# generated using pymatgen
data_Th4TiNb5Si8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.20709581
_cell_length_b   7.19812477
_cell_length_c   13.34422377
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00672928
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th4TiNb5Si8
_chemical_formula_sum   'Th8 Ti2 Nb10 Si16'
_cell_volume   692.26596343
_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
  Th  Th0  1  0.33824396  0.00033496  0.46798445  1.0
  Th  Th1  1  0.50012185  0.83834768  0.71803458  1.0
  Th  Th2  1  0.49987815  0.16165232  0.21803458  1.0
  Th  Th3  1  0.83860282  0.50091818  0.28234663  1.0
  Th  Th4  1  0.16139718  0.49908182  0.78234663  1.0
  Th  Th5  1  0.66175604  0.99966504  0.96798445  1.0
  Th  Th6  1  0.00040598  0.33711822  0.53195687  1.0
  Th  Th7  1  0.99959402  0.66288178  0.03195687  1.0
  Ti  Ti8  1  0.00657029  0.15884539  0.12416784  1.0
  Ti  Ti9  1  0.99342971  0.84115461  0.62416784  1.0
  Nb  Nb10  1  0.33139003  0.33098051  0.99981859  1.0
  Nb  Nb11  1  0.16900860  0.83026277  0.25004430  1.0
  Nb  Nb12  1  0.83099140  0.16973723  0.75004430  1.0
  Nb  Nb13  1  0.66860997  0.66901949  0.49981859  1.0
  Nb  Nb14  1  0.15922752  0.00560641  0.87575573  1.0
  Nb  Nb15  1  0.49464472  0.65843574  0.12541495  1.0
  Nb  Nb16  1  0.50535528  0.34156426  0.62541495  1.0
  Nb  Nb17  1  0.65812993  0.49433396  0.87454840  1.0
  Nb  Nb18  1  0.34187007  0.50566604  0.37454840  1.0
  Nb  Nb19  1  0.84077248  0.99439359  0.37575573  1.0
  Si  Si20  1  0.20150659  0.12274050  0.68520562  1.0
  Si  Si21  1  0.37511582  0.70295990  0.93555177  1.0
  Si  Si22  1  0.62488418  0.29704010  0.43555177  1.0
  Si  Si23  1  0.70324196  0.37369976  0.06451730  1.0
  Si  Si24  1  0.29675804  0.62630024  0.56451730  1.0
  Si  Si25  1  0.79849341  0.87725950  0.18520562  1.0
  Si  Si26  1  0.12393692  0.20194566  0.31323828  1.0
  Si  Si27  1  0.87606308  0.79805434  0.81323828  1.0
  Si  Si28  1  0.28665141  0.95903728  0.06440261  1.0
  Si  Si29  1  0.54149774  0.78795554  0.31351702  1.0
  Si  Si30  1  0.45850226  0.21204446  0.81351702  1.0
  Si  Si31  1  0.78922581  0.54261990  0.68586147  1.0
  Si  Si32  1  0.21077419  0.45738010  0.18586147  1.0
  Si  Si33  1  0.71334859  0.04096272  0.56440261  1.0
  Si  Si34  1  0.95839642  0.28730753  0.93763359  1.0
  Si  Si35  1  0.04160358  0.71269247  0.43763359  1.0