# generated using pymatgen
data_ZrScAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.24766313
_cell_length_b   11.24766313
_cell_length_c   11.24766313
_cell_angle_alpha   123.42635105
_cell_angle_beta   118.88273449
_cell_angle_gamma   88.05826469
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrScAu2
_chemical_formula_sum   'Zr1 Sc1 Au2'
_cell_volume   985.97009269
_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  0.50000000  0.50000000  1.0
  Sc  Sc1  1  0.00000000  0.00000000  0.00000000  1.0
  Au  Au2  1  0.00000000  0.24533800  0.24533800  1.0
  Au  Au3  1  0.00000000  0.75466200  0.75466200  1.0