# generated using pymatgen
data_Ti3P3O13
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.37787200
_cell_length_b   7.68142600
_cell_length_c   10.46725810
_cell_angle_alpha   81.52041802
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3P3O13
_chemical_formula_sum   'Ti6 P6 O26'
_cell_volume   507.19731110
_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
  Ti  Ti0  1  0.25000000  0.64652300  0.18964900  1.0
  Ti  Ti1  1  0.75000000  0.35347700  0.81035100  1.0
  Ti  Ti2  1  0.25000000  0.20923200  0.44152200  1.0
  Ti  Ti3  1  0.50000000  0.00000000  0.00000000  1.0
  Ti  Ti4  1  0.75000000  0.79076800  0.55847800  1.0
  Ti  Ti5  1  0.00000000  0.00000000  0.00000000  1.0
  P  P6  1  0.25000000  0.77936900  0.48054600  1.0
  P  P7  1  0.75000000  0.22063100  0.51945400  1.0
  P  P8  1  0.25000000  0.25597700  0.76519200  1.0
  P  P9  1  0.75000000  0.74402300  0.23480800  1.0
  P  P10  1  0.75000000  0.69599800  0.87952600  1.0
  P  P11  1  0.25000000  0.30400200  0.12047400  1.0
  O  O12  1  0.75000000  0.66758800  0.73417700  1.0
  O  O13  1  0.55156700  0.25061300  0.43550000  1.0
  O  O14  1  0.25000000  0.20449700  0.62710000  1.0
  O  O15  1  0.55288200  0.79653000  0.91212500  1.0
  O  O16  1  0.75000000  0.34187400  0.62240500  1.0
  O  O17  1  0.75000000  0.13146100  0.90160200  1.0
  O  O18  1  0.25000000  0.65812600  0.37759500  1.0
  O  O19  1  0.05288200  0.20347000  0.08787500  1.0
  O  O20  1  0.25000000  0.97841600  0.41352200  1.0
  O  O21  1  0.75000000  0.02158400  0.58647800  1.0
  O  O22  1  0.05381300  0.36164800  0.78837800  1.0
  O  O23  1  0.25000000  0.86853900  0.09839800  1.0
  O  O24  1  0.55381300  0.63835200  0.21162200  1.0
  O  O25  1  0.75000000  0.50122400  0.94596100  1.0
  O  O26  1  0.75000000  0.79550300  0.37290000  1.0
  O  O27  1  0.44711800  0.20347000  0.08787500  1.0
  O  O28  1  0.94843300  0.25061300  0.43550000  1.0
  O  O29  1  0.44843300  0.74938700  0.56450000  1.0
  O  O30  1  0.44618700  0.36164800  0.78837800  1.0
  O  O31  1  0.25000000  0.33241200  0.26582300  1.0
  O  O32  1  0.75000000  0.91706200  0.13101500  1.0
  O  O33  1  0.25000000  0.08293800  0.86898500  1.0
  O  O34  1  0.94618700  0.63835200  0.21162200  1.0
  O  O35  1  0.94711800  0.79653000  0.91212500  1.0
  O  O36  1  0.05156700  0.74938700  0.56450000  1.0
  O  O37  1  0.25000000  0.49877600  0.05403900  1.0