# generated using pymatgen
data_CoOF
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.94441900
_cell_length_b   4.60440400
_cell_length_c   13.61501400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoOF
_chemical_formula_sum   'Co6 O6 F6'
_cell_volume   184.58275607
_cell_formula_units_Z   6
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  0.50000000  0.72699400  0.99872500  1.0
  Co  Co1  1  0.50000000  0.85202500  0.33242900  1.0
  Co  Co2  1  0.50000000  0.70753200  0.66979400  1.0
  Co  Co3  1  0.00000000  0.29246800  0.16979400  1.0
  Co  Co4  1  0.00000000  0.27300600  0.49872500  1.0
  Co  Co5  1  0.00000000  0.14797500  0.83242900  1.0
  O  O6  1  0.00000000  0.01755200  0.26980500  1.0
  O  O7  1  0.00000000  0.88197700  0.93130100  1.0
  O  O8  1  0.50000000  0.98244800  0.76980500  1.0
  O  O9  1  0.50000000  0.11802300  0.43130100  1.0
  O  O10  1  0.50000000  0.44470900  0.56430900  1.0
  O  O11  1  0.00000000  0.55529100  0.06430900  1.0
  F  F12  1  0.00000000  0.92708100  0.60150900  1.0
  F  F13  1  0.50000000  0.07291900  0.10150900  1.0
  F  F14  1  0.50000000  0.52868700  0.23604400  1.0
  F  F15  1  0.50000000  0.35512900  0.89612700  1.0
  F  F16  1  0.00000000  0.64487100  0.39612700  1.0
  F  F17  1  0.00000000  0.47131300  0.73604400  1.0