# generated using pymatgen
data_LiInSe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.95886981
_cell_length_b   3.95886981
_cell_length_c   6.92324893
_cell_angle_alpha   73.38668047
_cell_angle_beta   73.38668047
_cell_angle_gamma   60.00000310
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiInSe2
_chemical_formula_sum   'Li1 In1 Se2'
_cell_volume   88.69996542
_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  0.00000000  0.00000000  0.00000000  1
  In  In1  1  0.50000000  0.50000000  0.50000000  1
  Se  Se2  1  0.75152100  0.75152100  0.74543700  1
  Se  Se3  1  0.24847900  0.24847900  0.25456300  1
