data_[Cs8Te4H24Se4O40]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Te  2.1000  1.4000  1.2933
  H  2.2000  0.2500  0.0000
  Se  2.5500  1.1500  1.0133
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [13.1290]
_cell_length_b [7.5235]
_cell_length_c [12.6018]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.4786]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Cs2TeH6SeO10]
_chemical_formula_sum '[Cs8 Te4 H24 Se4 O40]'
_cell_volume [1166.1026]
_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  4  0.1425  0.5083  0.8561  1
  Cs  Cs1  4  0.3633  0.0312  0.1103  1
  Te  Te2  2  0.0000  0.0000  0.0000  1
  Te  Te3  2  0.5000  0.0000  0.5000  1
  H  H4  4  0.0782  0.2121  0.6002  1
  H  H5  4  0.1255  0.7482  0.5986  1
  H  H6  4  0.1292  0.0342  0.8946  1
  H  H7  4  0.3875  0.5223  0.1254  1
  H  H8  4  0.3903  0.7033  0.8378  1
  H  H9  4  0.4090  0.2461  0.8777  1
  Se  Se10  4  0.2543  0.0011  0.7511  1
  O  O11  4  0.0258  0.1975  0.1076  1
  O  O12  4  0.0841  0.1205  0.9211  1
  O  O13  4  0.1329  0.6160  0.5999  1
  O  O14  4  0.1505  0.5125  0.1265  1
  O  O15  4  0.2172  0.5850  0.3550  1
  O  O16  4  0.2891  0.2148  0.7790  1
  O  O17  4  0.3626  0.6142  0.2449  1
  O  O18  4  0.3850  0.0565  0.5605  1
  O  O19  4  0.3867  0.5766  0.8604  1
  O  O20  4  0.4836  0.2402  0.4386  1
]