# generated using pymatgen
data_LiTiP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.20203000
_cell_length_b   5.27045300
_cell_length_c   14.39290166
_cell_angle_alpha   68.57011756
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTiP2O7
_chemical_formula_sum   'Li4 Ti4 P8 O28'
_cell_volume   579.16797433
_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  0.76352500  0.05724700  0.74408800  1
  Li  Li1  1  0.26352500  0.94275300  0.75591200  1
  Li  Li2  1  0.73647500  0.05724700  0.24408800  1
  Li  Li3  1  0.23647500  0.94275300  0.25591200  1
  Ti  Ti4  1  0.65070500  0.67373500  0.12423200  1
  Ti  Ti5  1  0.15070500  0.32626500  0.37576800  1
  Ti  Ti6  1  0.84929500  0.67373500  0.62423200  1
  Ti  Ti7  1  0.34929500  0.32626500  0.87576800  1
  P  P8  1  0.79605600  0.32798600  0.47790100  1
  P  P9  1  0.54217400  0.45729600  0.32200600  1
  P  P10  1  0.04217400  0.54270400  0.17799400  1
  P  P11  1  0.29605600  0.67201400  0.02209900  1
  P  P12  1  0.70394400  0.32798600  0.97790100  1
  P  P13  1  0.95782600  0.45729600  0.82200600  1
  P  P14  1  0.45782600  0.54270400  0.67799400  1
  P  P15  1  0.20394400  0.67201400  0.52209900  1
  O  O16  1  0.93649800  0.26268200  0.76689000  1
  O  O17  1  0.63572700  0.72061200  0.26244600  1
  O  O18  1  0.18097200  0.40547100  0.50637700  1
  O  O19  1  0.41421700  0.70802400  0.09977900  1
  O  O20  1  0.36345800  0.52234400  0.33659600  1
  O  O21  1  0.29497500  0.92516900  0.92425200  1
  O  O22  1  0.61372000  0.32974000  0.43359800  1
  O  O23  1  0.11372000  0.67026000  0.06640200  1
  O  O24  1  0.79497500  0.07483100  0.57574800  1
  O  O25  1  0.86345800  0.47765600  0.16340400  1
  O  O26  1  0.91421700  0.29197600  0.40022100  1
  O  O27  1  0.68097200  0.59452900  0.99362300  1
  O  O28  1  0.13572700  0.27938800  0.23755400  1
  O  O29  1  0.43649800  0.73731800  0.73311000  1
  O  O30  1  0.56350200  0.26268200  0.26689000  1
  O  O31  1  0.86427300  0.72061200  0.76244600  1
  O  O32  1  0.31902800  0.40547100  0.00637700  1
  O  O33  1  0.08578300  0.70802400  0.59977900  1
  O  O34  1  0.13654200  0.52234400  0.83659600  1
  O  O35  1  0.20502500  0.92516900  0.42425200  1
  O  O36  1  0.88628000  0.32974000  0.93359800  1
  O  O37  1  0.38628000  0.67026000  0.56640200  1
  O  O38  1  0.70502500  0.07483100  0.07574800  1
  O  O39  1  0.63654200  0.47765600  0.66340400  1
  O  O40  1  0.58578300  0.29197600  0.90022100  1
  O  O41  1  0.81902800  0.59452900  0.49362300  1
  O  O42  1  0.36427300  0.27938800  0.73755400  1
  O  O43  1  0.06350200  0.73731800  0.23311000  1
