data_[Sr4Pt4S4O4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Pt  2.2800  1.3500  0.8050
  S  2.5800  1.0000  0.8800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_12_12_1]
_cell_length_a [5.5259]
_cell_length_b [6.6391]
_cell_length_c [9.2286]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [19]
_chemical_formula_structural [SrPtSO]
_chemical_formula_sum '[Sr4 Pt4 S4 O4]'
_cell_volume [338.5723]
_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
[
  Sr  Sr0  4  0.1778  0.6553  0.3588  1
  Pt  Pt1  4  0.0651  0.7431  0.0173  1
  S  S2  4  0.1702  0.0483  0.6298  1
  O  O3  4  0.2280  0.8066  0.5975  1
]