data_[Cs2Cr6Ga2H2O20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Cr  1.6600  1.4000  0.9400
  Ga  1.8100  1.3000  0.7600
  H  2.2000  0.2500  0.0000
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [9.4776]
_cell_length_b [8.8178]
_cell_length_c [6.3256]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.3197]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [CsCr3GaHO10]
_chemical_formula_sum '[Cs2 Cr6 Ga2 H2 O20]'
_cell_volume [492.4621]
_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  2  0.0000  0.9468  0.5000  1
  Cr  Cr1  4  0.1856  0.3218  0.8965  1
  Cr  Cr2  2  0.0000  0.5204  0.5000  1
  Ga  Ga3  2  0.0000  0.6142  0.0000  1
  H  H4  2  0.0000  0.1768  0.0000  1
  O  O5  4  0.0600  0.1790  0.8646  1
  O  O6  4  0.0632  0.6329  0.3375  1
  O  O7  4  0.1295  0.7848  0.9881  1
  O  O8  4  0.1548  0.3937  0.6207  1
  O  O9  4  0.1548  0.4583  0.0656  1
]