# generated using pymatgen
data_Li17Ti20O40
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.94905800
_cell_length_b   9.59547500
_cell_length_c   25.49598245
_cell_angle_alpha   79.77004451
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li17Ti20O40
_chemical_formula_sum   'Li17 Ti20 O40'
_cell_volume   710.00605232
_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  0.00000000  0.99982600  0.10177000  1
  Li  Li1  1  0.00000000  0.49958300  0.80279400  1
  Li  Li2  1  0.50000000  0.75050100  0.14960600  1
  Li  Li3  1  0.50000000  0.24781700  0.25033700  1
  Li  Li4  1  0.50000000  0.24550700  0.44888200  1
  Li  Li5  1  0.50000000  0.75116500  0.34923100  1
  Li  Li6  1  0.50000000  0.24883500  0.65076900  1
  Li  Li7  1  0.50000000  0.75449300  0.55111800  1
  Li  Li8  1  0.50000000  0.24949900  0.85039400  1
  Li  Li9  1  0.50000000  0.75218300  0.74966300  1
  Li  Li10  1  0.50000000  0.74733900  0.95111200  1
  Li  Li11  1  0.50000000  0.25266100  0.04888800  1
  Li  Li12  1  0.00000000  0.50041700  0.19720600  1
  Li  Li13  1  0.00000000  0.00000000  0.50000000  1
  Li  Li14  1  0.00000000  0.49796400  0.40024900  1
  Li  Li15  1  0.00000000  0.50203600  0.59975100  1
  Li  Li16  1  0.00000000  0.00017400  0.89823000  1
  Ti  Ti17  1  0.00000000  0.25036100  0.14966400  1
  Ti  Ti18  1  0.00000000  0.25407900  0.95081600  1
  Ti  Ti19  1  0.50000000  0.99358700  0.20585200  1
  Ti  Ti20  1  0.50000000  0.99850300  0.39523900  1
  Ti  Ti21  1  0.50000000  0.49983700  0.29906200  1
  Ti  Ti22  1  0.50000000  0.00149700  0.60476100  1
  Ti  Ti23  1  0.50000000  0.50000000  0.50000000  1
  Ti  Ti24  1  0.50000000  0.50016300  0.70093800  1
  Ti  Ti25  1  0.50000000  0.00641300  0.79414800  1
  Ti  Ti26  1  0.50000000  0.49453300  0.90635500  1
  Ti  Ti27  1  0.50000000  0.00000000  0.00000000  1
  Ti  Ti28  1  0.50000000  0.50546700  0.09364500  1
  Ti  Ti29  1  0.00000000  0.75241800  0.25021200  1
  Ti  Ti30  1  0.00000000  0.24364600  0.34900700  1
  Ti  Ti31  1  0.00000000  0.25634300  0.54859600  1
  Ti  Ti32  1  0.00000000  0.24758200  0.74978800  1
  Ti  Ti33  1  0.00000000  0.74365700  0.45140400  1
  Ti  Ti34  1  0.00000000  0.75635400  0.65099300  1
  Ti  Ti35  1  0.00000000  0.74963900  0.85033600  1
  Ti  Ti36  1  0.00000000  0.74592100  0.04918400  1
  O  O37  1  0.00000000  0.37602000  0.47458800  1
  O  O38  1  0.00000000  0.12125200  0.02414200  1
  O  O39  1  0.00000000  0.37922300  0.67659200  1
  O  O40  1  0.00000000  0.62398000  0.52541200  1
  O  O41  1  0.00000000  0.87818400  0.17694300  1
  O  O42  1  0.00000000  0.62372400  0.72460400  1
  O  O43  1  0.00000000  0.37091000  0.07836000  1
  O  O44  1  0.00000000  0.62909000  0.92164000  1
  O  O45  1  0.50000000  0.36179800  0.97564500  1
  O  O46  1  0.50000000  0.37478200  0.17064200  1
  O  O47  1  0.50000000  0.87542100  0.07300100  1
  O  O48  1  0.50000000  0.86159300  0.27474300  1
  O  O49  1  0.50000000  0.37179700  0.37183600  1
  O  O50  1  0.50000000  0.37587400  0.77399400  1
  O  O51  1  0.50000000  0.13346200  0.32563500  1
  O  O52  1  0.50000000  0.87447200  0.47219600  1
  O  O53  1  0.50000000  0.37348000  0.57453000  1
  O  O54  1  0.50000000  0.12552800  0.52780400  1
  O  O55  1  0.50000000  0.86653800  0.67436500  1
  O  O56  1  0.50000000  0.62652000  0.42547000  1
  O  O57  1  0.50000000  0.13840700  0.72525700  1
  O  O58  1  0.50000000  0.87453800  0.87148100  1
  O  O59  1  0.50000000  0.62820300  0.62816400  1
  O  O60  1  0.50000000  0.62521800  0.82935800  1
  O  O61  1  0.50000000  0.12457900  0.92699900  1
  O  O62  1  0.50000000  0.63820200  0.02435500  1
  O  O63  1  0.50000000  0.12546200  0.12851900  1
  O  O64  1  0.50000000  0.62412600  0.22600600  1
  O  O65  1  0.00000000  0.86875200  0.37888800  1
  O  O66  1  0.00000000  0.62235600  0.12249900  1
  O  O67  1  0.00000000  0.37627600  0.27539600  1
  O  O68  1  0.00000000  0.87996200  0.57795700  1
  O  O69  1  0.00000000  0.62077700  0.32340800  1
  O  O70  1  0.00000000  0.87096600  0.77899600  1
  O  O71  1  0.00000000  0.87874800  0.97585800  1
  O  O72  1  0.00000000  0.12903400  0.22100400  1
  O  O73  1  0.00000000  0.12003800  0.42204300  1
  O  O74  1  0.00000000  0.37764400  0.87750100  1
  O  O75  1  0.00000000  0.13124800  0.62111200  1
  O  O76  1  0.00000000  0.12181600  0.82305700  1
