# generated using pymatgen
data_Nd(TiAu2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.67847885
_cell_length_b   5.67847810
_cell_length_c   5.67847747
_cell_angle_alpha   102.42849380
_cell_angle_beta   102.42849290
_cell_angle_gamma   124.71940202
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd(TiAu2)2
_chemical_formula_sum   'Nd1 Ti2 Au4'
_cell_volume   133.32623628
_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
  Nd  Nd0  1  0.00000000  0.00000000  0.00000000  1.0
  Ti  Ti1  1  0.25000000  0.75000000  0.50000000  1.0
  Ti  Ti2  1  0.75000000  0.25000000  0.50000000  1.0
  Au  Au3  1  0.69732143  0.30267857  0.00000000  1.0
  Au  Au4  1  0.69732143  0.69732143  0.39464485  1.0
  Au  Au5  1  0.30267857  0.30267857  0.60535515  1.0
  Au  Au6  1  0.30267857  0.69732143  1.00000000  1.0