data_[Li4Mo4Cl16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Mo  2.1600  1.4500  0.7750
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [7.3787]
_cell_length_b [14.8565]
_cell_length_c [5.4485]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.1977]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [LiMoCl4]
_chemical_formula_sum '[Li4 Mo4 Cl16]'
_cell_volume [540.4385]
_cell_formula_units_Z [4]
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
[
  Li  Li0  4  0.0000  0.2467  0.2500  1.0
  Mo  Mo1  4  0.0000  0.0440  0.7500  1.0
  Cl  Cl2  8  0.1921  0.1734  0.6829  1.0
  Cl  Cl3  8  0.2328  0.0628  0.2160  1.0
]