# generated using pymatgen
data_Li3YBr6
_symmetry_space_group_name_H-M   P2
_cell_length_a   6.85800000
_cell_length_b   11.95600000
_cell_length_c   6.91800000
_cell_angle_alpha   90.00000000
_cell_angle_beta   109.83600000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   3
_chemical_formula_structural   Li3YBr6
_chemical_formula_sum   'Li6 Y2 Br12'
_cell_volume   533.58080601
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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  0.00000000  1
  Li  Li1  1  0.50000000  0.00000000  0.50000000  1
  Li  Li2  1  0.50000000  0.16300000  0.00000000  1
  Li  Li3  1  0.50000000  0.33700000  0.50000000  1
  Li  Li4  1  0.50000000  0.50000000  0.00000000  1
  Li  Li5  1  0.50000000  0.83700000  0.00000000  1
  Y  Y6  1  0.00000000  0.50000000  0.50000000  1
  Y  Y7  1  0.00000000  0.85700000  0.50000000  1
  Br  Br8  2  0.24220000  0.16910000  0.24910000  1
  Br  Br9  2  0.24220000  0.33090000  0.74910000  1
  Br  Br10  2  0.24220000  0.66910000  0.74910000  1
  Br  Br11  2  0.24220000  0.83090000  0.24910000  1
  Br  Br12  2  0.24840000  0.00000000  0.74680000  1
  Br  Br13  2  0.24840000  0.50000000  0.24680000  1
