# generated using pymatgen
data_Th8Si12IrRh3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.19935534
_cell_length_b   8.19935529
_cell_length_c   8.50269010
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999623
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th8Si12IrRh3
_chemical_formula_sum   'Th8 Si12 Ir1 Rh3'
_cell_volume   495.04697614
_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  0.00000000  0.24941643  1.0
  Th  Th1  1  0.00000000  0.00000000  0.75051351  1.0
  Th  Th2  1  0.49927668  0.50072332  0.25012983  1.0
  Th  Th3  1  0.49927668  0.99855537  0.25012983  1.0
  Th  Th4  1  0.00144463  0.50072332  0.25012983  1.0
  Th  Th5  1  0.49922728  0.50077272  0.74984027  1.0
  Th  Th6  1  0.49922728  0.99845356  0.74984027  1.0
  Th  Th7  1  0.00154644  0.50077272  0.74984027  1.0
  Si  Si8  1  0.16588445  0.83411555  0.49977100  1.0
  Si  Si9  1  0.16588445  0.33177089  0.49977100  1.0
  Si  Si10  1  0.66822911  0.83411555  0.49977100  1.0
  Si  Si11  1  0.83287757  0.16712243  0.50018422  1.0
  Si  Si12  1  0.83287757  0.66575613  0.50018422  1.0
  Si  Si13  1  0.33424387  0.16712243  0.50018422  1.0
  Si  Si14  1  0.83329788  0.16670212  0.00001795  1.0
  Si  Si15  1  0.83329788  0.66659476  0.00001795  1.0
  Si  Si16  1  0.33340524  0.16670212  0.00001795  1.0
  Si  Si17  1  0.16676992  0.83323008  0.99990997  1.0
  Si  Si18  1  0.16676992  0.33354083  0.99990997  1.0
  Si  Si19  1  0.66645917  0.83323008  0.99990997  1.0
  Ir  Ir20  1  0.33333300  0.66666700  0.50028218  1.0
  Rh  Rh21  1  0.66666700  0.33333300  0.49998307  1.0
  Rh  Rh22  1  0.66666700  0.33333300  0.99972164  1.0
  Rh  Rh23  1  0.33333300  0.66666700  0.00051948  1.0