# generated using pymatgen
data_Li2UBr6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.96711338
_cell_length_b   6.96711338
_cell_length_c   13.58085500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999412
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2UBr6
_chemical_formula_sum   'Li4 U2 Br12'
_cell_volume   570.90457876
_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
  Li  Li0  1  0.00000000  0.00000000  0.75000000  1
  Li  Li1  1  0.66666700  0.33333300  0.75000000  1
  Li  Li2  1  0.33333300  0.66666700  0.25000000  1
  Li  Li3  1  0.00000000  0.00000000  0.25000000  1
  U  U4  1  0.33333300  0.66666700  0.75000000  1
  U  U5  1  0.66666700  0.33333300  0.25000000  1
  Br  Br6  1  0.99766000  0.33041900  0.63401300  1
  Br  Br7  1  0.33276000  0.00234000  0.63401300  1
  Br  Br8  1  0.66958100  0.66724000  0.63401300  1
  Br  Br9  1  0.66958100  0.00234000  0.86598700  1
  Br  Br10  1  0.33276000  0.33041900  0.86598700  1
  Br  Br11  1  0.99766000  0.66724000  0.86598700  1
  Br  Br12  1  0.00234000  0.33276000  0.13401300  1
  Br  Br13  1  0.33041900  0.99766000  0.13401300  1
  Br  Br14  1  0.66724000  0.66958100  0.13401300  1
  Br  Br15  1  0.66724000  0.99766000  0.36598700  1
  Br  Br16  1  0.33041900  0.33276000  0.36598700  1
  Br  Br17  1  0.00234000  0.66958100  0.36598700  1
