# generated using pymatgen
data_LaErSe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.39206525
_cell_length_b   7.39206525
_cell_length_c   7.39206580
_cell_angle_alpha   32.24356718
_cell_angle_beta   32.24356718
_cell_angle_gamma   32.24357339
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaErSe2
_chemical_formula_sum   'La1 Er1 Se2'
_cell_volume   102.19265344
_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
  La  La0  1  0.50000000  0.50000000  0.50000000  1.0
  Er  Er1  1  -0.00000000  -0.00000000  0.00000000  1.0
  Se  Se2  1  0.25827205  0.25827205  0.25827205  1.0
  Se  Se3  1  0.74172795  0.74172795  0.74172795  1.0