# generated using pymatgen
data_LiTi3P3O13
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.38797900
_cell_length_b   7.65376100
_cell_length_c   10.51423691
_cell_angle_alpha   80.63180220
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTi3P3O13
_chemical_formula_sum   'Li2 Ti6 P6 O26'
_cell_volume   507.20652199
_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
  Li  Li0  1  0.75000000  0.39652000  0.13768700  1
  Li  Li1  1  0.25000000  0.60348000  0.86231300  1
  Ti  Ti2  1  0.25000000  0.64152400  0.19550600  1
  Ti  Ti3  1  0.75000000  0.35847600  0.80449400  1
  Ti  Ti4  1  0.25000000  0.21382400  0.44340700  1
  Ti  Ti5  1  0.50000000  0.00000000  0.00000000  1
  Ti  Ti6  1  0.75000000  0.78617600  0.55659300  1
  Ti  Ti7  1  0.00000000  0.00000000  0.00000000  1
  P  P8  1  0.25000000  0.77889300  0.48372700  1
  P  P9  1  0.75000000  0.22110700  0.51627300  1
  P  P10  1  0.25000000  0.26965000  0.76630700  1
  P  P11  1  0.75000000  0.73035000  0.23369300  1
  P  P12  1  0.75000000  0.69297600  0.87882100  1
  P  P13  1  0.25000000  0.30702400  0.12117900  1
  O  O14  1  0.75000000  0.65181800  0.73763400  1
  O  O15  1  0.55410100  0.25901100  0.43187100  1
  O  O16  1  0.25000000  0.22186600  0.62998800  1
  O  O17  1  0.54805600  0.79236600  0.90421400  1
  O  O18  1  0.75000000  0.33370300  0.62396700  1
  O  O19  1  0.75000000  0.13699200  0.90254700  1
  O  O20  1  0.25000000  0.66629700  0.37603300  1
  O  O21  1  0.04805600  0.20763400  0.09578600  1
  O  O22  1  0.25000000  0.98047700  0.41982000  1
  O  O23  1  0.75000000  0.01952300  0.58018000  1
  O  O24  1  0.06034100  0.38334700  0.79289800  1
  O  O25  1  0.25000000  0.86300800  0.09745300  1
  O  O26  1  0.56034100  0.61665300  0.20710200  1
  O  O27  1  0.75000000  0.50065200  0.95522400  1
  O  O28  1  0.75000000  0.77813400  0.37001200  1
  O  O29  1  0.45194400  0.20763400  0.09578600  1
  O  O30  1  0.94589900  0.25901100  0.43187100  1
  O  O31  1  0.44589900  0.74098900  0.56812900  1
  O  O32  1  0.43965900  0.38334700  0.79289800  1
  O  O33  1  0.25000000  0.34818200  0.26236600  1
  O  O34  1  0.75000000  0.90579000  0.13128000  1
  O  O35  1  0.25000000  0.09421000  0.86872000  1
  O  O36  1  0.93965900  0.61665300  0.20710200  1
  O  O37  1  0.95194400  0.79236600  0.90421400  1
  O  O38  1  0.05410100  0.74098900  0.56812900  1
  O  O39  1  0.25000000  0.49934800  0.04477600  1
