# generated using pymatgen
data_CoOF
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.77443451
_cell_length_b   4.77443451
_cell_length_c   2.91224400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   98.22134101
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoOF
_chemical_formula_sum   'Co2 O2 F2'
_cell_volume   65.70301808
_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
  Co  Co0  1  0.00000000  0.00000000  0.00000000  1.0
  Co  Co1  1  0.50000000  0.50000000  0.50000000  1.0
  O  O2  1  0.30994800  0.30994800  0.00000000  1.0
  O  O3  1  0.69005200  0.69005200  0.00000000  1.0
  F  F4  1  0.19048300  0.80951700  0.50000000  1.0
  F  F5  1  0.80951700  0.19048300  0.50000000  1.0