# generated using pymatgen
data_Tb2Ce(ThIr6)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.31909978
_cell_length_b   5.31909870
_cell_length_c   17.62729780
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000674
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb2Ce(ThIr6)3
_chemical_formula_sum   'Tb2 Ce1 Th3 Ir18'
_cell_volume   431.90927539
_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
  Tb  Tb0  1  0.33333300  0.66666700  0.96114934  1.0
  Tb  Tb1  1  0.66666700  0.33333300  0.03845459  1.0
  Ce  Ce2  1  0.33333300  0.66666700  0.54444924  1.0
  Th  Th3  1  0.66666700  0.33333300  0.45887827  1.0
  Th  Th4  1  0.33333300  0.66666700  0.75485324  1.0
  Th  Th5  1  0.66666700  0.33333300  0.24437163  1.0
  Ir  Ir6  1  0.16741777  0.83258223  0.37215744  1.0
  Ir  Ir7  1  0.16741777  0.33483454  0.37215744  1.0
  Ir  Ir8  1  0.66516546  0.83258223  0.37215744  1.0
  Ir  Ir9  1  0.83277545  0.16722455  0.62746823  1.0
  Ir  Ir10  1  0.83277545  0.66554990  0.62746823  1.0
  Ir  Ir11  1  0.33445010  0.16722455  0.62746823  1.0
  Ir  Ir12  1  0.83278685  0.16721315  0.87510115  1.0
  Ir  Ir13  1  0.83278685  0.66557171  0.87510115  1.0
  Ir  Ir14  1  0.33442829  0.16721315  0.87510115  1.0
  Ir  Ir15  1  0.16719926  0.83280074  0.12463450  1.0
  Ir  Ir16  1  0.16719926  0.33439952  0.12463450  1.0
  Ir  Ir17  1  0.66560048  0.83280074  0.12463450  1.0
  Ir  Ir18  1  0.33333300  0.66666700  0.24894751  1.0
  Ir  Ir19  1  0.66666700  0.33333300  0.75079130  1.0
  Ir  Ir20  1  0.00000000  0.00000000  0.24857304  1.0
  Ir  Ir21  1  0.00000000  0.00000000  0.75127049  1.0
  Ir  Ir22  1  0.00000000  0.00000000  0.50029496  1.0
  Ir  Ir23  1  0.00000000  0.00000000  0.99988143  1.0