# generated using pymatgen
data_Zr3AlAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.79915617
_cell_length_b   8.79915617
_cell_length_c   8.79915617
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3AlAu2
_chemical_formula_sum   'Zr12 Al4 Au8'
_cell_volume   481.73486627
_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  0.80298600  0.80298600  0.19701400  1.0
  Zr  Zr1  1  0.19701400  0.19701400  0.80298600  1.0
  Zr  Zr2  1  0.80298600  0.19701400  0.80298600  1.0
  Zr  Zr3  1  0.19701400  0.80298600  0.19701400  1.0
  Zr  Zr4  1  0.19701400  0.80298600  0.80298600  1.0
  Zr  Zr5  1  0.80298600  0.19701400  0.19701400  1.0
  Zr  Zr6  1  0.44701400  0.44701400  0.05298600  1.0
  Zr  Zr7  1  0.05298600  0.05298600  0.44701400  1.0
  Zr  Zr8  1  0.44701400  0.05298600  0.44701400  1.0
  Zr  Zr9  1  0.05298600  0.44701400  0.05298600  1.0
  Zr  Zr10  1  0.05298600  0.44701400  0.44701400  1.0
  Zr  Zr11  1  0.44701400  0.05298600  0.05298600  1.0
  Al  Al12  1  0.12500000  0.62500000  0.62500000  1.0
  Al  Al13  1  0.62500000  0.12500000  0.62500000  1.0
  Al  Al14  1  0.62500000  0.62500000  0.12500000  1.0
  Al  Al15  1  0.62500000  0.62500000  0.62500000  1.0
  Au  Au16  1  0.76142300  0.41285900  0.41285900  1.0
  Au  Au17  1  0.41285900  0.76142300  0.41285900  1.0
  Au  Au18  1  0.41285900  0.41285900  0.76142300  1.0
  Au  Au19  1  0.41285900  0.41285900  0.41285900  1.0
  Au  Au20  1  0.48857700  0.83714100  0.83714100  1.0
  Au  Au21  1  0.83714100  0.48857700  0.83714100  1.0
  Au  Au22  1  0.83714100  0.83714100  0.48857700  1.0
  Au  Au23  1  0.83714100  0.83714100  0.83714100  1.0