# generated using pymatgen
data_Ba2Al4CuAu5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.86148844
_cell_length_b   6.86148930
_cell_length_c   5.56978721
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   104.89882094
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2Al4CuAu5
_chemical_formula_sum   'Ba2 Al4 Cu1 Au5'
_cell_volume   253.41007624
_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
  Ba  Ba0  1  0.83811932  0.83811932  0.00000000  1.0
  Ba  Ba1  1  0.16884357  0.16884357  0.50000000  1.0
  Al  Al2  1  0.30490406  0.69389929  0.25441992  1.0
  Al  Al3  1  0.30490406  0.69389929  0.74558008  1.0
  Al  Al4  1  0.69389929  0.30490406  0.25441992  1.0
  Al  Al5  1  0.69389929  0.30490406  0.74558008  1.0
  Cu  Cu6  1  0.57536515  0.57536515  0.50000000  1.0
  Au  Au7  1  0.40331854  0.01307144  0.00000000  1.0
  Au  Au8  1  0.97243954  0.59630988  0.50000000  1.0
  Au  Au9  1  0.59630988  0.97243954  0.50000000  1.0
  Au  Au10  1  0.01307144  0.40331854  0.00000000  1.0
  Au  Au11  1  0.43492387  0.43492387  0.00000000  1.0