[CIF]
data_MgScCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.71092515
_cell_length_b   4.71092515
_cell_length_c   3.80491928
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgScCl2
_chemical_formula_sum   'Mg1 Sc1 Cl2'
_cell_volume   84.44187260
_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
  Cl  Cl0  1  2.35546258  0.00000000  1.90245964  1
  Cl  Cl1  1  0.00000000  2.35546258  1.90245964  1
  Mg  Mg2  1  0.00000000  0.00000000  0.00000000  1
  Sc  Sc3  1  2.35546258  2.35546258  0.00000000  1
[/CIF]
