# generated using pymatgen
data_YOF
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.66708529
_cell_length_b   6.66708520
_cell_length_c   6.66708580
_cell_angle_alpha   33.07705835
_cell_angle_beta   33.07705976
_cell_angle_gamma   33.07705354
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YOF
_chemical_formula_sum   'Y2 O2 F2'
_cell_volume   78.56406569
_cell_formula_units_Z   2
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
  Y  Y0  1  0.74157135  0.74157135  0.74157135  1.0
  Y  Y1  1  0.25842865  0.25842865  0.25842865  1.0
  O  O2  1  0.62116735  0.62116735  0.62116735  1.0
  O  O3  1  0.37883265  0.37883265  0.37883265  1.0
  F  F4  1  0.13052214  0.13052214  0.13052214  1.0
  F  F5  1  0.86947786  0.86947786  0.86947786  1.0