data_[Li16Ti8Cr8O32]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ti  1.5400  1.4000  0.8517
  Cr  1.6600  1.4000  0.9400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [8.3726]
_cell_length_b [8.3799]
_cell_length_c [8.7143]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.3396]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [Li2TiCrO4]
_chemical_formula_sum '[Li16 Ti8 Cr8 O32]'
_cell_volume [611.2357]
_cell_formula_units_Z [8]
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  0.1221  0.6225  0.1310  1
  Li  Li1  4  0.1239  0.1277  0.6202  1
  Li  Li2  4  0.1267  0.8731  0.8676  1
  Li  Li3  4  0.1282  0.3696  0.3730  1
  Ti  Ti4  4  0.1198  0.1306  0.1212  1
  Ti  Ti5  4  0.1221  0.6186  0.6185  1
  Cr  Cr6  4  0.1238  0.8783  0.3763  1
  Cr  Cr7  4  0.1307  0.3748  0.8712  1
  O  O8  4  0.1170  0.8649  0.6116  1
  O  O9  4  0.1177  0.3584  0.1389  1
  O  O10  4  0.1206  0.6372  0.3812  1
  O  O11  4  0.1219  0.8881  0.1422  1
  O  O12  4  0.1262  0.1245  0.8871  1
  O  O13  4  0.1310  0.1180  0.3678  1
  O  O14  4  0.1342  0.6231  0.8553  1
  O  O15  4  0.1347  0.3906  0.6075  1
]