# generated using pymatgen
data_Th(Si2Ir3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.01139913
_cell_length_b   7.01139889
_cell_length_c   3.88475649
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000574
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th(Si2Ir3)2
_chemical_formula_sum   'Th1 Si4 Ir6'
_cell_volume   165.38791525
_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  0.00000000  1.0
  Si  Si1  1  0.66666700  0.33333300  0.00000000  1.0
  Si  Si2  1  0.20142749  0.79857251  0.50000000  1.0
  Si  Si3  1  0.20142749  0.40285697  0.50000000  1.0
  Si  Si4  1  0.59714303  0.79857251  0.50000000  1.0
  Ir  Ir5  1  0.46838408  0.53161592  0.00000000  1.0
  Ir  Ir6  1  0.46838408  0.93676615  0.00000000  1.0
  Ir  Ir7  1  0.06323385  0.53161592  0.00000000  1.0
  Ir  Ir8  1  0.80214416  0.19785584  0.50000000  1.0
  Ir  Ir9  1  0.80214416  0.60428931  0.50000000  1.0
  Ir  Ir10  1  0.39571069  0.19785584  0.50000000  1.0