# generated using pymatgen
data_Nd2(AlAu2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.69960050
_cell_length_b   8.69959956
_cell_length_c   8.69960045
_cell_angle_alpha   57.09823376
_cell_angle_beta   57.09824107
_cell_angle_gamma   57.09823977
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd2(AlAu2)3
_chemical_formula_sum   'Nd4 Al6 Au12'
_cell_volume   434.43275531
_cell_formula_units_Z   2
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
  Nd  Nd0  1  0.40918215  0.40918215  0.40918215  1.0
  Nd  Nd1  1  0.90918215  0.90918215  0.90918215  1.0
  Nd  Nd2  1  0.59081785  0.59081785  0.59081785  1.0
  Nd  Nd3  1  0.09081785  0.09081785  0.09081785  1.0
  Al  Al4  1  0.05459954  0.25000000  0.44540046  1.0
  Al  Al5  1  0.44540046  0.05459954  0.25000000  1.0
  Al  Al6  1  0.25000000  0.44540046  0.05459954  1.0
  Al  Al7  1  0.94540046  0.75000000  0.55459954  1.0
  Al  Al8  1  0.55459954  0.94540046  0.75000000  1.0
  Al  Al9  1  0.75000000  0.55459954  0.94540046  1.0
  Au  Au10  1  0.98126199  0.36544296  0.70222215  1.0
  Au  Au11  1  0.70222215  0.98126199  0.36544296  1.0
  Au  Au12  1  0.36544296  0.70222215  0.98126199  1.0
  Au  Au13  1  0.20222215  0.86544296  0.48126199  1.0
  Au  Au14  1  0.48126199  0.20222215  0.86544296  1.0
  Au  Au15  1  0.86544296  0.48126199  0.20222215  1.0
  Au  Au16  1  0.01873801  0.63455704  0.29777785  1.0
  Au  Au17  1  0.29777785  0.01873801  0.63455704  1.0
  Au  Au18  1  0.63455704  0.29777785  0.01873801  1.0
  Au  Au19  1  0.79777785  0.13455704  0.51873801  1.0
  Au  Au20  1  0.51873801  0.79777785  0.13455704  1.0
  Au  Au21  1  0.13455704  0.51873801  0.79777785  1.0