# generated using pymatgen
data_Li6Ti2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.98256000
_cell_length_b   5.10469000
_cell_length_c   15.68959577
_cell_angle_alpha   89.63879848
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Ti2O7
_chemical_formula_sum   'Li24 Ti8 O28'
_cell_volume   719.40362932
_cell_formula_units_Z   4
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  0.52672600  0.25329700  0.04807700  1
  Li  Li1  1  0.57411800  0.24148000  0.79846800  1
  Li  Li2  1  0.75104600  0.26217100  0.94668300  1
  Li  Li3  1  0.80219100  0.22761800  0.67675700  1
  Li  Li4  1  0.56567300  0.17144400  0.57444400  1
  Li  Li5  1  0.57754300  0.14320100  0.32068600  1
  Li  Li6  1  0.73324400  0.18827600  0.43925000  1
  Li  Li7  1  0.26724200  0.16731500  0.91598200  1
  Li  Li8  1  0.00981200  0.25226200  0.32067100  1
  Li  Li9  1  0.77031900  0.18859900  0.19357300  1
  Li  Li10  1  0.01438700  0.23589500  0.84350300  1
  Li  Li11  1  0.31848200  0.19275700  0.42380400  1
  Li  Li12  1  0.81848200  0.80724300  0.57619600  1
  Li  Li13  1  0.51438700  0.76410500  0.15649700  1
  Li  Li14  1  0.27031900  0.81140100  0.80642700  1
  Li  Li15  1  0.50981200  0.74773800  0.67932900  1
  Li  Li16  1  0.76724200  0.83268500  0.08401800  1
  Li  Li17  1  0.23324400  0.81172400  0.56075000  1
  Li  Li18  1  0.07754300  0.85679900  0.67931400  1
  Li  Li19  1  0.06567300  0.82855600  0.42555600  1
  Li  Li20  1  0.30219100  0.77238200  0.32324300  1
  Li  Li21  1  0.25104600  0.73782900  0.05331700  1
  Li  Li22  1  0.07411800  0.75852000  0.20153200  1
  Li  Li23  1  0.02672600  0.74670300  0.95192300  1
  Ti  Ti24  1  0.28574600  0.29456200  0.69691900  1
  Ti  Ti25  1  0.02253600  0.31568900  0.53432700  1
  Ti  Ti26  1  0.01529900  0.25960500  0.06090000  1
  Ti  Ti27  1  0.28884200  0.27998500  0.19959300  1
  Ti  Ti28  1  0.78884200  0.72001500  0.80040700  1
  Ti  Ti29  1  0.51529900  0.74039500  0.93910000  1
  Ti  Ti30  1  0.52253600  0.68431100  0.46567300  1
  Ti  Ti31  1  0.78574600  0.70543800  0.30308100  1
  O  O32  1  0.39941300  0.05327500  0.26393000  1
  O  O33  1  0.06496400  0.12334900  0.95895500  1
  O  O34  1  0.21159900  0.17962200  0.79719700  1
  O  O35  1  0.83145300  0.19836500  0.55196600  1
  O  O36  1  0.46873300  0.15761800  0.68703800  1
  O  O37  1  0.16010900  0.15692900  0.61100500  1
  O  O38  1  0.13716000  0.08530300  0.14422400  1
  O  O39  1  0.81570600  0.20940400  0.07355700  1
  O  O40  1  0.09462300  0.21843400  0.43291100  1
  O  O41  1  0.54590100  0.39060500  0.93136900  1
  O  O42  1  0.52300700  0.32746300  0.45626900  1
  O  O43  1  0.78228000  0.34427800  0.30741900  1
  O  O44  1  0.39679200  0.46209300  0.12069900  1
  O  O45  1  0.19532200  0.50385000  0.26844800  1
  O  O46  1  0.69532200  0.49615000  0.73155200  1
  O  O47  1  0.89679200  0.53790700  0.87930100  1
  O  O48  1  0.28228000  0.65572200  0.69258100  1
  O  O49  1  0.02300700  0.67253700  0.54373100  1
  O  O50  1  0.04590100  0.60939500  0.06863100  1
  O  O51  1  0.59462300  0.78156600  0.56708900  1
  O  O52  1  0.31570600  0.79059600  0.92644300  1
  O  O53  1  0.63716000  0.91469700  0.85577600  1
  O  O54  1  0.66010900  0.84307100  0.38899500  1
  O  O55  1  0.96873300  0.84238200  0.31296200  1
  O  O56  1  0.33145300  0.80163500  0.44803400  1
  O  O57  1  0.71159900  0.82037800  0.20280300  1
  O  O58  1  0.56496400  0.87665100  0.04104500  1
  O  O59  1  0.89941300  0.94672500  0.73607000  1
