[CIF]
data_Ba2SrSc
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.34027311
_cell_length_b   4.34027311
_cell_length_c   10.30990756
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2SrSc
_chemical_formula_sum   'Ba2 Sr1 Sc1'
_cell_volume   194.21773622
_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  2.17013656  2.17013656  8.17778909  1
  Ba  Ba1  1  2.17013656  2.17013656  2.13211847  1
  Sc  Sc2  1  0.00000000  0.00000000  0.00000000  1
  Sr  Sr3  1  0.00000000  0.00000000  5.15495378  1
[/CIF]
