# generated using pymatgen
data_Li2Th5OF22
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.33765700
_cell_length_b   11.33765700
_cell_length_c   6.87766500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Th5OF22
_chemical_formula_sum   'Li4 Th10 O2 F44'
_cell_volume   884.07202114
_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  0.50000000  0.50000000  0.24959800  1
  Li  Li1  1  0.00000000  0.00000000  0.75040200  1
  Li  Li2  1  0.50000000  0.50000000  0.75040200  1
  Li  Li3  1  0.00000000  0.00000000  0.24959800  1
  Th  Th4  1  0.34556600  0.65443400  0.50000000  1
  Th  Th5  1  0.65443400  0.34556600  0.50000000  1
  Th  Th6  1  0.84556600  0.84556600  0.50000000  1
  Th  Th7  1  0.15443400  0.15443400  0.50000000  1
  Th  Th8  1  0.15604400  0.84395600  0.00000000  1
  Th  Th9  1  0.84395600  0.15604400  0.00000000  1
  Th  Th10  1  0.65604400  0.65604400  0.00000000  1
  Th  Th11  1  0.34395600  0.34395600  0.00000000  1
  Th  Th12  1  0.00000000  0.50000000  0.25599200  1
  Th  Th13  1  0.50000000  0.00000000  0.74400800  1
  O  O14  1  0.00000000  0.50000000  0.69661300  1
  O  O15  1  0.50000000  0.00000000  0.30338700  1
  F  F16  1  0.08854500  0.65060800  0.06248300  1
  F  F17  1  0.91145500  0.34939200  0.06248300  1
  F  F18  1  0.58854500  0.84939200  0.93751600  1
  F  F19  1  0.41145500  0.15060800  0.93751600  1
  F  F20  1  0.65060800  0.08854500  0.93751600  1
  F  F21  1  0.34939200  0.91145500  0.93751600  1
  F  F22  1  0.84939200  0.58854500  0.06248300  1
  F  F23  1  0.15060800  0.41145500  0.06248300  1
  F  F24  1  0.99814100  0.83190600  0.24864200  1
  F  F25  1  0.00185900  0.16809400  0.24864200  1
  F  F26  1  0.49814100  0.66809400  0.75135800  1
  F  F27  1  0.50185900  0.33190600  0.75135800  1
  F  F28  1  0.83190600  0.99814100  0.75135800  1
  F  F29  1  0.16809400  0.00185900  0.75135800  1
  F  F30  1  0.66809400  0.49814100  0.24864200  1
  F  F31  1  0.33190600  0.50185900  0.24864200  1
  F  F32  1  0.50352500  0.67644300  0.25159400  1
  F  F33  1  0.49647500  0.32355700  0.25159400  1
  F  F34  1  0.00352500  0.82355700  0.74840600  1
  F  F35  1  0.99647500  0.17644300  0.74840600  1
  F  F36  1  0.67644300  0.50352500  0.74840600  1
  F  F37  1  0.32355700  0.49647500  0.74840600  1
  F  F38  1  0.82355700  0.00352500  0.25159400  1
  F  F39  1  0.17644300  0.99647500  0.25159400  1
  F  F40  1  0.15267100  0.59051000  0.44358000  1
  F  F41  1  0.84732900  0.40949000  0.44358000  1
  F  F42  1  0.65267100  0.90949000  0.55642000  1
  F  F43  1  0.34732900  0.09051000  0.55642000  1
  F  F44  1  0.59051000  0.15267100  0.55642000  1
  F  F45  1  0.40949000  0.84732900  0.55642000  1
  F  F46  1  0.90949000  0.65267100  0.44358000  1
  F  F47  1  0.09051000  0.34732900  0.44358000  1
  F  F48  1  0.26873200  0.76474600  0.24706800  1
  F  F49  1  0.73126800  0.23525400  0.24706800  1
  F  F50  1  0.76873200  0.73525400  0.75293200  1
  F  F51  1  0.23126800  0.26474600  0.75293200  1
  F  F52  1  0.76474600  0.26873200  0.75293200  1
  F  F53  1  0.23525400  0.73126800  0.75293200  1
  F  F54  1  0.73525400  0.76873200  0.24706800  1
  F  F55  1  0.26474600  0.23126800  0.24706800  1
  F  F56  1  0.50000000  0.50000000  0.00000000  1
  F  F57  1  0.00000000  0.00000000  0.00000000  1
  F  F58  1  0.50000000  0.50000000  0.50000000  1
  F  F59  1  0.00000000  0.00000000  0.50000000  1
