# generated using pymatgen
data_Ti3ZnP3O13
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.40904400
_cell_length_b   7.71910500
_cell_length_c   10.54208996
_cell_angle_alpha   80.19263599
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3ZnP3O13
_chemical_formula_sum   'Ti6 Zn2 P6 O26'
_cell_volume   513.91738951
_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  0.64742500  0.20036500  1.0
  Ti  Ti1  1  0.75000000  0.35257500  0.79963500  1.0
  Ti  Ti2  1  0.25000000  0.21095400  0.44026500  1.0
  Ti  Ti3  1  0.50000000  0.00000000  0.00000000  1.0
  Ti  Ti4  1  0.75000000  0.78904600  0.55973500  1.0
  Ti  Ti5  1  0.00000000  0.00000000  0.00000000  1.0
  Zn  Zn6  1  0.75000000  0.38130000  0.15107600  1.0
  Zn  Zn7  1  0.25000000  0.61870000  0.84892400  1.0
  P  P8  1  0.25000000  0.78067000  0.48693300  1.0
  P  P9  1  0.75000000  0.21933000  0.51306700  1.0
  P  P10  1  0.25000000  0.26470500  0.76251200  1.0
  P  P11  1  0.75000000  0.73529500  0.23748800  1.0
  P  P12  1  0.75000000  0.68770300  0.88147400  1.0
  P  P13  1  0.25000000  0.31229700  0.11852600  1.0
  O  O14  1  0.75000000  0.64869800  0.74121700  1.0
  O  O15  1  0.55461900  0.25334900  0.42784500  1.0
  O  O16  1  0.25000000  0.21906900  0.62675500  1.0
  O  O17  1  0.54924700  0.78715100  0.90817600  1.0
  O  O18  1  0.75000000  0.33549000  0.61734400  1.0
  O  O19  1  0.75000000  0.13324000  0.90331000  1.0
  O  O20  1  0.25000000  0.66451000  0.38265600  1.0
  O  O21  1  0.04924700  0.21284900  0.09182400  1.0
  O  O22  1  0.25000000  0.97908700  0.41771800  1.0
  O  O23  1  0.75000000  0.02091300  0.58228200  1.0
  O  O24  1  0.06083800  0.37907600  0.78853000  1.0
  O  O25  1  0.25000000  0.86676000  0.09669000  1.0
  O  O26  1  0.56083800  0.62092400  0.21147000  1.0
  O  O27  1  0.75000000  0.49451400  0.95745100  1.0
  O  O28  1  0.75000000  0.78093100  0.37324500  1.0
  O  O29  1  0.45075300  0.21284900  0.09182400  1.0
  O  O30  1  0.94538100  0.25334900  0.42784500  1.0
  O  O31  1  0.44538100  0.74665100  0.57215500  1.0
  O  O32  1  0.43916200  0.37907600  0.78853000  1.0
  O  O33  1  0.25000000  0.35130200  0.25878300  1.0
  O  O34  1  0.75000000  0.90857800  0.13393100  1.0
  O  O35  1  0.25000000  0.09142200  0.86606900  1.0
  O  O36  1  0.93916200  0.62092400  0.21147000  1.0
  O  O37  1  0.95075300  0.78715100  0.90817600  1.0
  O  O38  1  0.05461900  0.74665100  0.57215500  1.0
  O  O39  1  0.25000000  0.50548600  0.04254900  1.0