data_[Ba12Ag2Pt6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Ag  1.9300  1.6000  1.0867
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [13.2292]
_cell_length_b [4.6881]
_cell_length_c [13.4674]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.8745]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Ba6AgPt3]
_chemical_formula_sum '[Ba12 Ag2 Pt6]'
_cell_volume [790.3357]
_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  2  0.0747  0.7500  0.9105  1
  Ba  Ba1  2  0.1292  0.2500  0.4632  1
  Ba  Ba2  2  0.2142  0.7500  0.2411  1
  Ba  Ba3  2  0.2830  0.7500  0.7364  1
  Ba  Ba4  2  0.3924  0.2500  0.0552  1
  Ba  Ba5  2  0.4660  0.2500  0.6068  1
  Ag  Ag6  2  0.0536  0.2500  0.6987  1
  Pt  Pt7  2  0.1578  0.2500  0.0779  1
  Pt  Pt8  2  0.3072  0.7500  0.5004  1
  Pt  Pt9  2  0.4465  0.2500  0.8346  1
]