# generated using pymatgen
data_Ba2InAuI
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.87662278
_cell_length_b   4.87662246
_cell_length_c   18.83884444
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999545
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2InAuI
_chemical_formula_sum   'Ba4 In2 Au2 I2'
_cell_volume   387.99239192
_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  0.00000000  0.00000000  0.11341079  1.0
  Ba  Ba1  1  0.00000000  0.00000000  0.38658921  1.0
  Ba  Ba2  1  0.00000000  0.00000000  0.61503143  1.0
  Ba  Ba3  1  0.00000000  0.00000000  0.88496857  1.0
  In  In4  1  0.66666600  0.33333400  0.50145418  1.0
  In  In5  1  0.66666600  0.33333400  0.99854582  1.0
  Au  Au6  1  0.33333400  0.66666700  0.00090007  1.0
  Au  Au7  1  0.33333400  0.66666700  0.49909993  1.0
  I  I8  1  0.66666600  0.33333400  0.25000000  1.0
  I  I9  1  0.33333400  0.66666700  0.75000000  1.0