data_[Ba2Li1Ag3Bi4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Li  0.9800  1.4500  0.9000
  Ag  1.9300  1.6000  1.0867
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [P-4m2]
_cell_length_a [4.9182]
_cell_length_b [4.9182]
_cell_length_c [12.4356]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [115]
_chemical_formula_structural [Ba2LiAg3Bi4]
_chemical_formula_sum '[Ba2 Li1 Ag3 Bi4]'
_cell_volume [300.7953]
_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  2  0.0000  0.5000  0.7402  1.0
  Li  Li1  1  0.5000  0.5000  0.5000  1.0
  Ag  Ag2  2  0.0000  0.5000  0.1410  1.0
  Ag  Ag3  1  0.0000  0.0000  0.5000  1.0
  Bi  Bi4  2  0.0000  0.5000  0.3706  1.0
  Bi  Bi5  1  0.0000  0.0000  0.0000  1.0
  Bi  Bi6  1  0.5000  0.5000  0.0000  1.0
]