# generated using pymatgen
data_LiTiPO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.74489600
_cell_length_b   6.15008600
_cell_length_c   10.59380800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTiPO4
_chemical_formula_sum   'Li4 Ti4 P4 O16'
_cell_volume   309.14340372
_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  0.00000000  0.00000000  0.00000000  1
  Li  Li1  1  0.50000000  0.00000000  0.50000000  1
  Li  Li2  1  0.00000000  0.50000000  0.00000000  1
  Li  Li3  1  0.50000000  0.50000000  0.50000000  1
  Ti  Ti4  1  0.02004300  0.75000000  0.27871000  1
  Ti  Ti5  1  0.47995700  0.75000000  0.77871000  1
  Ti  Ti6  1  0.97995700  0.25000000  0.72129000  1
  Ti  Ti7  1  0.52004300  0.25000000  0.22129000  1
  P  P8  1  0.57861200  0.75000000  0.09435100  1
  P  P9  1  0.92138800  0.75000000  0.59435100  1
  P  P10  1  0.42138800  0.25000000  0.90564900  1
  P  P11  1  0.07861200  0.25000000  0.40564900  1
  O  O12  1  0.74439800  0.25000000  0.90579300  1
  O  O13  1  0.21224100  0.45036100  0.33451700  1
  O  O14  1  0.71224100  0.54963900  0.16548300  1
  O  O15  1  0.78775900  0.95036100  0.66548300  1
  O  O16  1  0.28775900  0.04963900  0.83451700  1
  O  O17  1  0.78775900  0.54963900  0.66548300  1
  O  O18  1  0.28775900  0.45036100  0.83451700  1
  O  O19  1  0.21224100  0.04963900  0.33451700  1
  O  O20  1  0.25560200  0.75000000  0.09420700  1
  O  O21  1  0.75560200  0.25000000  0.40579300  1
  O  O22  1  0.71224100  0.95036100  0.16548300  1
  O  O23  1  0.24439800  0.75000000  0.59420700  1
  O  O24  1  0.70583600  0.75000000  0.95934700  1
  O  O25  1  0.29416400  0.25000000  0.04065300  1
  O  O26  1  0.20583600  0.25000000  0.54065300  1
  O  O27  1  0.79416400  0.75000000  0.45934700  1
