# generated using pymatgen
data_Li4Ti2Cr3Ni3O16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.88139642
_cell_length_b   5.88139642
_cell_length_c   9.45267878
_cell_angle_alpha   88.07875345
_cell_angle_beta   88.07875345
_cell_angle_gamma   59.10673824
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Ti2Cr3Ni3O16
_chemical_formula_sum   'Li4 Ti2 Cr3 Ni3 O16'
_cell_volume   280.37787175
_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  0.66059700  0.66059700  0.10820300  1
  Li  Li1  1  0.99774100  0.99774100  0.00720200  1
  Li  Li2  1  0.99710100  0.99710100  0.50480000  1
  Li  Li3  1  0.33664600  0.33664600  0.60396700  1
  Ti  Ti4  1  0.66305600  0.66305600  0.49982600  1
  Ti  Ti5  1  0.33203000  0.33203000  0.00187700  1
  Cr  Cr6  1  0.34653200  0.83607300  0.78041900  1
  Cr  Cr7  1  0.83607300  0.34653200  0.78041900  1
  Cr  Cr8  1  0.17081600  0.17081600  0.27853700  1
  Ni  Ni9  1  0.82960300  0.82960300  0.79106300  1
  Ni  Ni10  1  0.16716800  0.65711600  0.28805900  1
  Ni  Ni11  1  0.65711600  0.16716800  0.28805900  1
  O  O12  1  0.33725800  0.84502200  0.40445600  1
  O  O13  1  0.52053500  0.52053500  0.65792400  1
  O  O14  1  0.64877900  0.64877900  0.89661500  1
  O  O15  1  0.00757000  0.00757000  0.69606400  1
  O  O16  1  0.00024700  0.00024700  0.19609600  1
  O  O17  1  0.84502200  0.33725800  0.40445600  1
  O  O18  1  0.50976200  0.96161400  0.65821500  1
  O  O19  1  0.96161400  0.50976200  0.65821500  1
  O  O20  1  0.16871100  0.16871100  0.89999900  1
  O  O21  1  0.83634800  0.83634800  0.40433500  1
  O  O22  1  0.03231600  0.46794700  0.15650200  1
  O  O23  1  0.46794700  0.03231600  0.15650200  1
  O  O24  1  0.32774400  0.32774400  0.38919200  1
  O  O25  1  0.17716200  0.66412000  0.90820700  1
  O  O26  1  0.47396700  0.47396700  0.16696300  1
  O  O27  1  0.66412000  0.17716200  0.90820700  1
