# generated using pymatgen
data_LiHo4Sc5Si8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.97278226
_cell_length_b   7.37401638
_cell_length_c   14.00252521
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.95062453
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiHo4Sc5Si8
_chemical_formula_sum   'Li2 Ho8 Sc10 Si16'
_cell_volume   719.97332057
_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  0.16229620  0.50914645  0.75000000  1.0
  Li  Li1  1  0.83770380  0.49085355  0.25000000  1.0
  Ho  Ho2  1  0.01075863  0.18451779  0.09814849  1.0
  Ho  Ho3  1  0.98924137  0.81548221  0.90185151  1.0
  Ho  Ho4  1  0.48512131  0.67447230  0.90293598  1.0
  Ho  Ho5  1  0.98924137  0.81548221  0.59814849  1.0
  Ho  Ho6  1  0.51487869  0.32552770  0.09706402  1.0
  Ho  Ho7  1  0.01075863  0.18451779  0.40185151  1.0
  Ho  Ho8  1  0.51487869  0.32552770  0.40293598  1.0
  Ho  Ho9  1  0.48512131  0.67447230  0.59706402  1.0
  Sc  Sc10  1  0.34142954  0.00418306  0.25000000  1.0
  Sc  Sc11  1  0.65857046  0.99581694  0.75000000  1.0
  Sc  Sc12  1  0.32460825  0.18228719  0.62583864  1.0
  Sc  Sc13  1  0.67539175  0.81771281  0.37416136  1.0
  Sc  Sc14  1  0.16389581  0.67561520  0.37301699  1.0
  Sc  Sc15  1  0.67539175  0.81771281  0.12583864  1.0
  Sc  Sc16  1  0.83610419  0.32438480  0.62698301  1.0
  Sc  Sc17  1  0.32460825  0.18228719  0.87416136  1.0
  Sc  Sc18  1  0.83610419  0.32438480  0.87301699  1.0
  Sc  Sc19  1  0.16389581  0.67561520  0.12698301  1.0
  Si  Si20  1  0.02951547  0.09873113  0.75000000  1.0
  Si  Si21  1  0.97048453  0.90126887  0.25000000  1.0
  Si  Si22  1  0.46424443  0.61347645  0.25000000  1.0
  Si  Si23  1  0.53575557  0.38652355  0.75000000  1.0
  Si  Si24  1  0.28642689  0.87843749  0.75000000  1.0
  Si  Si25  1  0.71357311  0.12156251  0.25000000  1.0
  Si  Si26  1  0.22402716  0.37210524  0.25000000  1.0
  Si  Si27  1  0.77597284  0.62789476  0.75000000  1.0
  Si  Si28  1  0.16025311  0.46271593  0.53310749  1.0
  Si  Si29  1  0.83974689  0.53728407  0.46689251  1.0
  Si  Si30  1  0.34384872  0.96745888  0.46117125  1.0
  Si  Si31  1  0.83974689  0.53728407  0.03310749  1.0
  Si  Si32  1  0.65615128  0.03254112  0.53882875  1.0
  Si  Si33  1  0.16025311  0.46271593  0.96689251  1.0
  Si  Si34  1  0.65615128  0.03254112  0.96117125  1.0
  Si  Si35  1  0.34384872  0.96745888  0.03882875  1.0