data_GaB
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.17
_cell_length_b   3.46
_cell_length_c   5.29
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaB
_chemical_formula_sum   'Ga2 B2'
_cell_volume   58.05
_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
  Ga  Ga2  1  0.79  0.73  0.22  1.0
  Ga  Ga3  1  0.38  0.73  0.07  1.0
  B  B0  1  0.79  0.0  0.82  1.0
  B  B1  1  0.38  0.0  0.48  1.0

data_GaB
_symmetry_space_group_name_H-M   P2
_cell_length_a   3.17
_cell_length_b   3.46
_cell_length_c   5.29
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   3
_chemical_formula_structural   GaB
_chemical_formula_sum   'Ga2 B2'
_cell_volume   58.05
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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  2  0.29  0.73  0.93  1.0
  B  B1  2  0.29  0.0  0.33  1.0

Ga Ga B B