# generated using pymatgen
data_GdOF
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.89489293
_cell_length_b   3.89486676
_cell_length_c   5.55033824
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GdOF
_chemical_formula_sum   'Gd2 O2 F2'
_cell_volume   84.19912512
_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
  Gd  Gd0  1  0.00000000  0.50000000  0.71340955  1.0
  Gd  Gd1  1  0.50000000  -0.00000000  0.28659045  1.0
  O  O2  1  -0.00000000  -0.00000000  0.50000249  1.0
  O  O3  1  0.50000000  0.50000000  0.49999751  1.0
  F  F4  1  -0.00000000  -0.00000000  0.00000715  1.0
  F  F5  1  0.50000000  0.50000000  0.99999285  1.0