# generated using pymatgen
data_Sc8Si16Tc11Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.58997958
_cell_length_b   6.58997914
_cell_length_c   12.38428303
_cell_angle_alpha   89.94684585
_cell_angle_beta   90.05315282
_cell_angle_gamma   90.23528910
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc8Si16Tc11Ir
_chemical_formula_sum   'Sc8 Si16 Tc11 Ir1'
_cell_volume   537.81751696
_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
  Sc  Sc0  1  0.00541087  0.65549381  0.03203601  1.0
  Sc  Sc1  1  0.99564737  0.33896114  0.53241549  1.0
  Sc  Sc2  1  0.33896114  0.99564737  0.46758451  1.0
  Sc  Sc3  1  0.15706917  0.49265569  0.78312520  1.0
  Sc  Sc4  1  0.84262358  0.50398450  0.27913169  1.0
  Sc  Sc5  1  0.49265569  0.15706917  0.21687480  1.0
  Sc  Sc6  1  0.50398450  0.84262358  0.72086831  1.0
  Sc  Sc7  1  0.65549381  0.00541087  0.96796399  1.0
  Si  Si8  1  0.02934120  0.72172462  0.43680659  1.0
  Si  Si9  1  0.61859823  0.30364548  0.43185856  1.0
  Si  Si10  1  0.38007576  0.69365868  0.93263472  1.0
  Si  Si11  1  0.19531922  0.12125363  0.68160494  1.0
  Si  Si12  1  0.30364548  0.61859823  0.56814144  1.0
  Si  Si13  1  0.69365868  0.38007576  0.06736528  1.0
  Si  Si14  1  0.80598448  0.88059519  0.18261659  1.0
  Si  Si15  1  0.12125363  0.19531922  0.31839506  1.0
  Si  Si16  1  0.97565447  0.27194544  0.93934186  1.0
  Si  Si17  1  0.72172462  0.02934120  0.56319341  1.0
  Si  Si18  1  0.22450450  0.47502344  0.18887738  1.0
  Si  Si19  1  0.77790036  0.52407670  0.68934031  1.0
  Si  Si20  1  0.47502344  0.22450450  0.81112262  1.0
  Si  Si21  1  0.52407670  0.77790036  0.31065969  1.0
  Si  Si22  1  0.27194544  0.97565447  0.06065814  1.0
  Si  Si23  1  0.88059519  0.80598448  0.81738341  1.0
  Tc  Tc24  1  0.16653160  0.83066250  0.25093514  1.0
  Tc  Tc25  1  0.33141076  0.33141076  0.00000000  1.0
  Tc  Tc26  1  0.02164017  0.81634789  0.62950824  1.0
  Tc  Tc27  1  0.97845517  0.18921382  0.13491733  1.0
  Tc  Tc28  1  0.81634789  0.02164017  0.37049176  1.0
  Tc  Tc29  1  0.31686611  0.48111402  0.38394621  1.0
  Tc  Tc30  1  0.68634827  0.51888758  0.88191549  1.0
  Tc  Tc31  1  0.48111402  0.31686611  0.61605379  1.0
  Tc  Tc32  1  0.51888758  0.68634827  0.11808451  1.0
  Tc  Tc33  1  0.18921382  0.97845517  0.86508267  1.0
  Tc  Tc34  1  0.83066250  0.16653160  0.74906486  1.0
  Ir  Ir35  1  0.67137359  0.67137359  0.50000000  1.0