# generated using pymatgen
data_LiCoOF
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.02560300
_cell_length_b   3.02560300
_cell_length_c   16.52685700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCoOF
_chemical_formula_sum   'Li4 Co4 O4 F4'
_cell_volume   151.29136930
_cell_formula_units_Z   4
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  0.00000000  0.50000000  0.31799700  1
  Li  Li1  1  0.50000000  0.00000000  0.44059900  1
  Li  Li2  1  0.00000000  0.50000000  0.55940100  1
  Li  Li3  1  0.50000000  0.00000000  0.68200300  1
  Co  Co4  1  0.00000000  0.50000000  0.81169600  1
  Co  Co5  1  0.50000000  0.00000000  0.93353800  1
  Co  Co6  1  0.00000000  0.50000000  0.06646200  1
  Co  Co7  1  0.50000000  0.00000000  0.18830400  1
  O  O8  1  0.50000000  0.00000000  0.80629300  1
  O  O9  1  0.00000000  0.50000000  0.93724400  1
  O  O10  1  0.50000000  0.00000000  0.06275600  1
  O  O11  1  0.00000000  0.50000000  0.19370700  1
  F  F12  1  0.50000000  0.00000000  0.32065900  1
  F  F13  1  0.00000000  0.50000000  0.43975500  1
  F  F14  1  0.50000000  0.00000000  0.56024500  1
  F  F15  1  0.00000000  0.50000000  0.67934100  1
