data_[Li1Sb1Te2W1O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Sb  2.0500  1.4500  0.8300
  Te  2.1000  1.4000  1.2933
  W  2.3600  1.3500  0.7667
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.1545]
_cell_length_b [5.3569]
_cell_length_c [7.4375]
_cell_angle_alpha [93.2334]
_cell_angle_beta [90.1243]
_cell_angle_gamma [90.0478]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [LiSbTe2WO12]
_chemical_formula_sum '[Li1 Sb1 Te2 W1 O12]'
_cell_volume [205.0382]
_cell_formula_units_Z [1]
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  1  0.9990  0.5762  0.7131  1.0
  Sb  Sb1  1  0.4995  0.5012  0.4919  1.0
  Te  Te2  1  0.0006  0.0050  0.4965  1.0
  Te  Te3  1  0.5021  0.5052  0.9992  1.0
  W  W4  1  0.0011  0.0095  0.0030  1.0
  O  O5  1  0.1041  0.9917  0.7514  1.0
  O  O6  1  0.1711  0.6847  0.4511  1.0
  O  O7  1  0.1983  0.3067  0.0541  1.0
  O  O8  1  0.3004  0.8057  0.0535  1.0
  O  O9  1  0.3119  0.1796  0.4367  1.0
  O  O10  1  0.3726  0.4987  0.7535  1.0
  O  O11  1  0.6272  0.5064  0.2412  1.0
  O  O12  1  0.6983  0.1998  0.9441  1.0
  O  O13  1  0.7052  0.8062  0.5687  1.0
  O  O14  1  0.8068  0.6938  0.9367  1.0
  O  O15  1  0.8170  0.3110  0.5647  1.0
  O  O16  1  0.8846  0.0042  0.2479  1.0
]