# generated using pymatgen
data_CsFeF4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.81748221
_cell_length_b   7.81748221
_cell_length_c   6.48368270
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CsFeF4
_chemical_formula_sum   'Cs4 Fe4 F16'
_cell_volume   396.23748306
_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
  Cs  Cs0  1  0.50000000  0.50000000  0.50000000  1.0
  Cs  Cs1  1  -0.00000000  -0.00000000  0.50000000  1.0
  Cs  Cs2  1  0.50000000  -0.00000000  0.44424490  1.0
  Cs  Cs3  1  -0.00000000  0.50000000  0.55575510  1.0
  Fe  Fe4  1  0.25000000  0.75000000  0.00000000  1.0
  Fe  Fe5  1  0.25000000  0.25000000  0.00000000  1.0
  Fe  Fe6  1  0.75000000  0.75000000  0.00000000  1.0
  Fe  Fe7  1  0.75000000  0.25000000  0.00000000  1.0
  F  F8  1  0.71967938  0.21967938  0.71548631  1.0
  F  F9  1  0.28032062  0.78032062  0.71548631  1.0
  F  F10  1  0.28032062  0.21967938  0.71548631  1.0
  F  F11  1  0.71967938  0.78032062  0.71548631  1.0
  F  F12  1  0.21967938  0.71967938  0.28451369  1.0
  F  F13  1  0.21967938  0.28032062  0.28451369  1.0
  F  F14  1  0.78032062  0.71967938  0.28451369  1.0
  F  F15  1  0.78032062  0.28032062  0.28451369  1.0
  F  F16  1  0.74672978  0.50000000  0.95073060  1.0
  F  F17  1  -0.00000000  0.75327022  0.95073060  1.0
  F  F18  1  -0.00000000  0.24672978  0.95073060  1.0
  F  F19  1  0.25327022  0.50000000  0.95073060  1.0
  F  F20  1  0.75327022  -0.00000000  0.04926940  1.0
  F  F21  1  0.24672978  -0.00000000  0.04926940  1.0
  F  F22  1  0.50000000  0.74672978  0.04926940  1.0
  F  F23  1  0.50000000  0.25327022  0.04926940  1.0