# generated using pymatgen
data_LiY3Si2(O4F)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.26610000
_cell_length_b   9.26610000
_cell_length_c   11.75421928
_cell_angle_alpha   50.66507125
_cell_angle_beta   50.66507125
_cell_angle_gamma   30.95086965
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiY3Si2(O4F)2
_chemical_formula_sum   'Li2 Y6 Si4 O16 F4'
_cell_volume   390.98892303
_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  0.00000000  0.50000000  0.00000000  1
  Li  Li1  1  0.50000000  0.00000000  0.50000000  1
  Y  Y2  1  0.78705100  0.21294900  0.25000000  1
  Y  Y3  1  0.21294900  0.78705100  0.75000000  1
  Y  Y4  1  0.67279600  0.07958200  0.09153400  1
  Y  Y5  1  0.92041800  0.32720400  0.40846600  1
  Y  Y6  1  0.32720400  0.92041800  0.90846600  1
  Y  Y7  1  0.07958200  0.67279600  0.59153400  1
  Si  Si8  1  0.08725400  0.63319700  0.29346600  1
  Si  Si9  1  0.36680300  0.91274600  0.20653400  1
  Si  Si10  1  0.91274600  0.36680300  0.70653400  1
  Si  Si11  1  0.63319700  0.08725400  0.79346600  1
  O  O12  1  0.42613700  0.31128300  0.28494300  1
  O  O13  1  0.68871700  0.57386300  0.21505700  1
  O  O14  1  0.57386300  0.68871700  0.71505700  1
  O  O15  1  0.31128300  0.42613700  0.78494300  1
  O  O16  1  0.04944400  0.87925600  0.13925700  1
  O  O17  1  0.12074400  0.95055600  0.36074300  1
  O  O18  1  0.95055600  0.12074400  0.86074300  1
  O  O19  1  0.87925600  0.04944400  0.63925700  1
  O  O20  1  0.88081000  0.67106600  0.29019100  1
  O  O21  1  0.32893400  0.11919000  0.20980900  1
  O  O22  1  0.11919000  0.32893400  0.70980900  1
  O  O23  1  0.67106600  0.88081000  0.79019100  1
  O  O24  1  0.93176400  0.77080300  0.42860200  1
  O  O25  1  0.22919700  0.06823600  0.07139800  1
  O  O26  1  0.06823600  0.22919700  0.57139800  1
  O  O27  1  0.77080300  0.93176400  0.92860200  1
  F  F28  1  0.53274400  0.31568800  0.47858500  1
  F  F29  1  0.68431200  0.46725600  0.02141500  1
  F  F30  1  0.46725600  0.68431200  0.52141500  1
  F  F31  1  0.31568800  0.53274400  0.97858500  1
