

data_LaBCl
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.11
_cell_length_b   4.11
_cell_length_c   6.63
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaBCl
_chemical_formula_sum   'La1 B1 Cl1'
_cell_volume   96.91
_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
  La  La0  1  0.05  0.19  0.65  1.0
  B  B1  1  0.0  0.0  0.74  1.0
  Cl  Cl2  1  0.0  0.37  0.87  1.0

La B Cl
LaBCl crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one LaBCl cluster. La(1) is bonded in a 2-coordinate geometry to one B(1) and one Cl(1) atom. The La(1)-B(1) bond length is 0.93 Å. The La(1)-Cl(1) bond length is 1.75 Å. B(1) is bonded in a distorted single-bond geometry to one La(1) and one Cl(1) atom. The B(1)-Cl(1) bond length is 1.76 Å. Cl(1) is bonded in a 2-coordinate geometry to one La(1) and one B(1) atom.