[CIF]
data_TaBCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.97697602
_cell_length_b   3.77082159
_cell_length_c   5.56972489
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaBCl2
_chemical_formula_sum   'Ta1 B1 Cl2'
_cell_volume   62.52375686
_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  0.00000000  0.00000000  0.00000000  1
  Cl  Cl1  1  1.48848801  1.88541080  1.44531971  1
  Cl  Cl2  1  1.48848801  1.88541080  4.12440518  1
  Ta  Ta3  1  0.00000000  0.00000000  2.78486244  1
[/CIF]
