data_[Ba2Li2Mo4O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  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 [I-4m2]
_cell_length_a [7.8943]
_cell_length_b [7.8943]
_cell_length_c [7.1740]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [119]
_chemical_formula_structural [BaLi(MoO4)2]
_chemical_formula_sum '[Ba2 Li2 Mo4 O16]'
_cell_volume [447.0839]
_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
[
  Ba  Ba0  2  0.0000  0.0000  0.0000  1
  Li  Li1  2  0.0000  0.5000  0.7500  1
  Mo  Mo2  2  0.0000  0.0000  0.5000  1
  Mo  Mo3  2  0.0000  0.5000  0.2500  1
  O  O4  8  0.0000  0.1838  0.6498  1
  O  O5  8  0.0000  0.3198  0.0981  1
]