# generated using pymatgen
data_Ba(LaSe2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.06829684
_cell_length_b   8.06846596
_cell_length_c   8.06843643
_cell_angle_alpha   109.27609862
_cell_angle_beta   109.27398811
_cell_angle_gamma   109.86388531
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba(LaSe2)2
_chemical_formula_sum   'Ba2 La4 Se8'
_cell_volume   404.32182130
_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
  Ba  Ba0  1  0.62499578  0.37499941  0.24999880  1.0
  Ba  Ba1  1  0.87499525  0.12499917  0.74999736  1.0
  La  La2  1  0.12392348  0.74999878  0.87392687  1.0
  La  La3  1  0.25000426  0.62392723  0.37392997  1.0
  La  La4  1  0.37607556  0.25000128  0.62607795  1.0
  La  La5  1  0.75000133  0.87608038  0.12608733  1.0
  Se  Se6  1  0.01436673  0.85702434  0.49683246  1.0
  Se  Se7  1  0.14295709  0.13978494  0.15731367  1.0
  Se  Se8  1  0.35704280  0.51436859  0.99683074  1.0
  Se  Se9  1  0.48564026  0.98245905  0.84264338  1.0
  Se  Se10  1  0.63979430  0.64297072  0.65735264  1.0
  Se  Se11  1  0.48247137  0.98565193  0.34265415  1.0
  Se  Se12  1  0.86020358  0.51753228  0.00317840  1.0
  Se  Se13  1  0.01752823  0.36019988  0.50317827  1.0