# generated using pymatgen
data_Zr3O
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.64998866
_cell_length_b   5.64998406
_cell_length_c   5.19391355
_cell_angle_alpha   90.00004561
_cell_angle_beta   89.99997208
_cell_angle_gamma   120.00001137
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3O
_chemical_formula_sum   'Zr6 O2'
_cell_volume   143.58864502
_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  0.99999925  0.66056433  0.49999993  1.0
  Zr  Zr1  1  0.99999776  0.33943348  0.00000108  1.0
  Zr  Zr2  1  0.66056574  0.66056762  0.99999830  1.0
  Zr  Zr3  1  0.66056811  0.00000216  0.49999948  1.0
  Zr  Zr4  1  0.33943199  0.33943442  0.50000043  1.0
  Zr  Zr5  1  0.33943668  0.00000013  0.00000076  1.0
  O  O6  1  0.66666821  0.33333305  0.74999009  1.0
  O  O7  1  0.33333227  0.66666681  0.25000992  1.0