# generated using pymatgen
data_LiNbO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.23145100
_cell_length_b   5.58154810
_cell_length_c   17.45918489
_cell_angle_alpha   87.64801976
_cell_angle_beta   98.60077596
_cell_angle_gamma   117.85785895
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNbO3
_chemical_formula_sum   'Li8 Nb8 O24'
_cell_volume   445.40877226
_cell_formula_units_Z   8
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  0.33618200  0.61605700  0.05830700  1
  Li  Li1  1  0.94211200  0.55886100  0.32441800  1
  Li  Li2  1  0.08220000  0.98319000  0.18074200  1
  Li  Li3  1  0.44151200  0.30889700  0.57235600  1
  Li  Li4  1  0.69013800  0.93480900  0.44784500  1
  Li  Li5  1  0.94117700  0.05900600  0.82304700  1
  Li  Li6  1  0.19009300  0.68406100  0.69763800  1
  Li  Li7  1  0.68722100  0.42575300  0.94798700  1
  Nb  Nb8  1  0.02131700  0.03083200  0.00382400  1
  Nb  Nb9  1  0.52145500  0.78342500  0.25494300  1
  Nb  Nb10  1  0.76113400  0.39719300  0.13157600  1
  Nb  Nb11  1  0.02320900  0.54288500  0.50344200  1
  Nb  Nb12  1  0.27434500  0.16844400  0.37798600  1
  Nb  Nb13  1  0.52208300  0.29177600  0.75304700  1
  Nb  Nb14  1  0.77343500  0.91784600  0.62836300  1
  Nb  Nb15  1  0.27119900  0.66477100  0.87758900  1
  O  O16  1  0.49683200  0.05873200  0.18622100  1
  O  O17  1  0.43434900  0.22414400  0.03052600  1
  O  O18  1  0.94343100  0.15804300  0.09357400  1
  O  O19  1  0.56967600  0.59865800  0.15616800  1
  O  O20  1  0.06237200  0.54073500  0.21846700  1
  O  O21  1  0.99231800  0.80277300  0.43435300  1
  O  O22  1  0.99096700  0.67782500  0.06069100  1
  O  O23  1  0.93727600  0.95347000  0.28138300  1
  O  O24  1  0.42607600  0.89421600  0.34397200  1
  O  O25  1  0.04864200  0.33007000  0.40578300  1
  O  O26  1  0.56227700  0.26596700  0.46856700  1
  O  O27  1  0.49212900  0.55293400  0.68423800  1
  O  O28  1  0.50097100  0.43667500  0.31142100  1
  O  O29  1  0.43719200  0.70571700  0.53096300  1
  O  O30  1  0.92264300  0.64161700  0.59369100  1
  O  O31  1  0.54836900  0.08075200  0.65555100  1
  O  O32  1  0.06189800  0.01615200  0.71849700  1
  O  O33  1  0.99330000  0.30255600  0.93596600  1
  O  O34  1  0.99521500  0.17739200  0.55912600  1
  O  O35  1  0.93706800  0.45241600  0.78064300  1
  O  O36  1  0.42139700  0.38892200  0.84340700  1
  O  O37  1  0.04734200  0.82924000  0.90523100  1
  O  O38  1  0.55659500  0.76176700  0.96792500  1
  O  O39  1  0.49445100  0.92602100  0.80912700  1
