# generated using pymatgen
data_VO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.52338304
_cell_length_b   5.52338304
_cell_length_c   5.52338304
_cell_angle_alpha   137.99529888
_cell_angle_beta   118.71908614
_cell_angle_gamma   77.07910502
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VO3
_chemical_formula_sum   'V2 O6'
_cell_volume   96.30038207
_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  0.75000000  0.91822100  0.16822100  1.0
  V  V1  1  0.25000000  0.08177900  0.83177900  1.0
  O  O2  1  0.75000000  0.49671000  0.74671000  1.0
  O  O3  1  0.25000000  0.50329000  0.25329000  1.0
  O  O4  1  0.85714800  0.85714800  0.50000000  1.0
  O  O5  1  0.14285200  0.14285200  0.50000000  1.0
  O  O6  1  0.64285200  0.14285200  0.00000000  1.0
  O  O7  1  0.35714800  0.85714800  0.00000000  1.0