# generated using pymatgen
data_CeTh2(SiIr)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.08096789
_cell_length_b   4.19847152
_cell_length_c   12.53784905
_cell_angle_alpha   80.36147175
_cell_angle_beta   80.63367102
_cell_angle_gamma   89.99999711
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CeTh2(SiIr)4
_chemical_formula_sum   'Ce1 Th2 Si4 Ir4'
_cell_volume   208.88327551
_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
  Ce  Ce0  1  0.14531611  0.64531611  0.70936677  1.0
  Th  Th1  1  0.00097599  0.00097599  0.99804902  1.0
  Th  Th2  1  0.85434944  0.35434944  0.29130313  1.0
  Si  Si3  1  0.69651039  0.19651039  0.60697921  1.0
  Si  Si4  1  0.30249049  0.80249049  0.39501702  1.0
  Si  Si5  1  0.45132118  0.45132118  0.09735764  1.0
  Si  Si6  1  0.54997825  0.54997825  0.90004149  1.0
  Ir  Ir7  1  0.59749513  0.09749513  0.80500973  1.0
  Ir  Ir8  1  0.40182819  0.90182819  0.19634262  1.0
  Ir  Ir9  1  0.24945743  0.24945743  0.50108515  1.0
  Ir  Ir10  1  0.75027639  0.75027639  0.49944721  1.0