# generated using pymatgen
data_CsTh3Se4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.27126363
_cell_length_b   4.27126390
_cell_length_c   30.41257554
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999013
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CsTh3Se4
_chemical_formula_sum   'Cs2 Th6 Se8'
_cell_volume   480.50361369
_cell_formula_units_Z   2
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  0.66666700  0.33333300  0.25000000  1.0
  Cs  Cs1  1  0.33333300  0.66666700  0.75000000  1.0
  Th  Th2  1  0.66666700  0.33333300  0.60799079  1.0
  Th  Th3  1  0.66666700  0.33333300  0.89200921  1.0
  Th  Th4  1  0.33333300  0.66666700  0.39200921  1.0
  Th  Th5  1  0.33333300  0.66666700  0.10799079  1.0
  Th  Th6  1  0.00000000  0.00000000  0.50000000  1.0
  Th  Th7  1  0.00000000  0.00000000  0.00000000  1.0
  Se  Se8  1  0.00000000  0.00000000  0.16447063  1.0
  Se  Se9  1  0.66666700  0.33333300  0.44558238  1.0
  Se  Se10  1  0.00000000  0.00000000  0.66447063  1.0
  Se  Se11  1  0.33333300  0.66666700  0.94558238  1.0
  Se  Se12  1  0.33333300  0.66666700  0.55441762  1.0
  Se  Se13  1  0.00000000  0.00000000  0.33552937  1.0
  Se  Se14  1  0.66666700  0.33333300  0.05441762  1.0
  Se  Se15  1  0.00000000  0.00000000  0.83552937  1.0