# generated using pymatgen
data_Sc20(SiBi3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.61665250
_cell_length_b   8.79427753
_cell_length_c   11.28051845
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.22455175
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc20(SiBi3)3
_chemical_formula_sum   'Sc20 Si3 Bi9'
_cell_volume   755.59666779
_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
  Sc  Sc0  1  0.19124158  0.04323632  0.93522302  1.0
  Sc  Sc1  1  0.32339769  0.05752281  0.44216619  1.0
  Sc  Sc2  1  0.32339769  0.44247719  0.44216619  1.0
  Sc  Sc3  1  0.33301194  0.75000000  0.71285411  1.0
  Sc  Sc4  1  0.45949312  0.75000000  0.00230578  1.0
  Sc  Sc5  1  0.15710827  0.25000000  0.21939854  1.0
  Sc  Sc6  1  0.81665749  0.92721816  0.06255684  1.0
  Sc  Sc7  1  0.64061558  0.75000000  0.29502870  1.0
  Sc  Sc8  1  0.03942378  0.75000000  0.50255852  1.0
  Sc  Sc9  1  0.68039905  0.94190462  0.55992232  1.0
  Sc  Sc10  1  0.19124158  0.45676368  0.93522302  1.0
  Sc  Sc11  1  0.35687904  0.25000000  0.70755530  1.0
  Sc  Sc12  1  0.16632759  0.75000000  0.21549805  1.0
  Sc  Sc13  1  0.96475853  0.25000000  0.49724497  1.0
  Sc  Sc14  1  0.68039905  0.55809538  0.55992232  1.0
  Sc  Sc15  1  0.66050747  0.25000000  0.29260835  1.0
  Sc  Sc16  1  0.81665749  0.57278184  0.06255684  1.0
  Sc  Sc17  1  0.52083213  0.25000000  0.99344690  1.0
  Sc  Sc18  1  0.81252517  0.25000000  0.76094280  1.0
  Sc  Sc19  1  0.86022497  0.75000000  0.79302901  1.0
  Si  Si20  1  0.40690675  0.75000000  0.47608825  1.0
  Si  Si21  1  0.09058848  0.75000000  0.97797359  1.0
  Si  Si22  1  0.59852127  0.25000000  0.53074728  1.0
  Bi  Bi23  1  0.06760163  0.49022754  0.67456845  1.0
  Bi  Bi24  1  0.56730689  0.51253626  0.82500451  1.0
  Bi  Bi25  1  0.93302725  0.99022158  0.32608314  1.0
  Bi  Bi26  1  0.43304056  0.00935985  0.17484496  1.0
  Bi  Bi27  1  0.56730689  0.98746374  0.82500451  1.0
  Bi  Bi28  1  0.43304056  0.49064015  0.17484496  1.0
  Bi  Bi29  1  0.06760163  0.00977246  0.67456845  1.0
  Bi  Bi30  1  0.93302725  0.50977842  0.32608314  1.0
  Bi  Bi31  1  0.90692865  0.25000000  0.02198101  1.0