# generated using pymatgen
data_Nd3Th(Nb3Si4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.17892333
_cell_length_b   7.17554424
_cell_length_c   13.32256614
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.02516233
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd3Th(Nb3Si4)2
_chemical_formula_sum   'Nd6 Th2 Nb12 Si16'
_cell_volume   686.28104649
_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
  Nd  Nd0  1  0.16150492  0.49710072  0.46810545  1.0
  Nd  Nd1  1  0.50309345  0.83866280  0.03207507  1.0
  Nd  Nd2  1  0.83849508  0.50289928  0.96810545  1.0
  Nd  Nd3  1  0.49690655  0.16133720  0.53207507  1.0
  Nd  Nd4  1  0.33895836  0.99731363  0.78278131  1.0
  Nd  Nd5  1  0.66104164  0.00268637  0.28278131  1.0
  Th  Th6  1  0.99651426  0.33855341  0.21753800  1.0
  Th  Th7  1  0.00348574  0.66144659  0.71753800  1.0
  Nb  Nb8  1  0.17061360  0.17107062  0.00068728  1.0
  Nb  Nb9  1  0.82938640  0.82892938  0.50068728  1.0
  Nb  Nb10  1  0.32749222  0.66909962  0.24940678  1.0
  Nb  Nb11  1  0.67250778  0.33090038  0.74940678  1.0
  Nb  Nb12  1  0.15507884  0.99144313  0.37472356  1.0
  Nb  Nb13  1  0.84492116  0.00855687  0.87472356  1.0
  Nb  Nb14  1  0.50973962  0.65524051  0.62543764  1.0
  Nb  Nb15  1  0.34369828  0.49007208  0.87428976  1.0
  Nb  Nb16  1  0.49026038  0.34475949  0.12543764  1.0
  Nb  Nb17  1  0.65630172  0.50992792  0.37428976  1.0
  Nb  Nb18  1  0.98958658  0.15514897  0.62507925  1.0
  Nb  Nb19  1  0.01041342  0.84485103  0.12507925  1.0
  Si  Si20  1  0.29214928  0.04366729  0.18679445  1.0
  Si  Si21  1  0.70785072  0.95633271  0.68679445  1.0
  Si  Si22  1  0.45528532  0.78948381  0.43665475  1.0
  Si  Si23  1  0.21087418  0.54572525  0.06204829  1.0
  Si  Si24  1  0.54471468  0.21051619  0.93665475  1.0
  Si  Si25  1  0.78912582  0.45427475  0.56204829  1.0
  Si  Si26  1  0.04512370  0.28792071  0.81420913  1.0
  Si  Si27  1  0.95487630  0.71207929  0.31420913  1.0
  Si  Si28  1  0.37276628  0.29762644  0.31459683  1.0
  Si  Si29  1  0.62723372  0.70237356  0.81459683  1.0
  Si  Si30  1  0.20311612  0.87245923  0.56308399  1.0
  Si  Si31  1  0.12899315  0.79832687  0.93645990  1.0
  Si  Si32  1  0.79688388  0.12754077  0.06308399  1.0
  Si  Si33  1  0.87100685  0.20167313  0.43645990  1.0
  Si  Si34  1  0.29860992  0.36955328  0.68602757  1.0
  Si  Si35  1  0.70139008  0.63044672  0.18602757  1.0