data_ScGaCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.0
_cell_length_b   7.71
_cell_length_c   3.28
_cell_angle_alpha   83.02
_cell_angle_beta   72.96
_cell_angle_gamma   24.02
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScGaCl
_chemical_formula_sum   'Sc1 Ga1 Cl1'
_cell_volume   72.96
_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
  Sc  Sc2  1  0.75  0.77  0.12  1.0
  Ga  Ga1  1  0.75  0.77  0.47  1.0
  Cl  Cl0  1  0.75  0.77  0.43  1.0

data_ScGaCl
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.51
_cell_length_b   15.01
_cell_length_c   3.28
_cell_angle_alpha   90.0
_cell_angle_beta   122.29
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   ScGaCl
_chemical_formula_sum   'Sc2 Ga2 Cl2'
_cell_volume   145.92
_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
  Sc  Sc0  2  0.35  0.0  0.12  1.0
  Ga  Ga1  2  0.01  0.0  0.78  1.0
  Cl  Cl2  2  0.05  0.0  0.82  1.0

Sc Ga Cl
Sc Ga Cl 0 2 o o o 0 1 o o o 1 2 o o o 
ScGaCl crystallizes in the monoclinic Cm space group. The structure is zero-dimensional and consists of two ScGaCl clusters. Sc(1) is bonded in a distorted single-bond geometry to one Cl(1) atom. The Sc(1)-Cl(1) bond length is 0.99 Å. Ga(1) is bonded in a single-bond geometry to one Cl(1) atom. The Ga(1)-Cl(1) bond length is 0.13 Å. Cl(1) is bonded in a linear geometry to one Sc(1) and one Ga(1) atom.