[CIF]
data_Mg2BrCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.35756832
_cell_length_b   3.81325268
_cell_length_c   6.25761075
_cell_angle_alpha   90.00000000
_cell_angle_beta   103.26311688
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg2BrCl
_chemical_formula_sum   'Mg2 Br1 Cl1'
_cell_volume   124.43155006
_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  1.96096354  0.00000000  3.04535000  1
  Cl  Cl1  1  0.00000000  0.00000000  0.00000000  1
  Mg  Mg2  1  1.62326450  1.90662634  1.04687683  1
  Mg  Mg3  1  2.29866259  1.90662634  5.04382318  1
[/CIF]
