# generated using pymatgen
data_LiNb3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.05174315
_cell_length_b   7.53813096
_cell_length_c   15.43027160
_cell_angle_alpha   72.66962058
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNb3O8
_chemical_formula_sum   'Li4 Nb12 O32'
_cell_volume   560.92048508
_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
  Li  Li0  1  0.75933922  0.26053894  0.07924853  1
  Li  Li1  1  0.74066078  0.26053894  0.57924853  1
  Li  Li2  1  0.24066078  0.73946106  0.92075147  1
  Li  Li3  1  0.25933922  0.73946106  0.42075147  1
  Nb  Nb4  1  0.74148753  0.51999746  0.83516430  1
  Nb  Nb5  1  0.24148753  0.48000254  0.66483570  1
  Nb  Nb6  1  0.25851247  0.48000254  0.16483570  1
  Nb  Nb7  1  0.75851247  0.51999746  0.33516430  1
  Nb  Nb8  1  0.24516085  0.24850512  0.92648290  1
  Nb  Nb9  1  0.74516085  0.75149488  0.57351710  1
  Nb  Nb10  1  0.75483915  0.75149488  0.07351710  1
  Nb  Nb11  1  0.25483915  0.24850512  0.42648290  1
  Nb  Nb12  1  0.73291531  0.00989052  0.83118305  1
  Nb  Nb13  1  0.23291531  0.99010948  0.66881695  1
  Nb  Nb14  1  0.26708469  0.99010948  0.16881695  1
  Nb  Nb15  1  0.76708469  0.00989052  0.33118305  1
  O  O16  1  0.42058178  0.03686395  0.90043093  1
  O  O17  1  0.92058178  0.96313605  0.59956907  1
  O  O18  1  0.57941822  0.96313605  0.09956907  1
  O  O19  1  0.07941822  0.03686395  0.40043093  1
  O  O20  1  0.56931387  0.35153842  0.95217804  1
  O  O21  1  0.06931387  0.64846158  0.54782196  1
  O  O22  1  0.43068613  0.64846158  0.04782196  1
  O  O23  1  0.93068613  0.35153842  0.45217804  1
  O  O24  1  0.91902619  0.22339435  0.84480053  1
  O  O25  1  0.58097381  0.22339435  0.34480053  1
  O  O26  1  0.08097381  0.77660565  0.15519947  1
  O  O27  1  0.41902619  0.77660565  0.65519947  1
  O  O28  1  0.93286002  0.08835763  0.21678281  1
  O  O29  1  0.43286002  0.91164237  0.28321719  1
  O  O30  1  0.06713998  0.91164237  0.78321719  1
  O  O31  1  0.56713998  0.08835763  0.71678281  1
  O  O32  1  0.90713522  0.73757412  0.34523013  1
  O  O33  1  0.40713522  0.26242588  0.15476987  1
  O  O34  1  0.09286478  0.26242588  0.65476987  1
  O  O35  1  0.59286478  0.73757412  0.84523013  1
  O  O36  1  0.08397956  0.41325642  0.28436170  1
  O  O37  1  0.58397956  0.58674358  0.21563830  1
  O  O38  1  0.91602044  0.58674358  0.71563830  1
  O  O39  1  0.41602044  0.41325642  0.78436170  1
  O  O40  1  0.59939885  0.85288743  0.45956143  1
  O  O41  1  0.09939885  0.14711257  0.04043857  1
  O  O42  1  0.40060115  0.14711257  0.54043857  1
  O  O43  1  0.90060115  0.85288743  0.95956143  1
  O  O44  1  0.43532090  0.50256799  0.40169759  1
  O  O45  1  0.93532090  0.49743201  0.09830241  1
  O  O46  1  0.56467910  0.49743201  0.59830241  1
  O  O47  1  0.06467910  0.50256799  0.90169759  1
