# generated using pymatgen
data_Zr8Si16(TcRu3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.90435269
_cell_length_b   9.90564552
_cell_length_c   13.33857486
_cell_angle_alpha   54.09208037
_cell_angle_beta   54.09678393
_cell_angle_gamma   31.18628310
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr8Si16(TcRu3)3
_chemical_formula_sum   'Zr8 Si16 Tc3 Ru9'
_cell_volume   537.55646419
_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
  Zr  Zr0  1  0.03448072  0.29719112  0.63702945  1.0
  Zr  Zr1  1  0.70283191  0.96516147  0.86290253  1.0
  Zr  Zr2  1  0.96554055  0.70316371  0.36295057  1.0
  Zr  Zr3  1  0.29664441  0.03623777  0.13752474  1.0
  Zr  Zr4  1  0.29282210  0.55893781  0.64665175  1.0
  Zr  Zr5  1  0.44245334  0.70731913  0.85034727  1.0
  Zr  Zr6  1  0.70671880  0.44131706  0.35362870  1.0
  Zr  Zr7  1  0.56067524  0.29142990  0.14626293  1.0
  Si  Si8  1  0.97200569  0.25537062  0.89451310  1.0
  Si  Si9  1  0.74445557  0.02614938  0.60661288  1.0
  Si  Si10  1  0.02698032  0.74495927  0.10582217  1.0
  Si  Si11  1  0.25600214  0.97278800  0.39367569  1.0
  Si  Si12  1  0.14146488  0.38847219  0.89669251  1.0
  Si  Si13  1  0.61099661  0.86076380  0.60227343  1.0
  Si  Si14  1  0.85994791  0.61112945  0.10343627  1.0
  Si  Si15  1  0.38970683  0.13919164  0.39748934  1.0
  Si  Si16  1  0.08302183  0.57094101  0.56786050  1.0
  Si  Si17  1  0.42710577  0.91637335  0.93398639  1.0
  Si  Si18  1  0.91790371  0.42818326  0.43254155  1.0
  Si  Si19  1  0.57246415  0.08237395  0.06693096  1.0
  Si  Si20  1  0.61293184  0.38663604  0.75013225  1.0
  Si  Si21  1  0.38641781  0.61390893  0.24880530  1.0
  Si  Si22  1  0.11698938  0.88288976  0.74968053  1.0
  Si  Si23  1  0.88049451  0.11915829  0.25020398  1.0
  Tc  Tc24  1  0.89157554  0.15128746  0.58203884  1.0
  Tc  Tc25  1  0.85030175  0.10668136  0.91795008  1.0
  Tc  Tc26  1  0.10768441  0.84955971  0.41643138  1.0
  Ru  Ru27  1  0.14682067  0.89558145  0.08276914  1.0
  Ru  Ru28  1  0.82925280  0.64570002  0.78273999  1.0
  Ru  Ru29  1  0.35267098  0.16925534  0.71995986  1.0
  Ru  Ru30  1  0.17238683  0.35297999  0.21835378  1.0
  Ru  Ru31  1  0.64848881  0.82880450  0.28098965  1.0
  Ru  Ru32  1  0.23955677  0.51709517  0.93168878  1.0
  Ru  Ru33  1  0.48317620  0.76038672  0.56834331  1.0
  Ru  Ru34  1  0.76059945  0.48233243  0.06934370  1.0
  Ru  Ru35  1  0.51643175  0.24029096  0.43143872  1.0