[CIF]
data_B3AuBr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.59526877
_cell_length_b   5.59526877
_cell_length_c   8.08135000
_cell_angle_alpha   95.42689313
_cell_angle_beta   95.42689313
_cell_angle_gamma   69.16163214
_symmetry_Int_Tables_number   1
_chemical_formula_structural   B3AuBr
_chemical_formula_sum   'B6 Au2 Br2'
_cell_volume   234.88836694
_cell_formula_units_Z   2
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
  Au  Au0  1  0.00000000  0.00000000  0.00000000  1
  Au  Au1  1  -0.46415275  0.00000000  4.01392784  1
  B  B2  1  7.57032504  0.00000000  5.84208861  1
  B  B3  1  0.71483500  -0.00000000  2.18576706  1
  B  B4  1  3.09585796  -1.75728681  6.46064444  1
  B  B5  1  5.18930207  -1.75728681  1.56721123  1
  B  B6  1  5.18930207  1.75728681  1.56721123  1
  B  B7  1  3.09585796  1.75728681  6.46064444  1
  Br  Br8  1  5.65895794  0.00000000  2.36012069  1
  Br  Br9  1  2.62620209  0.00000000  5.66773498  1
[/CIF]
