# generated using pymatgen
data_Ti3NbO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.89731984
_cell_length_b   9.89731984
_cell_length_c   4.71814766
_cell_angle_alpha   89.57389377
_cell_angle_beta   89.57389377
_cell_angle_gamma   35.27393771
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3NbO8
_chemical_formula_sum   'Ti6 Nb2 O16'
_cell_volume   266.89179344
_cell_formula_units_Z   2
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
  Ti  Ti0  1  0.37146800  0.37146800  0.50465700  1.0
  Ti  Ti1  1  0.62853200  0.62853200  0.49534300  1.0
  Ti  Ti2  1  0.50000000  0.00000000  0.00000000  1.0
  Ti  Ti3  1  0.26217400  0.73782600  0.00000000  1.0
  Ti  Ti4  1  0.00000000  0.50000000  0.00000000  1.0
  Ti  Ti5  1  0.73782600  0.26217400  0.00000000  1.0
  Nb  Nb6  1  0.12204700  0.12204700  0.50385200  1.0
  Nb  Nb7  1  0.87795300  0.87795300  0.49614800  1.0
  O  O8  1  0.95008200  0.95008200  0.19446600  1.0
  O  O9  1  0.44951900  0.44951900  0.19574800  1.0
  O  O10  1  0.19933500  0.19933500  0.19213400  1.0
  O  O11  1  0.69969400  0.69969400  0.19750200  1.0
  O  O12  1  0.08021900  0.56611800  0.30302900  1.0
  O  O13  1  0.82218000  0.32468500  0.30359500  1.0
  O  O14  1  0.56611800  0.08021900  0.30302900  1.0
  O  O15  1  0.32468500  0.82218000  0.30359500  1.0
  O  O16  1  0.17782000  0.67531500  0.69640500  1.0
  O  O17  1  0.43388200  0.91978100  0.69697100  1.0
  O  O18  1  0.91978100  0.43388200  0.69697100  1.0
  O  O19  1  0.67531500  0.17782000  0.69640500  1.0
  O  O20  1  0.04991800  0.04991800  0.80553400  1.0
  O  O21  1  0.55048100  0.55048100  0.80425200  1.0
  O  O22  1  0.30030600  0.30030600  0.80249800  1.0
  O  O23  1  0.80066500  0.80066500  0.80786600  1.0