# generated using pymatgen
data_LiCo3(OF3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.07747100
_cell_length_b   7.07296568
_cell_length_c   7.47719166
_cell_angle_alpha   78.96507830
_cell_angle_beta   89.58489805
_cell_angle_gamma   89.45185152
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCo3(OF3)2
_chemical_formula_sum   'Li2 Co6 O4 F12'
_cell_volume   263.54578411
_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
  Li  Li0  1  0.23444900  0.17014900  0.15356900  1
  Li  Li1  1  0.76555100  0.82985100  0.84643100  1
  Co  Co2  1  0.28338700  0.66088500  0.18388900  1
  Co  Co3  1  0.75969000  0.83160200  0.32707000  1
  Co  Co4  1  0.25610200  0.68499100  0.68307300  1
  Co  Co5  1  0.74389800  0.31500900  0.31692700  1
  Co  Co6  1  0.24031000  0.16839800  0.67293000  1
  Co  Co7  1  0.71661300  0.33911500  0.81611100  1
  O  O8  1  0.59214300  0.57602400  0.29877200  1
  O  O9  1  0.11758800  0.92717100  0.68419100  1
  O  O10  1  0.88241200  0.07282900  0.31580900  1
  O  O11  1  0.40785700  0.42397600  0.70122800  1
  F  F12  1  0.42568800  0.92327800  0.19118500  1
  F  F13  1  0.95629900  0.80049300  0.09312900  1
  F  F14  1  0.09187700  0.68424200  0.43087100  1
  F  F15  1  0.08059400  0.42537400  0.18896100  1
  F  F16  1  0.58067500  0.31062400  0.07084000  1
  F  F17  1  0.59371600  0.79409000  0.57283900  1
  F  F18  1  0.40628400  0.20591000  0.42716100  1
  F  F19  1  0.41932500  0.68937600  0.92916000  1
  F  F20  1  0.91940600  0.57462600  0.81103900  1
  F  F21  1  0.90812300  0.31575800  0.56912900  1
  F  F22  1  0.04370100  0.19950700  0.90687100  1
  F  F23  1  0.57431200  0.07672200  0.80881500  1
