data_[Li8Ti8Cr8Ni2O36]
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
  Ni  1.9100  1.3500  0.7400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pbam]
_cell_length_a [9.2689]
_cell_length_b [24.1776]
_cell_length_c [2.9321]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [55]
_chemical_formula_structural [Li4Ti4Cr4NiO18]
_chemical_formula_sum '[Li8 Ti8 Cr8 Ni2 O36]'
_cell_volume [657.0880]
_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
[
  Li  Li0  4  0.1680  0.1914  0.0000  1
  Li  Li1  4  0.2011  0.9894  0.0000  1
  Ti  Ti2  4  0.0182  0.9016  0.0000  1
  Ti  Ti3  4  0.1898  0.8091  0.5000  1
  Cr  Cr4  4  0.0345  0.6833  0.0000  1
  Cr  Cr5  4  0.1701  0.5863  0.5000  1
  Ni  Ni6  2  0.0000  0.5000  0.0000  1
  O  O7  4  0.0215  0.1557  0.5000  1
  O  O8  4  0.0313  0.5945  0.0000  1
  O  O9  4  0.0780  0.9476  0.5000  1
  O  O10  4  0.1056  0.2976  0.5000  1
  O  O11  4  0.1344  0.5039  0.5000  1
  O  O12  4  0.1351  0.7583  0.0000  1
  O  O13  4  0.1749  0.6662  0.5000  1
  O  O14  4  0.1853  0.0762  0.0000  1
  O  O15  4  0.2068  0.8620  0.0000  1
]