data_[Sn1Pt1F6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sn  1.9600  1.4500  0.8300
  Pt  2.2800  1.3500  0.8050
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.0097]
_cell_length_b [5.4041]
_cell_length_c [5.6069]
_cell_angle_alpha [65.5762]
_cell_angle_beta [89.4226]
_cell_angle_gamma [66.4998]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [SnPtF6]
_chemical_formula_sum '[Sn1 Pt1 F6]'
_cell_volume [124.5516]
_cell_formula_units_Z [1]
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
[
  Sn  Sn0  1  0.5000  0.0000  0.5000  1.0
  Pt  Pt1  1  0.0000  0.0000  0.0000  1.0
  F  F2  2  0.1248  0.1646  0.2198  1.0
  F  F3  2  0.2177  0.1772  0.7238  1.0
  F  F4  2  0.4835  0.6219  0.6881  1.0
]