# generated using pymatgen
data_LiNb(TeO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.67605300
_cell_length_b   4.96850700
_cell_length_c   5.23559359
_cell_angle_alpha   89.64483700
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNb(TeO4)3
_chemical_formula_sum   'Li1 Nb1 Te3 O12'
_cell_volume   225.68655414
_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  0.72384500  0.00000000  0.00000000  1
  Nb  Nb1  1  0.10975000  0.00000000  0.00000000  1
  Te  Te2  1  0.41681300  0.50000000  0.00000000  1
  Te  Te3  1  0.91956200  0.00000000  0.50000000  1
  Te  Te4  1  0.60587300  0.50000000  0.50000000  1
  O  O5  1  0.26247100  0.25779400  0.12207700  1
  O  O6  1  0.58195500  0.28476200  0.18290700  1
  O  O7  1  0.91857600  0.19512500  0.18471200  1
  O  O8  1  0.44289000  0.70841900  0.31392800  1
  O  O9  1  0.07286900  0.78821100  0.31902500  1
  O  O10  1  0.75140700  0.75748800  0.35656200  1
  O  O11  1  0.75140700  0.24251200  0.64343800  1
  O  O12  1  0.07286900  0.21178900  0.68097500  1
  O  O13  1  0.44289000  0.29158100  0.68607200  1
  O  O14  1  0.91857600  0.80487500  0.81528800  1
  O  O15  1  0.58195500  0.71523800  0.81709300  1
  O  O16  1  0.26247100  0.74220600  0.87792300  1
