# generated using pymatgen
data_Rb(ScBr3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.08498277
_cell_length_b   8.08498182
_cell_length_c   12.97298966
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999566
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Rb(ScBr3)2
_chemical_formula_sum   'Rb2 Sc4 Br12'
_cell_volume   734.39357579
_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
  Rb  Rb0  1  0.33333300  0.66666700  0.87439523  1.0
  Rb  Rb1  1  0.66666700  0.33333300  0.37439523  1.0
  Sc  Sc2  1  0.00000000  0.00000000  0.12561752  1.0
  Sc  Sc3  1  0.00000000  0.00000000  0.37558684  1.0
  Sc  Sc4  1  0.00000000  0.00000000  0.62561752  1.0
  Sc  Sc5  1  0.00000000  0.00000000  0.87558684  1.0
  Br  Br6  1  0.99087099  0.72889580  0.00099590  1.0
  Br  Br7  1  0.26129270  0.98962387  0.25038057  1.0
  Br  Br8  1  0.01037613  0.27166783  0.25038057  1.0
  Br  Br9  1  0.27110420  0.26197519  0.00099590  1.0
  Br  Br10  1  0.26197519  0.27110420  0.50099590  1.0
  Br  Br11  1  0.73802481  0.00912901  0.00099590  1.0
  Br  Br12  1  0.27166783  0.01037613  0.75038057  1.0
  Br  Br13  1  0.72833217  0.73870730  0.25038057  1.0
  Br  Br14  1  0.73870730  0.72833217  0.75038057  1.0
  Br  Br15  1  0.00912901  0.73802481  0.50099590  1.0
  Br  Br16  1  0.72889580  0.99087099  0.50099590  1.0
  Br  Br17  1  0.98962387  0.26129270  0.75038057  1.0