data_BaGa2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.71
_cell_length_b   4.71
_cell_length_c   6.92
_cell_angle_alpha   109.34
_cell_angle_beta   109.34
_cell_angle_gamma   57.96
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaGa2Pb
_chemical_formula_sum   'Ba1 Ga2 Pb1'
_cell_volume   120.59
_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
  Ba  Ba0  1  0.5  0.0  0.3  1.0
  Ga  Ga1  1  0.65  0.0  0.54  1.0
  Ga  Ga2  1  0.13  0.0  0.37  1.0
  Pb  Pb3  1  0.77  0.0  0.8  1.0

data_BaGa2Pb
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.57
_cell_length_b   4.71
_cell_length_c   6.92
_cell_angle_alpha   109.34
_cell_angle_beta   90.0
_cell_angle_gamma   118.98
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaGa2Pb
_chemical_formula_sum   'Ba1 Ga2 Pb1'
_cell_volume   120.59
_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
  Ba  Ba0  1  0.0  0.5  0.7  1.0
  Ga  Ga1  1  0.0  0.35  0.46  1.0
  Ga  Ga2  1  0.0  0.87  0.63  1.0
  Pb  Pb3  1  0.0  0.23  0.2  1.0

Ba Ga Ga Pb