data_[Cs1Cr1Sn1F6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Cr  1.6600  1.4000  0.9400
  Sn  1.9600  1.4500  0.8300
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.8065]
_cell_length_b [5.8277]
_cell_length_c [5.8573]
_cell_angle_alpha [61.3782]
_cell_angle_beta [89.9346]
_cell_angle_gamma [89.8580]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [CsCrSnF6]
_chemical_formula_sum '[Cs1 Cr1 Sn1 F6]'
_cell_volume [173.9819]
_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
[
  Cs  Cs0  1  0.9320  0.9926  0.0317  1.0
  Cr  Cr1  1  0.5173  0.6712  0.6643  1.0
  Sn  Sn2  1  0.4371  0.3327  0.3842  1.0
  F  F3  1  0.2975  0.8603  0.7504  1.0
  F  F4  1  0.3345  0.3576  0.7778  1.0
  F  F5  1  0.3839  0.7875  0.3227  1.0
  F  F6  1  0.6692  0.5259  0.0070  1.0
  F  F7  1  0.7027  0.9961  0.5219  1.0
  F  F8  1  0.7256  0.4761  0.5399  1.0
]