# generated using pymatgen
data_Li3InBr6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.93824575
_cell_length_b   6.93824575
_cell_length_c   12.71516000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999757
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3InBr6
_chemical_formula_sum   'Li6 In2 Br12'
_cell_volume   530.09270529
_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  0.66666700  0.33333400  0.96018700  1
  Li  Li1  1  0.66666700  0.33333400  0.53981300  1
  Li  Li2  1  0.00000000  0.00000000  0.25000000  1
  Li  Li3  1  0.00000000  0.00000000  0.75000000  1
  Li  Li4  1  0.33333300  0.66666600  0.03981300  1
  Li  Li5  1  0.33333300  0.66666600  0.46018700  1
  In  In6  1  0.66666700  0.33333400  0.25000000  1
  In  In7  1  0.33333300  0.66666600  0.75000000  1
  Br  Br8  1  0.65591100  0.68275700  0.87683000  1
  Br  Br9  1  0.02684600  0.34409000  0.87683000  1
  Br  Br10  1  0.31724400  0.97315500  0.87683000  1
  Br  Br11  1  0.34408900  0.02684500  0.37683000  1
  Br  Br12  1  0.68275600  0.65591000  0.37683000  1
  Br  Br13  1  0.34408900  0.31724300  0.12317000  1
  Br  Br14  1  0.68275600  0.02684500  0.12317000  1
  Br  Br15  1  0.97315400  0.65591000  0.12317000  1
  Br  Br16  1  0.65591100  0.97315500  0.62317000  1
  Br  Br17  1  0.02684600  0.68275700  0.62317000  1
  Br  Br18  1  0.97315400  0.31724300  0.37683000  1
  Br  Br19  1  0.31724400  0.34409000  0.62317000  1
