# generated using pymatgen
data_Nd8Si12IrAu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.23808983
_cell_length_b   8.23810215
_cell_length_c   8.67782561
_cell_angle_alpha   90.00859961
_cell_angle_beta   89.99145642
_cell_angle_gamma   120.00050544
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd8Si12IrAu3
_chemical_formula_sum   'Nd8 Si12 Ir1 Au3'
_cell_volume   510.02683526
_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  0.00001130  0.99999070  0.75124755  1.0
  Nd  Nd1  1  0.99998342  0.00001858  0.24884370  1.0
  Nd  Nd2  1  0.49682218  0.50317582  0.75501324  1.0
  Nd  Nd3  1  0.49686981  0.99371015  0.75500296  1.0
  Nd  Nd4  1  0.00629285  0.50313119  0.75500496  1.0
  Nd  Nd5  1  0.49748862  0.50250938  0.24501393  1.0
  Nd  Nd6  1  0.00503392  0.50249563  0.24501987  1.0
  Nd  Nd7  1  0.49750337  0.99496608  0.24502187  1.0
  Si  Si8  1  0.83789773  0.16210127  0.99954512  1.0
  Si  Si9  1  0.83790649  0.67581458  0.99953154  1.0
  Si  Si10  1  0.32418542  0.16209351  0.99953154  1.0
  Si  Si11  1  0.83600046  0.16399954  0.50005835  1.0
  Si  Si12  1  0.83600497  0.67199783  0.50001362  1.0
  Si  Si13  1  0.32800317  0.16399503  0.50001462  1.0
  Si  Si14  1  0.16378789  0.83621111  0.50015694  1.0
  Si  Si15  1  0.67243082  0.83620903  0.50014393  1.0
  Si  Si16  1  0.16378997  0.32756918  0.50014293  1.0
  Si  Si17  1  0.16880411  0.83119589  0.00059449  1.0
  Si  Si18  1  0.66240254  0.83120488  0.00059758  1.0
  Si  Si19  1  0.16879412  0.33759546  0.00059758  1.0
  Ir  Ir20  1  0.33333537  0.66666263  0.00040747  1.0
  Au  Au21  1  0.66665819  0.33334181  0.99900935  1.0
  Au  Au22  1  0.66666558  0.33333542  0.50117168  1.0
  Au  Au23  1  0.33332571  0.66667329  0.49831719  1.0