# generated using pymatgen
data_La(ThS2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.18700999
_cell_length_b   11.18701018
_cell_length_c   4.03589306
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999060
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La(ThS2)6
_chemical_formula_sum   'La1 Th6 S12'
_cell_volume   437.41974417
_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
  La  La0  1  0.00000000  0.00000000  0.00000000  1.0
  Th  Th1  1  0.56681585  0.84800301  0.00000000  1.0
  Th  Th2  1  0.28118616  0.43318415  0.00000000  1.0
  Th  Th3  1  0.15199699  0.71881384  0.00000000  1.0
  Th  Th4  1  0.43960289  0.15287616  0.50000000  1.0
  Th  Th5  1  0.71327326  0.56039711  0.50000000  1.0
  Th  Th6  1  0.84712384  0.28672674  0.50000000  1.0
  S  S7  1  0.86069186  0.48688716  0.00000000  1.0
  S  S8  1  0.62619330  0.13930814  0.00000000  1.0
  S  S9  1  0.51311284  0.37380670  0.00000000  1.0
  S  S10  1  0.13998542  0.52485619  0.50000000  1.0
  S  S11  1  0.38487177  0.86001458  0.50000000  1.0
  S  S12  1  0.47514381  0.61512823  0.50000000  1.0
  S  S13  1  0.74857873  0.74329370  0.00000000  1.0
  S  S14  1  0.99471397  0.25142127  0.00000000  1.0
  S  S15  1  0.25670630  0.00528603  0.00000000  1.0
  S  S16  1  0.21579260  0.22202646  0.50000000  1.0
  S  S17  1  0.00623385  0.78420740  0.50000000  1.0
  S  S18  1  0.77797354  0.99376615  0.50000000  1.0