# generated using pymatgen
data_LiYSe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.02634936
_cell_length_b   7.02634936
_cell_length_c   7.02634936
_cell_angle_alpha   132.34462296
_cell_angle_beta   132.34462296
_cell_angle_gamma   69.68527398
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiYSe2
_chemical_formula_sum   'Li2 Y2 Se4'
_cell_volume   185.85838180
_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  0.25000000  0.75000000  0.50000000  1
  Li  Li1  1  0.50000000  0.50000000  0.00000000  1
  Y  Y2  1  -0.00000000  -0.00000000  0.00000000  1
  Y  Y3  1  0.75000000  0.25000000  0.50000000  1
  Se  Se4  1  0.75338715  0.75338715  -0.00000000  1
  Se  Se5  1  0.99661285  0.49661285  0.50000000  1
  Se  Se6  1  0.50338715  0.00338715  0.50000000  1
  Se  Se7  1  0.24661285  0.24661285  0.00000000  1
