data_[Ba6Zn12Ag10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Zn  1.6500  1.3500  0.8800
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [4.7232]
_cell_length_b [13.8940]
_cell_length_c [10.1050]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [Ba3Zn6Ag5]
_chemical_formula_sum '[Ba6 Zn12 Ag10]'
_cell_volume [663.1281]
_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
[
  Ba  Ba0  4  0.0000  0.3068  0.7468  1
  Ba  Ba1  2  0.0000  0.0000  0.7529  1
  Zn  Zn2  4  0.0000  0.1362  0.0282  1
  Zn  Zn3  4  0.0000  0.3299  0.4009  1
  Zn  Zn4  2  0.0000  0.5000  0.5345  1
  Zn  Zn5  2  0.0000  0.5000  0.9612  1
  Ag  Ag6  4  0.0000  0.1175  0.4684  1
  Ag  Ag7  4  0.0000  0.3354  0.1098  1
  Ag  Ag8  2  0.0000  0.0000  0.2254  1
]