# generated using pymatgen
data_VO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.95655199
_cell_length_b   4.95655199
_cell_length_c   9.90775700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   145.05557904
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VO2
_chemical_formula_sum   'V4 O8'
_cell_volume   139.41955934
_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
  V  V0  1  0.13545700  0.86454300  0.07576100  1.0
  V  V1  1  0.86454300  0.13545700  0.92423900  1.0
  V  V2  1  0.13545700  0.86454300  0.42423900  1.0
  V  V3  1  0.86454300  0.13545700  0.57576100  1.0
  O  O4  1  0.76406700  0.23593300  0.39874900  1.0
  O  O5  1  0.23593300  0.76406700  0.60125100  1.0
  O  O6  1  0.23593300  0.76406700  0.89874900  1.0
  O  O7  1  0.76406700  0.23593300  0.10125100  1.0
  O  O8  1  0.07577100  0.92422900  0.25000000  1.0
  O  O9  1  0.92422900  0.07577100  0.75000000  1.0
  O  O10  1  0.50000000  0.50000000  0.00000000  1.0
  O  O11  1  0.50000000  0.50000000  0.50000000  1.0