# generated using pymatgen
data_Ti2ZnO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.98517920
_cell_length_b   5.98517920
_cell_length_c   15.09739300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999113
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2ZnO4
_chemical_formula_sum   'Ti12 Zn6 O24'
_cell_volume   468.36770997
_cell_formula_units_Z   6
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  0.34988400  0.17494200  0.16530700  1.0
  Ti  Ti1  1  0.82505800  0.65011600  0.16530700  1.0
  Ti  Ti2  1  0.01396200  0.50698100  0.50066800  1.0
  Ti  Ti3  1  0.82505800  0.17494200  0.16530700  1.0
  Ti  Ti4  1  0.49301900  0.98603800  0.50066800  1.0
  Ti  Ti5  1  0.33333300  0.66666700  0.67717300  1.0
  Ti  Ti6  1  0.33333300  0.66666700  0.28948600  1.0
  Ti  Ti7  1  0.64159100  0.82079500  0.82873600  1.0
  Ti  Ti8  1  0.49301900  0.50698100  0.50066800  1.0
  Ti  Ti9  1  0.17920500  0.35840900  0.82873600  1.0
  Ti  Ti10  1  0.17920500  0.82079500  0.82873600  1.0
  Ti  Ti11  1  0.66666700  0.33333300  0.94894600  1.0
  Zn  Zn12  1  0.33333300  0.66666700  0.04502700  1.0
  Zn  Zn13  1  0.00000000  0.00000000  0.37282400  1.0
  Zn  Zn14  1  0.66666700  0.33333300  0.33979500  1.0
  Zn  Zn15  1  0.66666700  0.33333300  0.69549900  1.0
  Zn  Zn16  1  0.00000000  0.00000000  0.00184400  1.0
  Zn  Zn17  1  0.00000000  0.00000000  0.63070300  1.0
  O  O18  1  0.68763300  0.84381600  0.09285000  1.0
  O  O19  1  0.00000000  0.00000000  0.24046100  1.0
  O  O20  1  0.15618400  0.31236700  0.09285000  1.0
  O  O21  1  0.15618400  0.84381600  0.09285000  1.0
  O  O22  1  0.35215100  0.17607600  0.42713300  1.0
  O  O23  1  0.50482100  0.49517900  0.24896500  1.0
  O  O24  1  0.66666700  0.33333300  0.56827600  1.0
  O  O25  1  0.50482100  0.00964200  0.24896500  1.0
  O  O26  1  0.66666700  0.33333300  0.07299100  1.0
  O  O27  1  0.82392400  0.64784900  0.42713300  1.0
  O  O28  1  0.82392400  0.17607600  0.42713300  1.0
  O  O29  1  0.99035800  0.49517900  0.24896500  1.0
  O  O30  1  0.00679100  0.50339500  0.74993600  1.0
  O  O31  1  0.18083300  0.81916700  0.58408800  1.0
  O  O32  1  0.18083300  0.36166600  0.58408800  1.0
  O  O33  1  0.33333300  0.66666700  0.91381100  1.0
  O  O34  1  0.33333300  0.66666700  0.41484900  1.0
  O  O35  1  0.49660500  0.99320900  0.74993600  1.0
  O  O36  1  0.49660500  0.50339500  0.74993600  1.0
  O  O37  1  0.63833400  0.81916700  0.58408800  1.0
  O  O38  1  0.83962200  0.16037800  0.91060300  1.0
  O  O39  1  0.83962200  0.67924400  0.91060300  1.0
  O  O40  1  0.00000000  0.00000000  0.76325300  1.0
  O  O41  1  0.32075600  0.16037800  0.91060300  1.0