# generated using pymatgen
data_LiCo3(OF3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.60274404
_cell_length_b   5.53547419
_cell_length_c   10.22587597
_cell_angle_alpha   97.20808163
_cell_angle_beta   89.98563340
_cell_angle_gamma   90.00703903
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCo3(OF3)2
_chemical_formula_sum   'Li2 Co6 O4 F12'
_cell_volume   258.47961761
_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  0.99912700  0.99903600  0.99980700  1
  Li  Li1  1  0.50053600  0.99893200  0.49947500  1
  Co  Co2  1  0.00869900  0.49690900  0.49526200  1
  Co  Co3  1  0.52960300  0.73446700  0.74429900  1
  Co  Co4  1  0.02541100  0.26850800  0.75468900  1
  Co  Co5  1  0.49135900  0.49686800  0.99535200  1
  Co  Co6  1  0.97036500  0.73448100  0.24431300  1
  Co  Co7  1  0.47468700  0.26854700  0.25458700  1
  O  O8  1  0.68784500  0.52750600  0.17062500  1
  O  O9  1  0.19014400  0.46907100  0.33358600  1
  O  O10  1  0.81213300  0.52765900  0.67066000  1
  O  O11  1  0.30974100  0.46915200  0.83351700  1
  F  F12  1  0.19079800  0.72706400  0.07742500  1
  F  F13  1  0.68874700  0.27644600  0.42347700  1
  F  F14  1  0.30925000  0.72709600  0.57743600  1
  F  F15  1  0.81140100  0.27654100  0.92366500  1
  F  F16  1  0.29992600  0.22704700  0.07587600  1
  F  F17  1  0.80234200  0.77296500  0.42532100  1
  F  F18  1  0.20021000  0.22697100  0.57585100  1
  F  F19  1  0.69788700  0.77274000  0.92519800  1
  F  F20  1  0.77562100  0.03284700  0.18299100  1
  F  F21  1  0.27555000  0.96814200  0.31678200  1
  F  F22  1  0.72423800  0.03290000  0.68303900  1
  F  F23  1  0.22438100  0.96810400  0.81676900  1
