# generated using pymatgen
data_Sc20Si12C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.85616391
_cell_length_b   7.90281810
_cell_length_c   13.68236124
_cell_angle_alpha   90.00000724
_cell_angle_beta   89.99999999
_cell_angle_gamma   89.97402140
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc20Si12C
_chemical_formula_sum   'Sc20 Si12 C1'
_cell_volume   633.22232435
_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  0.50000032  0.99999762  0.33522754  1.0
  Sc  Sc1  1  0.50000013  0.50000238  0.82994274  1.0
  Sc  Sc2  1  0.50000013  0.50000238  0.17005726  1.0
  Sc  Sc3  1  0.50000032  0.99999762  0.66477246  1.0
  Sc  Sc4  1  0.99999969  0.49999831  0.16401706  1.0
  Sc  Sc5  1  0.00000058  0.00000302  0.66823464  1.0
  Sc  Sc6  1  0.00000058  0.00000302  0.33176536  1.0
  Sc  Sc7  1  0.99999969  0.49999831  0.83598294  1.0
  Sc  Sc8  1  0.72726257  0.23426553  0.00000000  1.0
  Sc  Sc9  1  0.75154062  0.74184443  0.50000000  1.0
  Sc  Sc10  1  0.75178873  0.37988839  0.37957372  1.0
  Sc  Sc11  1  0.72794069  0.88212844  0.88259603  1.0
  Sc  Sc12  1  0.72794069  0.88212844  0.11740397  1.0
  Sc  Sc13  1  0.75178873  0.37988839  0.62042628  1.0
  Sc  Sc14  1  0.27273544  0.76573447  1.00000000  1.0
  Sc  Sc15  1  0.24846166  0.25815357  0.50000000  1.0
  Sc  Sc16  1  0.27205847  0.11787193  0.11740380  1.0
  Sc  Sc17  1  0.24821020  0.62011084  0.62042646  1.0
  Sc  Sc18  1  0.24821020  0.62011084  0.37957354  1.0
  Sc  Sc19  1  0.27205847  0.11787193  0.88259620  1.0
  Si  Si20  1  0.73950238  0.59999207  0.00000000  1.0
  Si  Si21  1  0.75393003  0.10531334  0.50000000  1.0
  Si  Si22  1  0.74698935  0.19944278  0.19982198  1.0
  Si  Si23  1  0.75297380  0.69772334  0.69722663  1.0
  Si  Si24  1  0.75297380  0.69772334  0.30277337  1.0
  Si  Si25  1  0.74698935  0.19944278  0.80017802  1.0
  Si  Si26  1  0.26049658  0.40000835  0.00000000  1.0
  Si  Si27  1  0.24606806  0.89468496  0.50000000  1.0
  Si  Si28  1  0.24703616  0.30227729  0.30277294  1.0
  Si  Si29  1  0.25300563  0.80055782  0.80017812  1.0
  Si  Si30  1  0.25300563  0.80055782  0.19982188  1.0
  Si  Si31  1  0.24703616  0.30227729  0.69722706  1.0
  C  C32  1  0.49999918  0.99999994  0.00000000  1.0