# generated using pymatgen
data_LiTiP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.30787937
_cell_length_b   5.30787937
_cell_length_c   4.61095755
_cell_angle_alpha   81.41715783
_cell_angle_beta   81.41715783
_cell_angle_gamma   103.04177541
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTiP2O7
_chemical_formula_sum   'Li1 Ti1 P2 O7'
_cell_volume   122.86228177
_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  0.25279500  0.74720500  0.00000000  1
  Ti  Ti1  1  0.87433100  0.12566900  0.00000000  1
  P  P2  1  0.74572900  0.66750300  0.58972200  1
  P  P3  1  0.33249700  0.25427100  0.41027800  1
  O  O4  1  0.92649200  0.81722700  0.29272400  1
  O  O5  1  0.65346900  0.84032300  0.80180200  1
  O  O6  1  0.86813800  0.46342100  0.74325800  1
  O  O7  1  0.47267200  0.52732800  0.50000000  1
  O  O8  1  0.53657900  0.13186200  0.25674200  1
  O  O9  1  0.15967700  0.34653100  0.19819800  1
  O  O10  1  0.18277300  0.07350800  0.70727600  1
