data_Ga5Br
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.61
_cell_length_b   5.61
_cell_length_c   7.02
_cell_angle_alpha   100.08
_cell_angle_beta   100.08
_cell_angle_gamma   36.76
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ga5Br
_chemical_formula_sum   'Ga5 Br1'
_cell_volume   129.71
_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
  Ga  Ga1  1  0.91  0.0  0.23  1.0
  Ga  Ga2  1  0.98  0.0  0.39  1.0
  Ga  Ga3  1  0.87  0.0  0.01  1.0
  Ga  Ga4  1  0.06  0.0  0.92  1.0
  Ga  Ga5  1  0.16  0.0  0.28  1.0
  Br  Br0  1  1.0  0.0  0.12  1.0

data_Ga5Br
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.54
_cell_length_b   5.61
_cell_length_c   7.02
_cell_angle_alpha   100.08
_cell_angle_beta   90.0
_cell_angle_gamma   108.38
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ga5Br
_chemical_formula_sum   'Ga5 Br1'
_cell_volume   129.71
_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
  Ga  Ga0  1  0.0  0.02  0.61  1.0
  Ga  Ga1  1  0.0  0.09  0.77  1.0
  Ga  Ga2  1  0.0  0.13  0.99  1.0
  Ga  Ga3  1  0.0  0.84  0.72  1.0
  Ga  Ga4  1  0.0  0.94  0.08  1.0
  Br  Br5  1  0.0  0.0  0.88  1.0

Ga Ga Ga Ga Ga Br