# generated using pymatgen
data_Th3Ir8Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.34226390
_cell_length_b   5.34226428
_cell_length_c   17.77061402
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999765
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th3Ir8Rh
_chemical_formula_sum   'Th6 Ir16 Rh2'
_cell_volume   439.22169459
_cell_formula_units_Z   2
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  0.33333300  0.66666700  0.95766919  1.0
  Th  Th1  1  0.66666700  0.33333300  0.04233081  1.0
  Th  Th2  1  0.66666700  0.33333300  0.45766919  1.0
  Th  Th3  1  0.33333300  0.66666700  0.54233081  1.0
  Th  Th4  1  0.33333300  0.66666700  0.75000000  1.0
  Th  Th5  1  0.66666700  0.33333300  0.25000000  1.0
  Ir  Ir6  1  0.16732882  0.83267118  0.37285719  1.0
  Ir  Ir7  1  0.16732882  0.33465664  0.37285719  1.0
  Ir  Ir8  1  0.66534336  0.83267118  0.37285719  1.0
  Ir  Ir9  1  0.83267118  0.16732882  0.62714281  1.0
  Ir  Ir10  1  0.83267118  0.66534336  0.62714281  1.0
  Ir  Ir11  1  0.33465664  0.16732882  0.62714281  1.0
  Ir  Ir12  1  0.83267118  0.16732882  0.87285719  1.0
  Ir  Ir13  1  0.83267118  0.66534336  0.87285719  1.0
  Ir  Ir14  1  0.33465664  0.16732882  0.87285719  1.0
  Ir  Ir15  1  0.16732882  0.83267118  0.12714281  1.0
  Ir  Ir16  1  0.16732882  0.33465664  0.12714281  1.0
  Ir  Ir17  1  0.66534336  0.83267118  0.12714281  1.0
  Ir  Ir18  1  0.33333300  0.66666700  0.25000000  1.0
  Ir  Ir19  1  0.66666700  0.33333300  0.75000000  1.0
  Ir  Ir20  1  0.00000000  0.00000000  0.50000000  1.0
  Ir  Ir21  1  0.00000000  0.00000000  0.00000000  1.0
  Rh  Rh22  1  0.00000000  0.00000000  0.25000000  1.0
  Rh  Rh23  1  0.00000000  0.00000000  0.75000000  1.0