# generated using pymatgen
data_ZrTiAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.47275510
_cell_length_b   5.47275510
_cell_length_c   8.76411200
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   118.48891026
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrTiAu
_chemical_formula_sum   'Zr4 Ti4 Au4'
_cell_volume   230.70875845
_cell_formula_units_Z   4
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  0.67702600  0.32297400  0.31230400  1.0
  Zr  Zr1  1  0.33746400  0.66253600  0.18303600  1.0
  Zr  Zr2  1  0.33746400  0.66253600  0.81696400  1.0
  Zr  Zr3  1  0.67702600  0.32297400  0.68769600  1.0
  Ti  Ti4  1  0.15908200  0.84091800  0.50000000  1.0
  Ti  Ti5  1  0.34647700  0.17305000  0.00000000  1.0
  Ti  Ti6  1  0.82695000  0.65352300  0.00000000  1.0
  Ti  Ti7  1  0.81969500  0.18030500  0.00000000  1.0
  Au  Au8  1  0.00616700  0.99383300  0.24300200  1.0
  Au  Au9  1  0.00616700  0.99383300  0.75699800  1.0
  Au  Au10  1  0.64571400  0.83920900  0.50000000  1.0
  Au  Au11  1  0.16079100  0.35428600  0.50000000  1.0