data_Ba2GaGe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.86
_cell_length_b   3.86
_cell_length_c   9.63
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2GaGe
_chemical_formula_sum   'Ba2 Ga1 Ge1'
_cell_volume   143.27
_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  0.0  0.0  0.81  1.0
  Ba  Ba1  1  0.93  0.93  0.22  1.0
  Ga  Ga2  1  0.0  0.0  0.45  1.0
  Ge  Ge3  1  0.93  0.93  0.59  1.0

data_Ba2GaGe
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.45
_cell_length_b   5.45
_cell_length_c   9.63
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Ba2GaGe
_chemical_formula_sum   'Ba4 Ga2 Ge2'
_cell_volume   286.54
_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
  Ba  Ba0  2  0.0  0.0  0.81  1.0
  Ba  Ba1  2  0.43  0.5  0.22  1.0
  Ga  Ga2  2  0.0  0.0  0.45  1.0
  Ge  Ge3  2  0.43  0.5  0.59  1.0

Ba Ba Ga Ge
Ba2GaGe crystallizes in the monoclinic Cm space group. The structure is zero-dimensional and consists of two Ba2GaGe clusters. There are two inequivalent Ba sites. In the first Ba site, Ba(1) is bonded in a single-bond geometry to one Ge(1) atom. The Ba(1)-Ge(1) bond length is 2.19 Å. In the second Ba site, Ba(2) is bonded in a single-bond geometry to one Ga(1) atom. The Ba(2)-Ga(1) bond length is 2.27 Å. Ga(1) is bonded in a bent 150 degrees geometry to one Ba(2) and one Ge(1) atom. The Ga(1)-Ge(1) bond length is 1.37 Å. Ge(1) is bonded in a bent 150 degrees geometry to one Ba(1) and one Ga(1) atom.