data_GaBiSb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.29
_cell_length_b   6.29
_cell_length_c   3.28
_cell_angle_alpha   99.51
_cell_angle_beta   99.51
_cell_angle_gamma   118.15
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaBiSb2
_chemical_formula_sum   'Ga1 Bi1 Sb2'
_cell_volume   108.61
_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  0.0  0.0  0.0  1.0
  Bi  Bi0  1  0.23  0.0  0.0  1.0
  Sb  Sb2  1  0.09  0.7  0.55  1.0
  Sb  Sb3  1  0.09  0.3  0.55  1.0

data_GaBiSb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.28
_cell_length_b   6.24
_cell_length_c   6.29
_cell_angle_alpha   116.46
_cell_angle_beta   99.51
_cell_angle_gamma   101.11
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaBiSb2
_chemical_formula_sum   'Ga1 Bi1 Sb2'
_cell_volume   108.61
_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  0.0  0.0  1.0
  Bi  Bi1  1  0.0  0.0  0.23  1.0
  Sb  Sb2  1  0.25  0.7  0.79  1.0
  Sb  Sb3  1  0.85  0.3  0.39  1.0

Ga Bi Sb Sb