# generated using pymatgen
data_Tb13Th3(HgIr)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.68105098
_cell_length_b   9.67479027
_cell_length_c   9.67478989
_cell_angle_alpha   60.00000130
_cell_angle_beta   60.02139156
_cell_angle_gamma   60.02139836
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb13Th3(HgIr)4
_chemical_formula_sum   'Tb13 Th3 Hg4 Ir4'
_cell_volume   640.96008287
_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
  Tb  Tb0  1  0.19319561  0.60226846  0.60226846  1.0
  Tb  Tb1  1  0.06056778  0.44040775  0.44040775  1.0
  Tb  Tb2  1  0.43855813  0.06179854  0.06179854  1.0
  Tb  Tb3  1  0.43855813  0.06179854  0.43784579  1.0
  Tb  Tb4  1  0.06056778  0.44040775  0.05861772  1.0
  Tb  Tb5  1  0.43855813  0.43784579  0.06179854  1.0
  Tb  Tb6  1  0.06056778  0.05861772  0.44040775  1.0
  Tb  Tb7  1  0.18761676  0.81243469  0.81243469  1.0
  Tb  Tb8  1  0.81345512  0.18626587  0.18626587  1.0
  Tb  Tb9  1  0.81345512  0.18626587  0.81401414  1.0
  Tb  Tb10  1  0.18761676  0.81243469  0.18751387  1.0
  Tb  Tb11  1  0.81345512  0.81401414  0.18626587  1.0
  Tb  Tb12  1  0.18761676  0.18751387  0.81243469  1.0
  Th  Th13  1  0.59920095  0.60124343  0.60124343  1.0
  Th  Th14  1  0.59920095  0.60124343  0.19831320  1.0
  Th  Th15  1  0.59920095  0.19831320  0.60124343  1.0
  Hg  Hg16  1  0.83980117  0.83552467  0.83552467  1.0
  Hg  Hg17  1  0.83980117  0.83552467  0.48915050  1.0
  Hg  Hg18  1  0.83980117  0.48915050  0.83552467  1.0
  Hg  Hg19  1  0.48817758  0.83727481  0.83727481  1.0
  Ir  Ir20  1  0.39380974  0.39242542  0.39242542  1.0
  Ir  Ir21  1  0.39380974  0.39242542  0.82133941  1.0
  Ir  Ir22  1  0.39380974  0.82133941  0.39242542  1.0
  Ir  Ir23  1  0.81960085  0.39346638  0.39346638  1.0