[CIF]
data_Ti4Ni2O
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.98233188
_cell_length_b   7.98233188
_cell_length_c   7.98233188
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti4Ni2O
_chemical_formula_sum   'Ti16 Ni8 O4'
_cell_volume   359.64526174
_cell_formula_units_Z   4
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
  Ti  Ti0  1  5.64436100  7.70946618  5.64436100  1
  Ti  Ti1  1  5.64436100  5.64436100  7.70946618  1
  Ti  Ti2  1  7.70946618  5.64436100  5.64436100  1
  Ti  Ti3  1  5.64436100  3.57925582  5.64436100  1
  Ti  Ti4  1  5.64436100  5.64436100  3.57925582  1
  Ti  Ti5  1  3.57925582  5.64436100  5.64436100  1
  Ti  Ti6  1  8.46654150  6.26341476  8.46654150  1
  Ti  Ti7  1  8.46654150  8.46654150  6.26341476  1
  Ti  Ti8  1  6.26341476  8.46654150  8.46654150  1
  Ti  Ti9  1  8.46654150  10.66966824  8.46654150  1
  Ti  Ti10  1  8.46654150  8.46654150  10.66966824  1
  Ti  Ti11  1  10.66966824  8.46654150  8.46654150  1
  Ti  Ti12  1  10.34554457  10.34554457  10.34554457  1
  Ti  Ti13  1  10.34554457  6.58753843  6.58753843  1
  Ti  Ti14  1  6.58753843  6.58753843  10.34554457  1
  Ti  Ti15  1  6.58753843  10.34554457  6.58753843  1
  Ni  Ni16  1  1.43546919  1.43546919  1.43546919  1
  Ni  Ni17  1  1.43546919  4.20889181  4.20889181  1
  Ni  Ni18  1  4.20889181  4.20889181  1.43546919  1
  Ni  Ni19  1  4.20889181  1.43546919  4.20889181  1
  Ni  Ni20  1  3.81933871  3.81933871  3.81933871  1
  Ni  Ni21  1  3.81933871  7.46938329  7.46938329  1
  Ni  Ni22  1  7.46938329  7.46938329  3.81933871  1
  Ni  Ni23  1  7.46938329  3.81933871  7.46938329  1
  O  O24  1  7.06306267  7.06306267  7.06306267  1
  O  O25  1  7.06306267  4.22565933  4.22565933  1
  O  O26  1  4.22565933  4.22565933  7.06306267  1
  O  O27  1  4.22565933  7.06306267  4.22565933  1
[/CIF]
