data_[Ba4Cd2In2Ag12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.7018]
_cell_length_b [5.9578]
_cell_length_c [9.4550]
_cell_angle_alpha [90.0000]
_cell_angle_beta [133.2167]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba2CdInAg6]
_chemical_formula_sum '[Ba4 Cd2 In2 Ag12]'
_cell_volume [562.4886]
_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  0.2488  0.0000  0.7032  1.0
  Cd  Cd1  2  0.0000  0.0000  0.0000  1.0
  In  In2  2  0.0000  0.5000  0.5000  1.0
  Ag  Ag3  8  0.0196  0.2484  0.7683  1.0
  Ag  Ag4  4  0.2490  0.0000  0.0862  1.0
]