data_[Li8Ti6Mn4Ni6O32]
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
  Mn  1.5500  1.4000  0.6483
  Ni  1.9100  1.3500  0.7400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [10.2355]
_cell_length_b [5.8308]
_cell_length_c [9.4547]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.9337]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Li4Ti3Mn2Ni3O16]
_chemical_formula_sum '[Li8 Ti6 Mn4 Ni6 O32]'
_cell_volume [563.9438]
_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  2  0.0182  0.0000  0.0095  1
  Li  Li1  2  0.1623  0.5000  0.5989  1
  Li  Li2  2  0.3362  0.0000  0.1052  1
  Li  Li3  2  0.4988  0.5000  0.5061  1
  Ti  Ti4  4  0.4119  0.2481  0.7889  1
  Ti  Ti5  2  0.3327  0.5000  0.2838  1
  Mn  Mn6  2  0.1629  0.5000  0.0189  1
  Mn  Mn7  2  0.3289  0.0000  0.5152  1
  Ni  Ni8  4  0.0877  0.2535  0.2894  1
  Ni  Ni9  2  0.1709  0.0000  0.7876  1
  O  O10  4  0.0788  0.2600  0.9030  1
  O  O11  4  0.2463  0.2843  0.1503  1
  O  O12  4  0.2645  0.2240  0.6497  1
  O  O13  4  0.4047  0.2494  0.4009  1
  O  O14  2  0.0066  0.0000  0.1985  1
  O  O15  2  0.0255  0.5000  0.1573  1
  O  O16  2  0.1607  0.0000  0.4085  1
  O  O17  2  0.1652  0.5000  0.3896  1
  O  O18  2  0.3298  0.5000  0.8976  1
  O  O19  2  0.3439  0.0000  0.8997  1
  O  O20  2  0.4761  0.0000  0.6569  1
  O  O21  2  0.4941  0.5000  0.6946  1
]