# generated using pymatgen
data_Th3Hg3IrAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.96258867
_cell_length_b   7.96258774
_cell_length_c   3.89400920
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999566
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th3Hg3IrAu2
_chemical_formula_sum   'Th3 Hg3 Ir1 Au2'
_cell_volume   213.81399904
_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  0.41586800  0.02110214  0.50000000  1.0
  Th  Th1  1  0.97889786  0.39476686  0.50000000  1.0
  Th  Th2  1  0.60523314  0.58413200  0.50000000  1.0
  Hg  Hg3  1  0.73046395  0.99374691  0.00000000  1.0
  Hg  Hg4  1  0.00625309  0.73671704  0.00000000  1.0
  Hg  Hg5  1  0.26328296  0.26953605  0.00000000  1.0
  Ir  Ir6  1  0.66666700  0.33333300  0.00000000  1.0
  Au  Au7  1  0.33333300  0.66666700  0.00000000  1.0
  Au  Au8  1  0.00000000  0.00000000  0.50000000  1.0