# generated using pymatgen
data_ZrBrO
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.88329081
_cell_length_b   9.88329081
_cell_length_c   9.88329005
_cell_angle_alpha   21.90133679
_cell_angle_beta   21.90133679
_cell_angle_gamma   21.90133758
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrBrO
_chemical_formula_sum   'Zr2 Br2 O2'
_cell_volume   117.74135159
_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  0.12359800  0.12359800  0.12359800  1.0
  Zr  Zr1  1  0.87640300  0.87640300  0.87640300  1.0
  Br  Br2  1  0.39087000  0.39087000  0.39087000  1.0
  Br  Br3  1  0.60913000  0.60913000  0.60913000  1.0
  O  O4  1  0.19946400  0.19946400  0.19946400  1.0
  O  O5  1  0.80053600  0.80053600  0.80053600  1.0