data_[Cs2Re2Mo2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Re  1.9000  1.3500  0.7125
  Mo  2.1600  1.4500  0.7750
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [5.2814]
_cell_length_b [9.6560]
_cell_length_c [6.6236]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.4945]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [CsReMoO6]
_chemical_formula_sum '[Cs2 Re2 Mo2 O12]'
_cell_volume [337.6695]
_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  0.9995  0.0000  1
  Re  Re1  2  0.0000  0.6638  0.5000  1
  Mo  Mo2  2  0.0000  0.3414  0.5000  1
  O  O3  4  0.1056  0.5108  0.3385  1
  O  O4  4  0.1910  0.7888  0.3319  1
  O  O5  4  0.2176  0.1984  0.3315  1
]