# generated using pymatgen
data_Tb3ThHgRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.65311142
_cell_length_b   9.65311241
_cell_length_c   9.65311263
_cell_angle_alpha   60.00000265
_cell_angle_beta   59.99999925
_cell_angle_gamma   59.99999704
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb3ThHgRu
_chemical_formula_sum   'Tb12 Th4 Hg4 Ru4'
_cell_volume   636.04384601
_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
  Tb  Tb0  1  0.06111239  0.43888761  0.43888761  1.0
  Tb  Tb1  1  0.43888761  0.06111239  0.06111239  1.0
  Tb  Tb2  1  0.43888761  0.06111239  0.43888761  1.0
  Tb  Tb3  1  0.06111239  0.43888761  0.06111239  1.0
  Tb  Tb4  1  0.43888761  0.43888761  0.06111239  1.0
  Tb  Tb5  1  0.06111239  0.06111239  0.43888761  1.0
  Tb  Tb6  1  0.18681994  0.81318006  0.81318006  1.0
  Tb  Tb7  1  0.81318006  0.18681994  0.18681994  1.0
  Tb  Tb8  1  0.81318006  0.18681994  0.81318006  1.0
  Tb  Tb9  1  0.18681994  0.81318006  0.18681994  1.0
  Tb  Tb10  1  0.81318006  0.81318006  0.18681994  1.0
  Tb  Tb11  1  0.18681994  0.18681994  0.81318006  1.0
  Th  Th12  1  0.59849972  0.59849972  0.59849972  1.0
  Th  Th13  1  0.59849972  0.59849972  0.20449985  1.0
  Th  Th14  1  0.59849972  0.20449985  0.59849972  1.0
  Th  Th15  1  0.20449985  0.59849972  0.59849972  1.0
  Hg  Hg16  1  0.83497090  0.83497090  0.83497090  1.0
  Hg  Hg17  1  0.83497090  0.83497090  0.49508729  1.0
  Hg  Hg18  1  0.83497090  0.49508729  0.83497090  1.0
  Hg  Hg19  1  0.49508729  0.83497090  0.83497090  1.0
  Ru  Ru20  1  0.39376524  0.39376524  0.39376524  1.0
  Ru  Ru21  1  0.39376524  0.39376524  0.81870427  1.0
  Ru  Ru22  1  0.39376524  0.81870427  0.39376524  1.0
  Ru  Ru23  1  0.81870427  0.39376524  0.39376524  1.0