# generated using pymatgen
data_LiEr2(ScSi2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.84027377
_cell_length_b   7.34165773
_cell_length_c   14.05730498
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiEr2(ScSi2)2
_chemical_formula_sum   'Li4 Er8 Sc8 Si16'
_cell_volume   705.94307907
_cell_formula_units_Z   4
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  0.15883198  0.50932487  0.75000000  1.0
  Li  Li1  1  0.84116802  0.49067513  0.25000000  1.0
  Li  Li2  1  0.34116802  0.00932487  0.25000000  1.0
  Li  Li3  1  0.65883198  0.99067513  0.75000000  1.0
  Er  Er4  1  0.01381661  0.18265666  0.09875248  1.0
  Er  Er5  1  0.98618339  0.81734334  0.90124752  1.0
  Er  Er6  1  0.48618339  0.68265666  0.90124752  1.0
  Er  Er7  1  0.98618339  0.81734334  0.59875248  1.0
  Er  Er8  1  0.51381661  0.31734334  0.09875248  1.0
  Er  Er9  1  0.01381661  0.18265666  0.40124752  1.0
  Er  Er10  1  0.51381661  0.31734334  0.40124752  1.0
  Er  Er11  1  0.48618339  0.68265666  0.59875248  1.0
  Sc  Sc12  1  0.32998222  0.17896419  0.62706982  1.0
  Sc  Sc13  1  0.67001778  0.82103581  0.37293018  1.0
  Sc  Sc14  1  0.17001778  0.67896419  0.37293018  1.0
  Sc  Sc15  1  0.67001778  0.82103581  0.12706982  1.0
  Sc  Sc16  1  0.82998222  0.32103581  0.62706982  1.0
  Sc  Sc17  1  0.32998222  0.17896419  0.87293018  1.0
  Sc  Sc18  1  0.82998222  0.32103581  0.87293018  1.0
  Sc  Sc19  1  0.17001778  0.67896419  0.12706982  1.0
  Si  Si20  1  0.02980824  0.09990632  0.75000000  1.0
  Si  Si21  1  0.97019176  0.90009368  0.25000000  1.0
  Si  Si22  1  0.47019176  0.59990632  0.25000000  1.0
  Si  Si23  1  0.52980824  0.40009368  0.75000000  1.0
  Si  Si24  1  0.28082675  0.87755308  0.75000000  1.0
  Si  Si25  1  0.71917325  0.12244692  0.25000000  1.0
  Si  Si26  1  0.21917325  0.37755308  0.25000000  1.0
  Si  Si27  1  0.78082675  0.62244692  0.75000000  1.0
  Si  Si28  1  0.15862969  0.46457609  0.53488643  1.0
  Si  Si29  1  0.84137031  0.53542391  0.46511357  1.0
  Si  Si30  1  0.34137031  0.96457609  0.46511357  1.0
  Si  Si31  1  0.84137031  0.53542391  0.03488643  1.0
  Si  Si32  1  0.65862969  0.03542391  0.53488643  1.0
  Si  Si33  1  0.15862969  0.46457609  0.96511357  1.0
  Si  Si34  1  0.65862969  0.03542391  0.96511357  1.0
  Si  Si35  1  0.34137031  0.96457609  0.03488643  1.0