data_BaGa2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.85
_cell_length_b   4.6
_cell_length_c   6.75
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaGa2Cl
_chemical_formula_sum   'Ba1 Ga2 Cl1'
_cell_volume   119.55
_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
  Ba  Ba0  1  0.93  0.3  0.0  1.0
  Ga  Ga2  1  0.0  0.3  0.37  1.0
  Ga  Ga3  1  0.93  0.0  0.37  1.0
  Cl  Cl1  1  0.0  0.0  0.0  1.0

data_BaGa2Cl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.85
_cell_length_b   4.6
_cell_length_c   6.75
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaGa2Cl
_chemical_formula_sum   'Ba1 Ga2 Cl1'
_cell_volume   119.55
_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
  Ba  Ba0  1  0.93  0.3  -0.0  1.0
  Ga  Ga1  1  0.0  0.3  0.37  1.0
  Ga  Ga2  1  0.93  0.0  0.37  1.0
  Cl  Cl3  1  0.0  0.0  0.0  1.0

Ba Ga Ga Cl
BaGa2Cl is alpha Niobium phosphide-derived structured and crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one BaGa2Cl cluster. Ba(1) is bonded in a single-bond geometry to one Ga(1) and one Cl(1) atom. The Ba(1)-Ga(1) bond length is 2.53 Å. The Ba(1)-Cl(1) bond length is 1.41 Å. There are two inequivalent Ga sites. In the first Ga site, Ga(1) is bonded in an L-shaped geometry to one Ba(1) and one Ga(2) atom. The Ga(1)-Ga(2) bond length is 1.41 Å. In the second Ga site, Ga(2) is bonded in an L-shaped geometry to one Ga(1) and one Cl(1) atom. The Ga(2)-Cl(1) bond length is 2.53 Å. Cl(1) is bonded in a distorted single-bond geometry to one Ba(1) and one Ga(2) atom.