# generated using pymatgen
data_CsTh3Te5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.47290459
_cell_length_b   13.53924134
_cell_length_c   23.84475520
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CsTh3Te5
_chemical_formula_sum   'Cs4 Th12 Te20'
_cell_volume   1444.03204930
_cell_formula_units_Z   4
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
  Cs  Cs0  1  0.25000000  0.85335740  0.09230636  1.0
  Cs  Cs1  1  0.75000000  0.14664260  0.90769364  1.0
  Cs  Cs2  1  0.75000000  0.35335740  0.40769364  1.0
  Cs  Cs3  1  0.25000000  0.64664260  0.59230636  1.0
  Th  Th4  1  0.75000000  0.78201024  0.82745197  1.0
  Th  Th5  1  0.25000000  0.21798976  0.17254803  1.0
  Th  Th6  1  0.25000000  0.28201024  0.67254803  1.0
  Th  Th7  1  0.75000000  0.71798976  0.32745197  1.0
  Th  Th8  1  0.25000000  0.96840054  0.69244033  1.0
  Th  Th9  1  0.75000000  0.03159946  0.30755967  1.0
  Th  Th10  1  0.75000000  0.46840054  0.80755967  1.0
  Th  Th11  1  0.25000000  0.53159946  0.19244033  1.0
  Th  Th12  1  0.75000000  0.39183584  0.06924034  1.0
  Th  Th13  1  0.25000000  0.60816416  0.93075966  1.0
  Th  Th14  1  0.25000000  0.89183584  0.43075966  1.0
  Th  Th15  1  0.75000000  0.10816416  0.56924034  1.0
  Te  Te16  1  0.25000000  0.93796428  0.56335507  1.0
  Te  Te17  1  0.75000000  0.06203572  0.43664493  1.0
  Te  Te18  1  0.75000000  0.43796428  0.93664493  1.0
  Te  Te19  1  0.25000000  0.56203572  0.06335507  1.0
  Te  Te20  1  0.75000000  0.76765138  0.95978531  1.0
  Te  Te21  1  0.25000000  0.23234862  0.04021469  1.0
  Te  Te22  1  0.25000000  0.26765138  0.54021469  1.0
  Te  Te23  1  0.75000000  0.73234862  0.45978531  1.0
  Te  Te24  1  0.25000000  0.94944855  0.82771837  1.0
  Te  Te25  1  0.75000000  0.05055145  0.17228163  1.0
  Te  Te26  1  0.75000000  0.44944855  0.67228163  1.0
  Te  Te27  1  0.25000000  0.55055145  0.32771837  1.0
  Te  Te28  1  0.75000000  0.12931425  0.70602451  1.0
  Te  Te29  1  0.25000000  0.87068575  0.29397549  1.0
  Te  Te30  1  0.25000000  0.62931425  0.79397549  1.0
  Te  Te31  1  0.75000000  0.37068575  0.20602451  1.0
  Te  Te32  1  0.75000000  0.69500055  0.19300752  1.0
  Te  Te33  1  0.25000000  0.30499945  0.80699248  1.0
  Te  Te34  1  0.25000000  0.19500055  0.30699248  1.0
  Te  Te35  1  0.75000000  0.80499945  0.69300752  1.0