data_Ba2AgBi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.07
_cell_length_b   7.07
_cell_length_c   7.07
_cell_angle_alpha   142.34
_cell_angle_beta   136.26
_cell_angle_gamma   59.06
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2AgBi
_chemical_formula_sum   'Ba2 Ag1 Bi1'
_cell_volume   147.76
_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  Ba1  1  0.0  0.63  0.88  1.0
  Ba  Ba2  1  0.0  0.0  0.21  1.0
  Ag  Ag0  1  0.0  0.0  0.83  1.0
  Bi  Bi3  1  0.0  0.63  0.52  1.0

data_Ba2AgBi
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.56
_cell_length_b   5.27
_cell_length_c   7.07
_cell_angle_alpha   111.87
_cell_angle_beta   108.83
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2AgBi
_chemical_formula_sum   'Ba2 Ag1 Bi1'
_cell_volume   147.76
_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  0.12  0.75  0.75  1.0
  Ba  Ba1  1  0.79  0.79  0.79  1.0
  Ag  Ag2  1  0.17  0.17  0.17  1.0
  Bi  Bi3  1  0.48  0.11  0.11  1.0

Ba Ba Ag Bi