# generated using pymatgen
data_Ba2ZrF8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.61719848
_cell_length_b   9.67169465
_cell_length_c   11.96349649
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2ZrF8
_chemical_formula_sum   'Ba8 Zr4 F32'
_cell_volume   649.95078541
_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
  Ba  Ba0  1  0.25000000  0.44281046  0.83921260  1.0
  Ba  Ba1  1  0.75000000  0.55718954  0.16078740  1.0
  Ba  Ba2  1  0.25000000  0.94281046  0.66078740  1.0
  Ba  Ba3  1  0.75000000  0.05718954  0.33921260  1.0
  Ba  Ba4  1  0.25000000  0.86056162  0.05814332  1.0
  Ba  Ba5  1  0.75000000  0.13943838  0.94185668  1.0
  Ba  Ba6  1  0.25000000  0.36056162  0.44185668  1.0
  Ba  Ba7  1  0.75000000  0.63943838  0.55814332  1.0
  Zr  Zr8  1  0.25000000  0.24302226  0.14145380  1.0
  Zr  Zr9  1  0.75000000  0.75697774  0.85854620  1.0
  Zr  Zr10  1  0.25000000  0.74302226  0.35854620  1.0
  Zr  Zr11  1  0.75000000  0.25697774  0.64145380  1.0
  F  F12  1  0.25000000  0.13333230  0.30726628  1.0
  F  F13  1  0.75000000  0.86666770  0.69273372  1.0
  F  F14  1  0.25000000  0.63333230  0.19273372  1.0
  F  F15  1  0.75000000  0.36666770  0.80726628  1.0
  F  F16  1  0.25000000  0.14898003  0.97442771  1.0
  F  F17  1  0.75000000  0.85101997  0.02557229  1.0
  F  F18  1  0.25000000  0.64898003  0.52557229  1.0
  F  F19  1  0.75000000  0.35101997  0.47442771  1.0
  F  F20  1  0.99098048  0.65879074  0.75361497  1.0
  F  F21  1  0.49098048  0.34120926  0.24638503  1.0
  F  F22  1  0.50901952  0.15879074  0.74638503  1.0
  F  F23  1  0.00901952  0.84120926  0.25361497  1.0
  F  F24  1  0.01065665  0.40838473  0.63649966  1.0
  F  F25  1  0.51065665  0.59161527  0.36350034  1.0
  F  F26  1  0.48934335  0.90838473  0.86350034  1.0
  F  F27  1  0.98934335  0.09161527  0.13649966  1.0
  F  F28  1  0.98934335  0.59161527  0.36350034  1.0
  F  F29  1  0.48934335  0.40838473  0.63649966  1.0
  F  F30  1  0.51065665  0.09161527  0.13649966  1.0
  F  F31  1  0.01065665  0.90838473  0.86350034  1.0
  F  F32  1  0.48510699  0.35818897  0.03890838  1.0
  F  F33  1  0.98510699  0.64181103  0.96109162  1.0
  F  F34  1  0.01489301  0.85818897  0.46109162  1.0
  F  F35  1  0.51489301  0.14181103  0.53890838  1.0
  F  F36  1  0.51489301  0.64181103  0.96109162  1.0
  F  F37  1  0.01489301  0.35818897  0.03890838  1.0
  F  F38  1  0.98510699  0.14181103  0.53890838  1.0
  F  F39  1  0.48510699  0.85818897  0.46109162  1.0
  F  F40  1  0.99098048  0.15879074  0.74638503  1.0
  F  F41  1  0.49098048  0.84120926  0.25361497  1.0
  F  F42  1  0.50901952  0.65879074  0.75361497  1.0
  F  F43  1  0.00901952  0.34120926  0.24638503  1.0