# generated using pymatgen
data_TbTh5(SnIr)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.52425100
_cell_length_b   7.54133258
_cell_length_c   8.22254936
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.92323858
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TbTh5(SnIr)6
_chemical_formula_sum   'Tb1 Th5 Sn6 Ir6'
_cell_volume   404.37462582
_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  0.40474270  0.00000246  0.75000000  1.0
  Th  Th1  1  0.41351341  0.99992656  0.25000000  1.0
  Th  Th2  1  0.58483231  0.58751847  0.75000000  1.0
  Th  Th3  1  0.58988190  0.58770248  0.25000000  1.0
  Th  Th4  1  0.00208319  0.41224425  0.25000000  1.0
  Th  Th5  1  0.99733533  0.41248170  0.75000000  1.0
  Sn  Sn6  1  0.25149400  0.24650401  0.50210349  1.0
  Sn  Sn7  1  0.25149400  0.24650401  0.99789651  1.0
  Sn  Sn8  1  0.74429239  0.00000287  0.99643685  1.0
  Sn  Sn9  1  0.00499465  0.75350151  0.50214086  1.0
  Sn  Sn10  1  0.74429239  0.00000287  0.50356315  1.0
  Sn  Sn11  1  0.00499465  0.75350151  0.99785914  1.0
  Ir  Ir12  1  0.67187895  0.33821102  0.49981877  1.0
  Ir  Ir13  1  0.67187895  0.33821102  0.00018123  1.0
  Ir  Ir14  1  0.33368951  0.66184576  0.00020934  1.0
  Ir  Ir15  1  0.33368951  0.66184576  0.49979066  1.0
  Ir  Ir16  1  0.99525760  0.00003129  0.75000000  1.0
  Ir  Ir17  1  0.99965555  0.99996244  0.25000000  1.0