[CIF]
data_ScGa2Br
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.21500361
_cell_length_b   5.21500361
_cell_length_c   5.21500361
_cell_angle_alpha   129.21205411
_cell_angle_beta   129.21205411
_cell_angle_gamma   74.66960825
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScGa2Br
_chemical_formula_sum   'Sc1 Ga2 Br1'
_cell_volume   82.95436325
_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
  Br  Br0  1  2.23640271  -0.00000000  2.07323832  1
  Ga  Ga1  1  0.00000000  -0.00000000  4.14647664  1
  Ga  Ga2  1  -0.00000000  2.23640271  2.07323832  1
  Sc  Sc3  1  0.00000000  0.00000000  0.00000000  1
[/CIF]
