data_[Na6Li2Mo2O10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Li  0.9800  1.4500  0.9000
  Mo  2.1600  1.4500  0.7750
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.5956]
_cell_length_b [5.9704]
_cell_length_c [7.3957]
_cell_angle_alpha [76.6328]
_cell_angle_beta [72.4111]
_cell_angle_gamma [73.6328]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Na3LiMoO5]
_chemical_formula_sum '[Na6 Li2 Mo2 O10]'
_cell_volume [223.0827]
_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  0.3037  0.9537  0.3934  1
  Na  Na1  2  0.3334  0.4444  0.3857  1
  Na  Na2  2  0.4820  0.2520  0.0092  1
  Li  Li3  2  0.1054  0.6431  0.8401  1
  Mo  Mo4  2  0.0916  0.1622  0.7833  1
  O  O5  2  0.0107  0.2382  0.5526  1
  O  O6  2  0.1527  0.0460  0.0867  1
  O  O7  2  0.1562  0.5772  0.1087  1
  O  O8  2  0.3476  0.8788  0.7227  1
  O  O9  2  0.3502  0.3341  0.7269  1
]