# generated using pymatgen
data_Er5Th3(Ta3Si4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.04730633
_cell_length_b   7.04790609
_cell_length_c   13.07813499
_cell_angle_alpha   89.89091041
_cell_angle_beta   90.02162066
_cell_angle_gamma   90.04995024
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er5Th3(Ta3Si4)4
_chemical_formula_sum   'Er5 Th3 Ta12 Si16'
_cell_volume   649.57318867
_cell_formula_units_Z   1
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
  Er  Er0  1  0.99952812  0.34046849  0.21614668  1.0
  Er  Er1  1  0.99896038  0.66040269  0.71898150  1.0
  Er  Er2  1  0.16038094  0.50092465  0.46768309  1.0
  Er  Er3  1  0.49848702  0.83932735  0.03158619  1.0
  Er  Er4  1  0.83855214  0.49968148  0.96887358  1.0
  Th  Th5  1  0.49823112  0.16238933  0.53182620  1.0
  Th  Th6  1  0.33796822  0.99724197  0.78258601  1.0
  Th  Th7  1  0.66200452  0.00317261  0.28148028  1.0
  Ta  Ta8  1  0.16811541  0.17028064  0.99965618  1.0
  Ta  Ta9  1  0.83063033  0.83095461  0.49969360  1.0
  Ta  Ta10  1  0.33017975  0.67062919  0.24873254  1.0
  Ta  Ta11  1  0.66926620  0.33049992  0.75132718  1.0
  Ta  Ta12  1  0.15616958  0.98892823  0.37452317  1.0
  Ta  Ta13  1  0.84596176  0.00825670  0.87688902  1.0
  Ta  Ta14  1  0.51119347  0.65560674  0.62654699  1.0
  Ta  Ta15  1  0.34524411  0.49400365  0.87567497  1.0
  Ta  Ta16  1  0.48986220  0.34571485  0.12500456  1.0
  Ta  Ta17  1  0.65671610  0.50348640  0.37318353  1.0
  Ta  Ta18  1  0.99716726  0.15699234  0.62490349  1.0
  Ta  Ta19  1  0.00349099  0.84395880  0.12366848  1.0
  Si  Si20  1  0.28719126  0.04358530  0.18348258  1.0
  Si  Si21  1  0.71655922  0.95374001  0.68788249  1.0
  Si  Si22  1  0.45419892  0.78332440  0.43698298  1.0
  Si  Si23  1  0.20336914  0.54271283  0.06342385  1.0
  Si  Si24  1  0.54603689  0.20847086  0.93928803  1.0
  Si  Si25  1  0.80018765  0.46111791  0.56399531  1.0
  Si  Si26  1  0.03824470  0.30055318  0.81475533  1.0
  Si  Si27  1  0.95945204  0.69985226  0.31278931  1.0
  Si  Si28  1  0.36123832  0.30092631  0.31515533  1.0
  Si  Si29  1  0.63739286  0.70052098  0.81929057  1.0
  Si  Si30  1  0.19903944  0.86200981  0.56615929  1.0
  Si  Si31  1  0.12720544  0.79125008  0.93518868  1.0
  Si  Si32  1  0.79676469  0.13434924  0.06620604  1.0
  Si  Si33  1  0.87997457  0.20882942  0.43314426  1.0
  Si  Si34  1  0.29138290  0.37908895  0.68393343  1.0
  Si  Si35  1  0.70365236  0.62674582  0.17935828  1.0