# generated using pymatgen
data_Li6Nb3Fe3O16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.09022801
_cell_length_b   6.09022801
_cell_length_c   10.09495746
_cell_angle_alpha   89.18814540
_cell_angle_beta   89.18814540
_cell_angle_gamma   60.60010316
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Nb3Fe3O16
_chemical_formula_sum   'Li6 Nb3 Fe3 O16'
_cell_volume   326.16570953
_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  0.65879800  0.65879800  0.50100500  1
  Li  Li1  1  0.67120300  0.67120300  0.11045300  1
  Li  Li2  1  0.00513400  0.00513400  0.99503400  1
  Li  Li3  1  0.00888800  0.00888800  0.49924800  1
  Li  Li4  1  0.33648800  0.33648800  0.99365000  1
  Li  Li5  1  0.33251300  0.33251300  0.62398500  1
  Nb  Nb6  1  0.82160700  0.82160700  0.78094500  1
  Nb  Nb7  1  0.16643800  0.66088900  0.28617000  1
  Nb  Nb8  1  0.66088900  0.16643800  0.28617000  1
  Fe  Fe9  1  0.32570200  0.83182300  0.78285700  1
  Fe  Fe10  1  0.83182300  0.32570200  0.78285700  1
  Fe  Fe11  1  0.16493500  0.16493500  0.27995200  1
  O  O12  1  0.30328900  0.84516200  0.38757100  1
  O  O13  1  0.51898400  0.51898400  0.68949900  1
  O  O14  1  0.68345200  0.68345200  0.90914300  1
  O  O15  1  0.99125000  0.99125000  0.67788600  1
  O  O16  1  0.99399200  0.99399200  0.17705400  1
  O  O17  1  0.84516200  0.30328900  0.38757100  1
  O  O18  1  0.50665800  0.96803300  0.67878100  1
  O  O19  1  0.96803300  0.50665800  0.67878100  1
  O  O20  1  0.14977600  0.14977600  0.87638100  1
  O  O21  1  0.84451900  0.84451900  0.39544700  1
  O  O22  1  0.03228300  0.48939800  0.17728900  1
  O  O23  1  0.48939800  0.03228300  0.17728900  1
  O  O24  1  0.33971800  0.33971800  0.40045500  1
  O  O25  1  0.16210400  0.69787000  0.88895800  1
  O  O26  1  0.48873800  0.48873800  0.17860600  1
  O  O27  1  0.69787000  0.16210400  0.88895800  1
