# generated using pymatgen
data_ZrCu2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.22690867
_cell_length_b   9.22690867
_cell_length_c   9.22690867
_cell_angle_alpha   121.69761155
_cell_angle_beta   114.84037076
_cell_angle_gamma   93.12257360
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrCu2Au
_chemical_formula_sum   'Zr1 Cu2 Au1'
_cell_volume   566.69296563
_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
  Zr  Zr0  1  0.00000000  0.00000000  0.00000000  1.0
  Cu  Cu1  1  0.25375800  0.00000000  0.25375800  1.0
  Cu  Cu2  1  0.74624200  0.00000000  0.74624200  1.0
  Au  Au3  1  0.50000000  0.00000000  0.50000000  1.0