data_[Cs1Na2Mn1F8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Na  0.9300  1.8000  1.1600
  Mn  1.5500  1.4000  0.6483
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.9085]
_cell_length_b [5.1879]
_cell_length_c [7.7922]
_cell_angle_alpha [86.1207]
_cell_angle_beta [80.1560]
_cell_angle_gamma [89.1983]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CsNa2MnF8]
_chemical_formula_sum '[Cs1 Na2 Mn1 F8]'
_cell_volume [195.0552]
_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
  Na  Na1  2  0.4703  0.4890  0.7907  1
  Mn  Mn2  1  0.0000  0.0000  0.0000  1
  F  F3  2  0.1515  0.7782  0.1539  1
  F  F4  2  0.2323  0.2619  0.0365  1
  F  F5  2  0.2620  0.8978  0.8159  1
  F  F6  2  0.2996  0.4799  0.5086  1
]