# generated using pymatgen
data_LiCo6(OF5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.80490179
_cell_length_b   4.76236037
_cell_length_c   9.92126605
_cell_angle_alpha   87.50055242
_cell_angle_beta   87.25810135
_cell_angle_gamma   89.40240329
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCo6(OF5)2
_chemical_formula_sum   'Li1 Co6 O2 F10'
_cell_volume   226.54153436
_cell_formula_units_Z   1
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  0.20364700  0.22513400  0.82565900  1
  Co  Co1  1  0.96921000  0.96417300  0.02235100  1
  Co  Co2  1  0.02046200  0.02178300  0.33081100  1
  Co  Co3  1  0.97726100  0.97637100  0.64840800  1
  Co  Co4  1  0.50415100  0.50263400  0.18335200  1
  Co  Co5  1  0.57794100  0.58094100  0.85961000  1
  Co  Co6  1  0.48016300  0.47939600  0.48387400  1
  O  O7  1  0.31798100  0.31343700  0.31930900  1
  O  O8  1  0.68340600  0.68233300  0.02874900  1
  F  F9  1  0.19954400  0.80663200  0.17339100  1
  F  F10  1  0.19415500  0.80455400  0.82878300  1
  F  F11  1  0.19251300  0.79669600  0.49448200  1
  F  F12  1  0.28565400  0.28630300  0.99539300  1
  F  F13  1  0.27521300  0.27714400  0.64740100  1
  F  F14  1  0.68208400  0.68368800  0.66519300  1
  F  F15  1  0.70804700  0.70621300  0.33309900  1
  F  F16  1  0.80967500  0.19847000  0.17310800  1
  F  F17  1  0.80234200  0.19643000  0.82781900  1
  F  F18  1  0.79710600  0.19211200  0.49492400  1
