data_[Ba4Zn12Pt4]
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
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.2329]
_cell_length_b [6.5105]
_cell_length_c [7.4234]
_cell_angle_alpha [90.0000]
_cell_angle_beta [127.1964]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [BaZn3Pt]
_chemical_formula_sum '[Ba4 Zn12 Pt4]'
_cell_volume [470.9422]
_cell_formula_units_Z [4]
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  0.2469  0.5000  0.6584  1.0
  Zn  Zn1  8  0.0496  0.2467  0.8020  1.0
  Zn  Zn2  4  0.2500  0.0000  0.8349  1.0
  Pt  Pt3  2  0.0000  0.0000  0.5000  1.0
  Pt  Pt4  2  0.0000  0.5000  0.0000  1.0
]