# generated using pymatgen
data_Th10Sn6HgBi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.70063891
_cell_length_b   9.70063811
_cell_length_c   6.60914258
_cell_angle_alpha   90.01305207
_cell_angle_beta   90.01304985
_cell_angle_gamma   120.05287535
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th10Sn6HgBi
_chemical_formula_sum   'Th10 Sn6 Hg1 Bi1'
_cell_volume   538.32519709
_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
  Th  Th0  1  0.00402276  0.72347085  0.74933502  1.0
  Th  Th1  1  0.27619309  0.27619309  0.74916186  1.0
  Th  Th2  1  0.33071506  0.66740142  0.49852107  1.0
  Th  Th3  1  0.66740142  0.33071506  0.49852107  1.0
  Th  Th4  1  0.72184219  0.72184219  0.25053547  1.0
  Th  Th5  1  0.72347085  0.00402276  0.74933502  1.0
  Th  Th6  1  0.00015182  0.27856365  0.25067219  1.0
  Th  Th7  1  0.27856365  0.00015182  0.25067219  1.0
  Th  Th8  1  0.33082080  0.66708287  0.00135880  1.0
  Th  Th9  1  0.66708287  0.33082080  0.00135880  1.0
  Sn  Sn10  1  0.00055990  0.37942259  0.75089055  1.0
  Sn  Sn11  1  0.37942259  0.00055990  0.75089055  1.0
  Sn  Sn12  1  0.62137958  0.99971820  0.24890001  1.0
  Sn  Sn13  1  0.37884697  0.37884697  0.24930714  1.0
  Sn  Sn14  1  0.99971820  0.62137958  0.24890001  1.0
  Sn  Sn15  1  0.99926497  0.99926497  0.49892287  1.0
  Hg  Hg16  1  0.99963186  0.99963186  0.00180350  1.0
  Bi  Bi17  1  0.62091242  0.62091242  0.75091387  1.0