# generated using pymatgen
data_VPO4F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.21507700
_cell_length_b   5.20901234
_cell_length_c   7.35416071
_cell_angle_alpha   108.74579488
_cell_angle_beta   107.54614632
_cell_angle_gamma   96.01710939
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VPO4F
_chemical_formula_sum   'V2 P2 O8 F2'
_cell_volume   175.82054670
_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
  V  V0  1  0.00000000  0.00000000  0.00000000  1.0
  V  V1  1  0.50000000  0.50000000  0.50000000  1.0
  P  P2  1  0.90631900  0.58971400  0.76158900  1.0
  P  P3  1  0.09368100  0.41028600  0.23841100  1.0
  O  O4  1  0.01914900  0.58210500  0.11663400  1.0
  O  O5  1  0.54895600  0.66643900  0.08742200  1.0
  O  O6  1  0.86185200  0.38573400  0.39943100  1.0
  O  O7  1  0.93230500  0.98192100  0.34718100  1.0
  O  O8  1  0.45104400  0.33356100  0.91257800  1.0
  O  O9  1  0.13814800  0.61426600  0.60056900  1.0
  O  O10  1  0.06769500  0.01807900  0.65281900  1.0
  O  O11  1  0.98085100  0.41789500  0.88336600  1.0
  F  F12  1  0.62241800  0.79099000  0.26454900  1.0
  F  F13  1  0.37758200  0.20901000  0.73545100  1.0