# generated using pymatgen
data_Zr6O
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.65304782
_cell_length_b   5.65304818
_cell_length_c   10.34412532
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999206
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr6O
_chemical_formula_sum   'Zr12 O2'
_cell_volume   286.27919413
_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
  Zr  Zr0  1  0.66764866  0.66278206  0.37781259  1.0
  Zr  Zr1  1  0.33235134  0.99513340  0.87781259  1.0
  Zr  Zr2  1  0.66278206  0.99513340  0.62218741  1.0
  Zr  Zr3  1  0.66278206  0.66764866  0.87781259  1.0
  Zr  Zr4  1  0.33721794  0.33235134  0.12218741  1.0
  Zr  Zr5  1  0.99513340  0.33235134  0.37781259  1.0
  Zr  Zr6  1  0.33721794  0.00486660  0.37781259  1.0
  Zr  Zr7  1  0.66764866  0.00486660  0.12218741  1.0
  Zr  Zr8  1  0.00486660  0.33721794  0.87781259  1.0
  Zr  Zr9  1  0.33235134  0.33721794  0.62218741  1.0
  Zr  Zr10  1  0.00486660  0.66764866  0.62218741  1.0
  Zr  Zr11  1  0.99513340  0.66278206  0.12218741  1.0
  O  O12  1  0.66666700  0.33333300  0.25000000  1.0
  O  O13  1  0.33333300  0.66666700  0.75000000  1.0