# generated using pymatgen
data_BaCu5P2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.13286290
_cell_length_b   4.13286290
_cell_length_c   8.89059228
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaCu5P2Au
_chemical_formula_sum   'Ba1 Cu5 P2 Au1'
_cell_volume   151.85625735
_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  0.50000000  0.50000000  0.50000000  1.0
  Cu  Cu1  1  0.00000000  0.50000000  0.18241533  1.0
  Cu  Cu2  1  0.00000000  0.50000000  0.81758467  1.0
  Cu  Cu3  1  0.50000000  0.00000000  0.18241533  1.0
  Cu  Cu4  1  0.50000000  0.00000000  0.81758467  1.0
  Cu  Cu5  1  0.00000000  0.00000000  0.00000000  1.0
  P  P6  1  0.00000000  0.00000000  0.29119850  1.0
  P  P7  1  0.00000000  0.00000000  0.70880150  1.0
  Au  Au8  1  0.50000000  0.50000000  0.00000000  1.0