data_[Cs2Mo4As2O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Mo  2.1600  1.4500  0.7750
  As  2.1800  1.1500  0.6600
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.5329]
_cell_length_b [5.9503]
_cell_length_c [8.7664]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.9107]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CsMo2AsO8]
_chemical_formula_sum '[Cs2 Mo4 As2 O16]'
_cell_volume [496.0975]
_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  0.0000  0.5000  1.0
  Mo  Mo1  4  0.1321  0.5000  0.8066  1.0
  As  As2  2  0.0000  0.0000  0.0000  1.0
  O  O3  8  0.0258  0.2489  0.8299  1.0
  O  O4  4  0.1850  0.5000  0.6189  1.0
  O  O5  4  0.2167  0.0000  0.0575  1.0
]