# generated using pymatgen
data_Th2InAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.98841087
_cell_length_b   7.98840890
_cell_length_c   8.02964506
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.99544132
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th2InAu2
_chemical_formula_sum   'Th8 In4 Au8'
_cell_volume   512.40932888
_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
  Th  Th0  1  0.32387492  0.32359289  0.00000000  1.0
  Th  Th1  1  0.67640711  0.67612508  0.00000000  1.0
  Th  Th2  1  0.82312899  0.17687101  0.00000000  1.0
  Th  Th3  1  0.82390211  0.17609789  0.50000000  1.0
  Th  Th4  1  0.17648344  0.82351656  0.50000000  1.0
  Th  Th5  1  0.67642758  0.67685985  0.50000000  1.0
  Th  Th6  1  0.32314015  0.32357242  0.50000000  1.0
  Th  Th7  1  0.17655346  0.82344654  0.00000000  1.0
  In  In8  1  0.50002732  0.99999849  0.25022602  1.0
  In  In9  1  0.00000151  0.49997268  0.74977398  1.0
  In  In10  1  0.50002732  0.99999849  0.74977398  1.0
  In  In11  1  0.00000151  0.49997268  0.25022602  1.0
  Au  Au12  1  0.62668554  0.37331446  0.25089523  1.0
  Au  Au13  1  0.37334818  0.62665182  0.25006280  1.0
  Au  Au14  1  0.12661481  0.12663624  0.75047712  1.0
  Au  Au15  1  0.87336376  0.87338519  0.75047712  1.0
  Au  Au16  1  0.37334818  0.62665182  0.74993720  1.0
  Au  Au17  1  0.62668554  0.37331446  0.74910477  1.0
  Au  Au18  1  0.87336376  0.87338519  0.24952288  1.0
  Au  Au19  1  0.12661481  0.12663624  0.24952288  1.0