# generated using pymatgen
data_Lu4Ti5ReSi8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.89279327
_cell_length_b   6.90134624
_cell_length_c   12.68377783
_cell_angle_alpha   90.06727106
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Lu4Ti5ReSi8
_chemical_formula_sum   'Lu8 Ti10 Re2 Si16'
_cell_volume   603.36122522
_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
  Lu  Lu0  1  0.00014027  0.65876371  0.03041978  1.0
  Lu  Lu1  1  0.99994626  0.34018142  0.53461673  1.0
  Lu  Lu2  1  0.33945159  0.00249594  0.46857103  1.0
  Lu  Lu3  1  0.15908507  0.49734911  0.78321133  1.0
  Lu  Lu4  1  0.83945159  0.49750406  0.28142897  1.0
  Lu  Lu5  1  0.49994626  0.15981858  0.21538327  1.0
  Lu  Lu6  1  0.50014027  0.84123629  0.71958022  1.0
  Lu  Lu7  1  0.65908507  0.00265089  0.96678867  1.0
  Ti  Ti8  1  0.67260365  0.67255005  0.50188970  1.0
  Ti  Ti9  1  0.17260365  0.82744995  0.24811030  1.0
  Ti  Ti10  1  0.99247761  0.84656020  0.62605659  1.0
  Ti  Ti11  1  0.00467148  0.15165137  0.12234157  1.0
  Ti  Ti12  1  0.85071760  0.99412178  0.37740613  1.0
  Ti  Ti13  1  0.35071760  0.50587822  0.37259387  1.0
  Ti  Ti14  1  0.65298373  0.49350139  0.87529976  1.0
  Ti  Ti15  1  0.50467148  0.34834863  0.62765843  1.0
  Ti  Ti16  1  0.49247761  0.65343980  0.12394341  1.0
  Ti  Ti17  1  0.15298373  0.00649861  0.87470024  1.0
  Re  Re18  1  0.32856680  0.32608996  0.99759613  1.0
  Re  Re19  1  0.82856680  0.17391004  0.75240387  1.0
  Si  Si20  1  0.04765632  0.70513543  0.43498814  1.0
  Si  Si21  1  0.63355413  0.29675382  0.43411365  1.0
  Si  Si22  1  0.36940188  0.70251431  0.93150825  1.0
  Si  Si23  1  0.20089059  0.13081805  0.68255023  1.0
  Si  Si24  1  0.29635032  0.63372164  0.56714806  1.0
  Si  Si25  1  0.70089059  0.36918195  0.06744977  1.0
  Si  Si26  1  0.79635032  0.86627836  0.18285194  1.0
  Si  Si27  1  0.13355413  0.20324618  0.31588635  1.0
  Si  Si28  1  0.95334699  0.29205659  0.93457252  1.0
  Si  Si29  1  0.70634138  0.04853841  0.56808764  1.0
  Si  Si30  1  0.20634138  0.45146159  0.18191236  1.0
  Si  Si31  1  0.79181432  0.54495124  0.68603607  1.0
  Si  Si32  1  0.45334699  0.20794341  0.81542748  1.0
  Si  Si33  1  0.54765632  0.79486457  0.31501186  1.0
  Si  Si34  1  0.29181432  0.95504876  0.06396393  1.0
  Si  Si35  1  0.86940188  0.79748569  0.81849175  1.0