data_[Na6Fe4Mo10O32]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Fe  1.8300  1.4000  0.8525
  Mo  2.1600  1.4500  0.7750
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [5.7516]
_cell_length_b [5.7516]
_cell_length_c [21.9457]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Na3Fe2Mo5O16]
_chemical_formula_sum '[Na6 Fe4 Mo10 O32]'
_cell_volume [628.7240]
_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
[
  Na  Na0  2  0.3333  0.6667  0.6162  1
  Na  Na1  2  0.3333  0.6667  0.1112  1
  Na  Na2  1  0.0000  0.0000  0.0000  1
  Na  Na3  1  0.0000  0.0000  0.5000  1
  Fe  Fe4  2  0.0000  0.0000  0.1459  1
  Fe  Fe5  2  0.0000  0.0000  0.3491  1
  Mo  Mo6  6  0.0329  0.5164  0.2494  1
  Mo  Mo7  2  0.3333  0.6667  0.4330  1
  Mo  Mo8  2  0.3333  0.6667  0.9277  1
  O  O9  6  0.1569  0.3137  0.9068  1
  O  O10  6  0.1580  0.3159  0.4119  1
  O  O11  6  0.1605  0.3211  0.1946  1
  O  O12  6  0.1703  0.3405  0.6995  1
  O  O13  2  0.3333  0.6667  0.0082  1
  O  O14  2  0.3333  0.6667  0.3139  1
  O  O15  2  0.3333  0.6667  0.5132  1
  O  O16  2  0.3333  0.6667  0.7977  1
]