# generated using pymatgen
data_Zr2HBr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.37559352
_cell_length_b   10.37559352
_cell_length_c   5.97616690
_cell_angle_alpha   80.12873852
_cell_angle_beta   80.12873852
_cell_angle_gamma   19.60809688
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2HBr2
_chemical_formula_sum   'Zr4 H2 Br4'
_cell_volume   212.60659207
_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  0.18678900  0.18678900  0.04896000  1.0
  Zr  Zr1  1  0.81321100  0.81321100  0.95104000  1.0
  Zr  Zr2  1  0.31560500  0.31560500  0.45031700  1.0
  Zr  Zr3  1  0.68439500  0.68439500  0.54968300  1.0
  H  H4  1  0.21810700  0.21810700  0.38224000  1.0
  H  H5  1  0.78189300  0.78189300  0.61776000  1.0
  Br  Br6  1  0.09280500  0.09280500  0.77305100  1.0
  Br  Br7  1  0.90719500  0.90719500  0.22694900  1.0
  Br  Br8  1  0.40937900  0.40937900  0.72581500  1.0
  Br  Br9  1  0.59062100  0.59062100  0.27418500  1.0