data_[Cs1Mn2In1F8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Mn  1.5500  1.4000  0.6483
  In  1.7800  1.5500  0.9400
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.4319]
_cell_length_b [5.4815]
_cell_length_c [7.9106]
_cell_angle_alpha [76.8641]
_cell_angle_beta [77.3682]
_cell_angle_gamma [76.3312]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CsMn2InF8]
_chemical_formula_sum '[Cs1 Mn2 In1 F8]'
_cell_volume [219.4609]
_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  0.0000  0.0000  0.5000  1.0
  Mn  Mn1  2  0.4540  0.4522  0.7237  1.0
  In  In2  1  0.0000  0.0000  0.0000  1.0
  F  F3  2  0.1983  0.7479  0.1973  1.0
  F  F4  2  0.2359  0.7846  0.8101  1.0
  F  F5  2  0.2632  0.2397  0.9423  1.0
  F  F6  2  0.3632  0.3352  0.5119  1.0
]