# generated using pymatgen
data_Li6PBrO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.94023436
_cell_length_b   5.94023436
_cell_length_c   5.94023436
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6PBrO5
_chemical_formula_sum   'Li6 P1 Br1 O5'
_cell_volume   148.21622284
_cell_formula_units_Z   1
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
  Li  Li0  1  0.98190800  0.51809200  0.98190800  1
  Li  Li1  1  0.51809200  0.98190800  0.98190800  1
  Li  Li2  1  0.51809200  0.51809200  0.98190800  1
  Li  Li3  1  0.51809200  0.98190800  0.51809200  1
  Li  Li4  1  0.98190800  0.98190800  0.51809200  1
  Li  Li5  1  0.98190800  0.51809200  0.51809200  1
  P  P6  1  0.50000000  0.50000000  0.50000000  1
  Br  Br7  1  0.00000000  0.00000000  0.00000000  1
  O  O8  1  0.82230300  0.39256600  0.39256600  1
  O  O9  1  0.39256600  0.82230300  0.39256600  1
  O  O10  1  0.39256600  0.39256600  0.39256600  1
  O  O11  1  0.39256600  0.39256600  0.82230300  1
  O  O12  1  0.75000000  0.75000000  0.75000000  1
