# generated using pymatgen
data_Th2Si4Ir3Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.20902196
_cell_length_b   4.20902196
_cell_length_c   9.79559259
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th2Si4Ir3Ru
_chemical_formula_sum   'Th2 Si4 Ir3 Ru1'
_cell_volume   173.53740468
_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  0.00000000  0.50000000  0.25490308  1.0
  Th  Th1  1  0.50000000  0.00000000  0.74509692  1.0
  Si  Si2  1  0.00000000  0.00000000  0.50000000  1.0
  Si  Si3  1  0.50000000  0.50000000  0.50000000  1.0
  Si  Si4  1  0.00000000  0.50000000  0.87607793  1.0
  Si  Si5  1  0.50000000  0.00000000  0.12392207  1.0
  Ir  Ir6  1  0.50000000  0.50000000  0.00000000  1.0
  Ir  Ir7  1  0.00000000  0.50000000  0.62749402  1.0
  Ir  Ir8  1  0.50000000  0.00000000  0.37250598  1.0
  Ru  Ru9  1  0.00000000  0.00000000  0.00000000  1.0