# generated using pymatgen
data_Nd4HgIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.88246750
_cell_length_b   9.88246787
_cell_length_c   9.88246750
_cell_angle_alpha   60.00000122
_cell_angle_beta   59.99999998
_cell_angle_gamma   60.00000313
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd4HgIr
_chemical_formula_sum   'Nd16 Hg4 Ir4'
_cell_volume   682.46630898
_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
  Nd  Nd0  1  0.59967646  0.59967646  0.59967646  1.0
  Nd  Nd1  1  0.59967646  0.59967646  0.20097162  1.0
  Nd  Nd2  1  0.59967646  0.20097162  0.59967646  1.0
  Nd  Nd3  1  0.20097162  0.59967646  0.59967646  1.0
  Nd  Nd4  1  0.05776606  0.44223394  0.44223394  1.0
  Nd  Nd5  1  0.44223394  0.05776606  0.05776606  1.0
  Nd  Nd6  1  0.44223394  0.05776606  0.44223394  1.0
  Nd  Nd7  1  0.05776606  0.44223394  0.05776606  1.0
  Nd  Nd8  1  0.44223394  0.44223394  0.05776606  1.0
  Nd  Nd9  1  0.05776606  0.05776606  0.44223394  1.0
  Nd  Nd10  1  0.19014773  0.80985227  0.80985227  1.0
  Nd  Nd11  1  0.80985227  0.19014773  0.19014773  1.0
  Nd  Nd12  1  0.80985227  0.19014773  0.80985227  1.0
  Nd  Nd13  1  0.19014773  0.80985227  0.19014773  1.0
  Nd  Nd14  1  0.80985227  0.80985227  0.19014773  1.0
  Nd  Nd15  1  0.19014773  0.19014773  0.80985227  1.0
  Hg  Hg16  1  0.83322181  0.83322181  0.83322181  1.0
  Hg  Hg17  1  0.83322181  0.83322181  0.50033357  1.0
  Hg  Hg18  1  0.83322181  0.50033357  0.83322181  1.0
  Hg  Hg19  1  0.50033357  0.83322181  0.83322181  1.0
  Ir  Ir20  1  0.39145623  0.39145623  0.39145623  1.0
  Ir  Ir21  1  0.39145623  0.39145623  0.82563032  1.0
  Ir  Ir22  1  0.39145623  0.82563032  0.39145623  1.0
  Ir  Ir23  1  0.82563032  0.39145623  0.39145623  1.0