# generated using pymatgen
data_Ba3LiIn11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.52478596
_cell_length_b   10.52478596
_cell_length_c   9.61598800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999975
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba3LiIn11
_chemical_formula_sum   'Ba6 Li2 In22'
_cell_volume   922.46753447
_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  0.51690800  0.03381700  0.25000000  1.0
  Ba  Ba1  1  0.48309200  0.96618300  0.75000000  1.0
  Ba  Ba2  1  0.96618300  0.48309200  0.25000000  1.0
  Ba  Ba3  1  0.03381700  0.51690800  0.75000000  1.0
  Ba  Ba4  1  0.51690800  0.48309200  0.25000000  1.0
  Ba  Ba5  1  0.48309200  0.51690800  0.75000000  1.0
  Li  Li6  1  0.00000000  0.00000000  0.00000000  1.0
  Li  Li7  1  0.00000000  0.00000000  0.50000000  1.0
  In  In8  1  0.16937400  0.33874800  0.04727900  1.0
  In  In9  1  0.83062600  0.66125200  0.95272100  1.0
  In  In10  1  0.66125200  0.83062600  0.04727900  1.0
  In  In11  1  0.83062600  0.66125200  0.54727900  1.0
  In  In12  1  0.33874800  0.16937400  0.95272100  1.0
  In  In13  1  0.16937400  0.33874800  0.45272100  1.0
  In  In14  1  0.16937400  0.83062600  0.04727900  1.0
  In  In15  1  0.33874800  0.16937400  0.54727900  1.0
  In  In16  1  0.83062600  0.16937400  0.95272100  1.0
  In  In17  1  0.66125200  0.83062600  0.45272100  1.0
  In  In18  1  0.83062600  0.16937400  0.54727900  1.0
  In  In19  1  0.16937400  0.83062600  0.45272100  1.0
  In  In20  1  0.89735300  0.79470600  0.25000000  1.0
  In  In21  1  0.10264700  0.20529400  0.75000000  1.0
  In  In22  1  0.20529400  0.10264700  0.25000000  1.0
  In  In23  1  0.79470600  0.89735300  0.75000000  1.0
  In  In24  1  0.89735300  0.10264700  0.25000000  1.0
  In  In25  1  0.10264700  0.89735300  0.75000000  1.0
  In  In26  1  0.33333300  0.66666700  0.04561800  1.0
  In  In27  1  0.66666700  0.33333300  0.95438200  1.0
  In  In28  1  0.66666700  0.33333300  0.54561800  1.0
  In  In29  1  0.33333300  0.66666700  0.45438200  1.0