[CIF]
data_Sr2BBr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.55446226
_cell_length_b   5.55446226
_cell_length_c   5.55446226
_cell_angle_alpha   130.83486390
_cell_angle_beta   111.04697694
_cell_angle_gamma   89.25430988
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2BBr
_chemical_formula_sum   'Sr2 B1 Br1'
_cell_volume   114.88025189
_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
  B  B0  1  -0.00000000  -0.00000000  0.00000000  1
  Br  Br1  1  -0.00000000  -0.00000000  3.95307294  1
  Sr  Sr2  1  2.31067931  0.00000000  1.82968171  1
  Sr  Sr3  1  -0.00000000  3.14420522  2.12339123  1
[/CIF]
