# generated using pymatgen
data_LiNbO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.24995300
_cell_length_b   5.58339653
_cell_length_c   21.72670413
_cell_angle_alpha   94.76912966
_cell_angle_beta   90.01660590
_cell_angle_gamma   117.97801421
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNbO3
_chemical_formula_sum   'Li10 Nb10 O30'
_cell_volume   559.92736570
_cell_formula_units_Z   10
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  0.30838800  0.61811800  0.04555800  1
  Li  Li1  1  0.80733600  0.61445100  0.25866900  1
  Li  Li2  1  0.00697000  0.01390700  0.14390300  1
  Li  Li3  1  0.20778200  0.41465900  0.45773100  1
  Li  Li4  1  0.50716600  0.01547400  0.35786500  1
  Li  Li5  1  0.60797200  0.21492800  0.65790000  1
  Li  Li6  1  0.90691800  0.81483400  0.55794000  1
  Li  Li7  1  0.00780800  0.01534700  0.85798100  1
  Li  Li8  1  0.30715200  0.61506800  0.75775300  1
  Li  Li9  1  0.70506800  0.40920700  0.95808300  1
  Nb  Nb10  1  0.01839800  0.02882300  0.00319200  1
  Nb  Nb11  1  0.41855700  0.83321600  0.20357700  1
  Nb  Nb12  1  0.70633300  0.42027500  0.10490800  1
  Nb  Nb13  1  0.82201700  0.64560400  0.40292000  1
  Nb  Nb14  1  0.12266900  0.24382200  0.30230000  1
  Nb  Nb15  1  0.22304300  0.44707600  0.60307500  1
  Nb  Nb16  1  0.52390200  0.04689000  0.50303400  1
  Nb  Nb17  1  0.62180500  0.24486500  0.80279700  1
  Nb  Nb18  1  0.92387500  0.84665900  0.70302500  1
  Nb  Nb19  1  0.32044600  0.64110700  0.90220300  1
  O  O20  1  0.42309600  0.09494500  0.14901900  1
  O  O21  1  0.42299900  0.23378100  0.02502500  1
  O  O22  1  0.90503100  0.17872400  0.07476700  1
  O  O23  1  0.50766500  0.62962600  0.12559100  1
  O  O24  1  0.97714400  0.58618800  0.17453900  1
  O  O25  1  0.82311000  0.89288100  0.34747100  1
  O  O26  1  0.96418000  0.69109100  0.04885700  1
  O  O27  1  0.82364700  0.00909700  0.22565500  1
  O  O28  1  0.28839100  0.96555700  0.27459200  1
  O  O29  1  0.88874800  0.41249000  0.32528800  1
  O  O30  1  0.37695100  0.36335300  0.37423200  1
  O  O31  1  0.22266000  0.69298800  0.54753000  1
  O  O32  1  0.37529500  0.50073400  0.24948500  1
  O  O33  1  0.22443400  0.81361700  0.42561800  1
  O  O34  1  0.68656700  0.76412200  0.47463600  1
  O  O35  1  0.28868100  0.21416800  0.52569400  1
  O  O36  1  0.77779200  0.16440400  0.57478800  1
  O  O37  1  0.62266500  0.49260900  0.74743300  1
  O  O38  1  0.76992400  0.29263100  0.44742100  1
  O  O39  1  0.62538100  0.61410000  0.62569100  1
  O  O40  1  0.08659600  0.56437200  0.67483400  1
  O  O41  1  0.68857700  0.01408000  0.72542900  1
  O  O42  1  0.17797400  0.96424500  0.77468000  1
  O  O43  1  0.02550200  0.29318000  0.94973200  1
  O  O44  1  0.17022200  0.09265600  0.64754000  1
  O  O45  1  0.02456800  0.41168400  0.82522700  1
  O  O46  1  0.48577400  0.36255200  0.87420800  1
  O  O47  1  0.08757400  0.81247800  0.92447800  1
  O  O48  1  0.57317800  0.75726600  0.97400300  1
  O  O49  1  0.56987000  0.89165200  0.84752500  1
