# generated using pymatgen
data_Th2Ir5Rh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.30828172
_cell_length_b   5.30828287
_cell_length_c   13.61608996
_cell_angle_alpha   78.75954712
_cell_angle_beta   78.75955617
_cell_angle_gamma   60.00001048
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th2Ir5Rh2
_chemical_formula_sum   'Th4 Ir10 Rh4'
_cell_volume   323.74386919
_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  0.95094591  0.95094591  0.14716327  1.0
  Th  Th1  1  0.04905409  0.04905409  0.85283673  1.0
  Th  Th2  1  0.85341871  0.85341871  0.43974186  1.0
  Th  Th3  1  0.14658129  0.14658129  0.56025814  1.0
  Ir  Ir4  1  0.50000000  0.50000000  0.50000000  1.0
  Ir  Ir5  1  0.00000000  0.50000000  0.00000000  1.0
  Ir  Ir6  1  0.50000000  0.00000000  0.00000000  1.0
  Ir  Ir7  1  0.50000000  0.50000000  0.00000000  1.0
  Ir  Ir8  1  0.38937167  0.38937167  0.32941959  1.0
  Ir  Ir9  1  0.89183607  0.38937167  0.32941959  1.0
  Ir  Ir10  1  0.38937167  0.89183607  0.32941959  1.0
  Ir  Ir11  1  0.61062833  0.61062833  0.67058041  1.0
  Ir  Ir12  1  0.10816393  0.61062833  0.67058041  1.0
  Ir  Ir13  1  0.61062833  0.10816393  0.67058041  1.0
  Rh  Rh14  1  0.72215108  0.72215108  0.83354576  1.0
  Rh  Rh15  1  0.27784892  0.27784892  0.16645424  1.0
  Rh  Rh16  1  0.61121003  0.61121003  0.16636890  1.0
  Rh  Rh17  1  0.38878997  0.38878997  0.83363110  1.0