# generated using pymatgen
data_KTiF4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.71064927
_cell_length_b   7.92727462
_cell_length_c   12.04598340
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KTiF4
_chemical_formula_sum   'K8 Ti8 F32'
_cell_volume   736.30392045
_cell_formula_units_Z   8
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
  K  K0  1  0.25000000  0.87775875  0.98819038  1.0
  K  K1  1  0.75000000  0.12224125  0.01180962  1.0
  K  K2  1  0.75000000  0.37775875  0.51180962  1.0
  K  K3  1  0.25000000  0.62224125  0.48819038  1.0
  K  K4  1  0.25000000  0.37568714  0.96973676  1.0
  K  K5  1  0.75000000  0.62431286  0.03026324  1.0
  K  K6  1  0.75000000  0.87568714  0.53026324  1.0
  K  K7  1  0.25000000  0.12431286  0.46973676  1.0
  Ti  Ti8  1  0.50094376  0.62732778  0.75318789  1.0
  Ti  Ti9  1  0.00094376  0.37267222  0.24681211  1.0
  Ti  Ti10  1  0.49905624  0.12732778  0.74681211  1.0
  Ti  Ti11  1  0.99905624  0.87267222  0.25318789  1.0
  Ti  Ti12  1  0.49905624  0.37267222  0.24681211  1.0
  Ti  Ti13  1  0.99905624  0.62732778  0.75318789  1.0
  Ti  Ti14  1  0.50094376  0.87267222  0.25318789  1.0
  Ti  Ti15  1  0.00094376  0.12732778  0.74681211  1.0
  F  F16  1  0.25000000  0.82309252  0.21366505  1.0
  F  F17  1  0.75000000  0.17690748  0.78633495  1.0
  F  F18  1  0.75000000  0.32309252  0.28633495  1.0
  F  F19  1  0.25000000  0.67690748  0.71366505  1.0
  F  F20  1  0.25000000  0.42158293  0.20410455  1.0
  F  F21  1  0.75000000  0.57841707  0.79589545  1.0
  F  F22  1  0.75000000  0.92158293  0.29589545  1.0
  F  F23  1  0.25000000  0.07841707  0.70410455  1.0
  F  F24  1  0.55483846  0.87729575  0.74677667  1.0
  F  F25  1  0.05483846  0.12270425  0.25322333  1.0
  F  F26  1  0.44516154  0.37729575  0.75322333  1.0
  F  F27  1  0.94516154  0.62270425  0.24677667  1.0
  F  F28  1  0.44516154  0.12270425  0.25322333  1.0
  F  F29  1  0.94516154  0.87729575  0.74677667  1.0
  F  F30  1  0.55483846  0.62270425  0.24677667  1.0
  F  F31  1  0.05483846  0.37729575  0.75322333  1.0
  F  F32  1  0.05366359  0.11475229  0.90057792  1.0
  F  F33  1  0.55366359  0.88524771  0.09942208  1.0
  F  F34  1  0.94633641  0.61475229  0.59942208  1.0
  F  F35  1  0.44633641  0.38524771  0.40057792  1.0
  F  F36  1  0.94633641  0.88524771  0.09942208  1.0
  F  F37  1  0.44633641  0.11475229  0.90057792  1.0
  F  F38  1  0.05366359  0.38524771  0.40057792  1.0
  F  F39  1  0.55366359  0.61475229  0.59942208  1.0
  F  F40  1  0.05038619  0.63792781  0.90725399  1.0
  F  F41  1  0.55038619  0.36207219  0.09274601  1.0
  F  F42  1  0.94961381  0.13792781  0.59274601  1.0
  F  F43  1  0.44961381  0.86207219  0.40725399  1.0
  F  F44  1  0.94961381  0.36207219  0.09274601  1.0
  F  F45  1  0.44961381  0.63792781  0.90725399  1.0
  F  F46  1  0.05038619  0.86207219  0.40725399  1.0
  F  F47  1  0.55038619  0.13792781  0.59274601  1.0