# generated using pymatgen
data_HfTiO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.77077700
_cell_length_b   5.68478575
_cell_length_c   10.17510644
_cell_angle_alpha   90.14598707
_cell_angle_beta   90.94091080
_cell_angle_gamma   90.05634046
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfTiO4
_chemical_formula_sum   'Hf4 Ti4 O16'
_cell_volume   275.91923550
_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
  Hf  Hf0  1  0.00173600  0.32768000  0.12088500  1.0
  Hf  Hf1  1  0.49914700  0.82093900  0.12183600  1.0
  Hf  Hf2  1  0.50135800  0.18190600  0.37938200  1.0
  Hf  Hf3  1  0.49871200  0.81755200  0.62838100  1.0
  Ti  Ti4  1  0.99981400  0.68100400  0.87199500  1.0
  Ti  Ti5  1  0.00222600  0.32711400  0.62807300  1.0
  Ti  Ti6  1  0.99654900  0.67247000  0.37791400  1.0
  Ti  Ti7  1  0.50202700  0.18709600  0.87129300  1.0
  O  O8  1  0.24550300  0.38676700  0.95443300  1.0
  O  O9  1  0.21693000  0.38959200  0.47008300  1.0
  O  O10  1  0.22484100  0.60870500  0.21854000  1.0
  O  O11  1  0.20725900  0.60975300  0.71419100  1.0
  O  O12  1  0.25822600  0.88411700  0.95237400  1.0
  O  O13  1  0.27270200  0.12175100  0.70946400  1.0
  O  O14  1  0.28099800  0.10666400  0.20849100  1.0
  O  O15  1  0.26649200  0.88159300  0.45660600  1.0
  O  O16  1  0.73158900  0.88291900  0.79691500  1.0
  O  O17  1  0.74271400  0.88552100  0.29465500  1.0
  O  O18  1  0.73654500  0.11462300  0.54936100  1.0
  O  O19  1  0.71034000  0.11384200  0.03292700  1.0
  O  O20  1  0.78799300  0.61391500  0.03103900  1.0
  O  O21  1  0.77810900  0.60727800  0.53541300  1.0
  O  O22  1  0.77381000  0.39689800  0.28828900  1.0
  O  O23  1  0.76437900  0.38030500  0.78745900  1.0