# generated using pymatgen
data_Li8PSe6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.56381629
_cell_length_b   7.56381629
_cell_length_c   7.56381629
_cell_angle_alpha   120.78753348
_cell_angle_beta   120.78753348
_cell_angle_gamma   88.64127987
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li8PSe6
_chemical_formula_sum   'Li8 P1 Se6'
_cell_volume   302.25589946
_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  0.68620900  0.99911000  0.65564300  1.0
  Li  Li1  1  0.34346700  0.03056700  0.34435700  1.0
  Li  Li2  1  0.01542500  0.37746600  0.97064200  1.0
  Li  Li3  1  0.62253400  0.59317500  0.63795800  1.0
  Li  Li4  1  0.95521700  0.98457500  0.36204200  1.0
  Li  Li5  1  0.00089000  0.65653300  0.68710000  1.0
  Li  Li6  1  0.96943300  0.31379100  0.31290000  1.0
  Li  Li7  1  0.40682500  0.04478300  0.02935800  1.0
  P  P8  1  0.50000000  0.50000000  0.00000000  1.0
  Se  Se9  1  0.38832700  0.64651300  0.27106600  1.0
  Se  Se10  1  0.88273900  0.61167300  0.25818500  1.0
  Se  Se11  1  0.35348700  0.62455300  0.74181500  1.0
  Se  Se12  1  0.37544700  0.11726100  0.72893400  1.0
  Se  Se13  1  0.00000000  0.00000000  0.00000000  1.0
  Se  Se14  1  0.75000000  0.25000000  0.50000000  1.0