# generated using pymatgen
data_Nd3Th(HgAu2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.09676467
_cell_length_b   8.09676428
_cell_length_c   3.85175193
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.73542037
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd3Th(HgAu2)2
_chemical_formula_sum   'Nd3 Th1 Hg2 Au4'
_cell_volume   252.49079245
_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  0.32291737  0.82291737  0.50000000  1.0
  Nd  Nd1  1  0.17555650  0.32489315  0.50000000  1.0
  Nd  Nd2  1  0.82489315  0.67555650  0.50000000  1.0
  Th  Th3  1  0.67400634  0.17400634  0.50000000  1.0
  Hg  Hg4  1  0.00295736  0.00000221  0.00000000  1.0
  Hg  Hg5  1  0.50000221  0.50295736  0.00000000  1.0
  Au  Au6  1  0.12310745  0.62310745  0.00000000  1.0
  Au  Au7  1  0.87149801  0.37149801  0.00000000  1.0
  Au  Au8  1  0.62724888  0.87781273  0.00000000  1.0
  Au  Au9  1  0.37781273  0.12724888  0.00000000  1.0