# generated using pymatgen
data_LiYF4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.22970222
_cell_length_b   5.26989880
_cell_length_c   6.56481174
_cell_angle_alpha   113.30915844
_cell_angle_beta   113.11557316
_cell_angle_gamma   90.81741884
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiYF4
_chemical_formula_sum   'Li2 Y2 F8'
_cell_volume   149.70670362
_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  0.62956700  0.37956700  0.75913400  1
  Li  Li1  1  0.37043300  0.62043300  0.24086600  1
  Y  Y2  1  0.87578600  0.12578600  0.25157200  1
  Y  Y3  1  0.12421400  0.87421400  0.74842800  1
  F  F4  1  0.87827500  0.17589500  0.91487500  1
  F  F5  1  0.17522800  0.54237600  0.41262300  1
  F  F6  1  0.46340000  0.26102000  0.08512500  1
  F  F7  1  0.73739500  0.87024700  0.41262300  1
  F  F8  1  0.12172500  0.82410500  0.08512500  1
  F  F9  1  0.53660000  0.73898000  0.91487500  1
  F  F10  1  0.26260500  0.12975300  0.58737700  1
  F  F11  1  0.82477200  0.45762400  0.58737700  1
