data_[Ba4In6Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  In  1.7800  1.5500  0.9400
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.0214]
_cell_length_b [4.4979]
_cell_length_c [8.2545]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.9685]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba2In3Pt2]
_chemical_formula_sum '[Ba4 In6 Pt4]'
_cell_volume [390.4879]
_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  0.1390  0.0000  0.7730  1.0
  In  In1  4  0.1439  0.5000  0.4365  1.0
  In  In2  2  0.0000  0.5000  0.0000  1.0
  Pt  Pt3  4  0.1351  0.0000  0.2111  1.0
]