# generated using pymatgen
data_Nd11Th3NiIr5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.83509705
_cell_length_b   10.09782291
_cell_length_c   6.43133884
_cell_angle_alpha   90.15992280
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.14299759
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd11Th3NiIr5
_chemical_formula_sum   'Nd11 Th3 Ni1 Ir5'
_cell_volume   557.85617588
_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  0.45932080  0.53021279  0.30023749  1.0
  Nd  Nd1  1  0.07089100  0.53021279  0.30023749  1.0
  Nd  Nd2  1  0.92696890  0.46991772  0.80218562  1.0
  Nd  Nd3  1  0.25210086  0.12475473  0.50294255  1.0
  Nd  Nd4  1  0.53884765  0.07769329  0.81086517  1.0
  Nd  Nd5  1  0.74654079  0.87287608  0.00302298  1.0
  Nd  Nd6  1  0.66617315  0.33234529  0.27517352  1.0
  Nd  Nd7  1  0.12633529  0.87287608  0.00302298  1.0
  Nd  Nd8  1  0.46222969  0.92446038  0.30639544  1.0
  Nd  Nd9  1  0.54294982  0.46991772  0.80218562  1.0
  Nd  Nd10  1  0.87265386  0.12475473  0.50294255  1.0
  Th  Th11  1  0.12588995  0.25178091  0.99202345  1.0
  Th  Th12  1  0.87416512  0.74833123  0.49360841  1.0
  Th  Th13  1  0.33466802  0.66933804  0.76649397  1.0
  Ni  Ni14  1  0.81073797  0.62147594  0.06157922  1.0
  Ir  Ir15  1  0.82637549  0.19624853  0.04615136  1.0
  Ir  Ir16  1  0.62555564  0.80181239  0.54915093  1.0
  Ir  Ir17  1  0.36987304  0.19624853  0.04615136  1.0
  Ir  Ir18  1  0.19146621  0.38293143  0.57047998  1.0
  Ir  Ir19  1  0.17625575  0.80181239  0.54915093  1.0