# generated using pymatgen
data_CoOF
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.48157700
_cell_length_b   4.50899200
_cell_length_c   8.99859900
_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   181.83824300
_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  0.77488600  0.02521400  0.66634700  1.0
  Co  Co1  1  0.77488600  0.02521400  0.33365300  1.0
  Co  Co2  1  0.72927200  0.96587900  0.00000000  1.0
  Co  Co3  1  0.27072800  0.46587900  0.50000000  1.0
  Co  Co4  1  0.22511400  0.52521400  0.83365300  1.0
  Co  Co5  1  0.22511400  0.52521400  0.16634700  1.0
  O  O6  1  0.92608700  0.80859100  0.83624300  1.0
  O  O7  1  0.92608700  0.80859100  0.16375700  1.0
  O  O8  1  0.42438800  0.69186200  0.00000000  1.0
  O  O9  1  0.07391300  0.30859100  0.66375700  1.0
  O  O10  1  0.07391300  0.30859100  0.33624300  1.0
  O  O11  1  0.57561200  0.19186200  0.50000000  1.0
  F  F12  1  0.98067700  0.78013100  0.50000000  1.0
  F  F13  1  0.46661000  0.69695200  0.34090100  1.0
  F  F14  1  0.46661000  0.69695200  0.65909900  1.0
  F  F15  1  0.01932300  0.28013100  0.00000000  1.0
  F  F16  1  0.53339000  0.19695200  0.84090100  1.0
  F  F17  1  0.53339000  0.19695200  0.15909900  1.0