# generated using pymatgen
data_Ce2Hf3ScF22
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.26922152
_cell_length_b   8.26922273
_cell_length_c   8.30400201
_cell_angle_alpha   124.94068534
_cell_angle_beta   106.40064669
_cell_angle_gamma   98.12442309
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ce2Hf3ScF22
_chemical_formula_sum   'Ce2 Hf3 Sc1 F22'
_cell_volume   412.04921891
_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
  Ce  Ce0  1  0.74897927  0.24666919  0.49389163  1.0
  Ce  Ce1  1  0.24722244  0.74491236  0.49389163  1.0
  Hf  Hf2  1  0.32299340  0.36888722  0.69188062  1.0
  Hf  Hf3  1  0.17830682  0.86832053  0.04662834  1.0
  Hf  Hf4  1  0.81543724  0.13378231  0.94921855  1.0
  Sc  Sc5  1  0.68202409  0.63602464  0.31804873  1.0
  F  F6  1  0.70379262  0.90540632  0.34538915  1.0
  F  F7  1  0.29610506  0.10051559  0.65519409  1.0
  F  F8  1  0.55467750  0.35908904  0.65519409  1.0
  F  F9  1  0.94493970  0.60463549  0.80979860  1.0
  F  F10  1  0.43998282  0.64159653  0.34538915  1.0
  F  F11  1  0.05753631  0.39071324  0.18719670  1.0
  F  F12  1  0.79648246  0.12965939  0.18719670  1.0
  F  F13  1  0.20516311  0.86485890  0.80979860  1.0
  F  F14  1  0.49775240  0.49845025  0.99620264  1.0
  F  F15  1  0.00009619  0.00120116  0.00129735  1.0
  F  F16  1  0.77948561  0.87484057  0.65432618  1.0
  F  F17  1  0.22082149  0.13139263  0.35221312  1.0
  F  F18  1  0.27888204  0.63230159  0.91118462  1.0
  F  F19  1  0.72038495  0.36631120  0.08669514  1.0
  F  F20  1  0.96039710  0.73778276  0.42038465  1.0
  F  F21  1  0.04976310  0.26185515  0.58585605  1.0
  F  F22  1  0.32400091  0.53609296  0.58585605  1.0
  F  F23  1  0.17017719  0.75803235  0.20845644  1.0
  F  F24  1  0.68260089  0.45998755  0.42038465  1.0
  F  F25  1  0.82859487  0.24700920  0.78998653  1.0
  F  F26  1  0.54297734  0.96139166  0.78998653  1.0
  F  F27  1  0.45042510  0.03827926  0.20845644  1.0