data_[Li4Cr1Fe1W2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Cr  1.6600  1.4000  0.9400
  Fe  1.8300  1.4000  0.8525
  W  2.3600  1.3500  0.7667
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.1049]
_cell_length_b [5.4078]
_cell_length_c [7.5070]
_cell_angle_alpha [85.9047]
_cell_angle_beta [89.9459]
_cell_angle_gamma [89.9591]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Li4CrFe(WO6)2]
_chemical_formula_sum '[Li4 Cr1 Fe1 W2 O12]'
_cell_volume [206.7131]
_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  0.0007  0.4546  0.2278  1.0
  Li  Li1  1  0.4926  0.9151  0.2146  1.0
  Li  Li2  1  0.5126  0.9255  0.7088  1.0
  Li  Li3  1  0.9971  0.4372  0.7061  1.0
  Cr  Cr4  1  0.0050  0.9803  0.9812  1.0
  Fe  Fe5  1  0.5021  0.4967  0.5017  1.0
  W  W6  1  0.5047  0.4798  0.0023  1.0
  W  W7  1  0.9898  0.0035  0.4778  1.0
  O  O8  1  0.1189  0.0077  0.7688  1.0
  O  O9  1  0.1777  0.3149  0.4566  1.0
  O  O10  1  0.1927  0.7084  0.0666  1.0
  O  O11  1  0.3031  0.1969  0.0685  1.0
  O  O12  1  0.3076  0.8290  0.4510  1.0
  O  O13  1  0.3775  0.5256  0.7653  1.0
  O  O14  1  0.6149  0.5245  0.2446  1.0
  O  O15  1  0.6979  0.8196  0.9485  1.0
  O  O16  1  0.7068  0.1981  0.5747  1.0
  O  O17  1  0.8101  0.7138  0.5730  1.0
  O  O18  1  0.8124  0.3115  0.9460  1.0
  O  O19  1  0.8759  0.0148  0.2449  1.0
]