# generated using pymatgen
data_Cs(HfSe2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.53625741
_cell_length_b   7.54750698
_cell_length_c   17.75251507
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cs(HfSe2)2
_chemical_formula_sum   'Cs4 Hf8 Se16'
_cell_volume   875.77503446
_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  0.35602146  0.00000000  0.00000000  1.0
  Cs  Cs1  1  0.64397854  0.50000000  0.50000000  1.0
  Cs  Cs2  1  0.02931406  0.00000000  0.50000000  1.0
  Cs  Cs3  1  0.97068594  0.50000000  0.00000000  1.0
  Hf  Hf4  1  0.00193081  0.00000000  0.24962680  1.0
  Hf  Hf5  1  0.00193081  0.00000000  0.75037320  1.0
  Hf  Hf6  1  0.99806919  0.50000000  0.25037320  1.0
  Hf  Hf7  1  0.99806919  0.50000000  0.74962680  1.0
  Hf  Hf8  1  0.50000000  0.25000000  0.25000000  1.0
  Hf  Hf9  1  0.50000000  0.75000000  0.75000000  1.0
  Hf  Hf10  1  0.50000000  0.75000000  0.25000000  1.0
  Hf  Hf11  1  0.50000000  0.25000000  0.75000000  1.0
  Se  Se12  1  0.83430701  0.24926390  0.33877162  1.0
  Se  Se13  1  0.83430701  0.75073610  0.66122838  1.0
  Se  Se14  1  0.16569299  0.74926390  0.16122838  1.0
  Se  Se15  1  0.16569299  0.25073610  0.83877162  1.0
  Se  Se16  1  0.16569299  0.25073610  0.16122838  1.0
  Se  Se17  1  0.16569299  0.74926390  0.83877162  1.0
  Se  Se18  1  0.83430701  0.75073610  0.33877162  1.0
  Se  Se19  1  0.83430701  0.24926390  0.66122838  1.0
  Se  Se20  1  0.66997293  0.00000000  0.16182706  1.0
  Se  Se21  1  0.66997293  0.00000000  0.83817294  1.0
  Se  Se22  1  0.33002707  0.50000000  0.33817294  1.0
  Se  Se23  1  0.33002707  0.50000000  0.66182706  1.0
  Se  Se24  1  0.33781312  0.00000000  0.33808535  1.0
  Se  Se25  1  0.33781312  0.00000000  0.66191465  1.0
  Se  Se26  1  0.66218688  0.50000000  0.16191465  1.0
  Se  Se27  1  0.66218688  0.50000000  0.83808535  1.0