# generated using pymatgen
data_Sn14(IrRu)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.15422029
_cell_length_b   8.15422030
_cell_length_c   8.15421993
_cell_angle_alpha   109.22803992
_cell_angle_beta   109.49248235
_cell_angle_gamma   109.69347985
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sn14(IrRu)3
_chemical_formula_sum   'Sn14 Ir3 Ru3'
_cell_volume   417.36707049
_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
  Sn  Sn0  1  0.25357455  0.75103155  0.50254300  1.0
  Sn  Sn1  1  0.75151045  0.24896845  0.50254300  1.0
  Sn  Sn2  1  0.74850678  0.50000000  0.24850678  1.0
  Sn  Sn3  1  0.25260988  0.50000000  0.75260988  1.0
  Sn  Sn4  1  0.50254301  0.74904509  0.25158811  1.0
  Sn  Sn5  1  0.50254301  0.25095491  0.75349792  1.0
  Sn  Sn6  1  0.99681148  0.99706631  0.32396179  1.0
  Sn  Sn7  1  0.67317069  0.99720235  0.99694871  1.0
  Sn  Sn8  1  0.99681148  0.67284968  0.99974516  1.0
  Sn  Sn9  1  0.32689548  0.32715032  0.32396179  1.0
  Sn  Sn10  1  0.99974537  0.32377802  0.99694871  1.0
  Sn  Sn11  1  0.67317069  0.67622198  0.67596735  1.0
  Sn  Sn12  1  0.32689548  0.00293369  0.99974516  1.0
  Sn  Sn13  1  0.99974537  0.00279765  0.67596735  1.0
  Ir  Ir14  1  0.34104709  1.00000000  0.34104709  1.0
  Ir  Ir15  1  0.00013381  0.34362710  0.34376190  1.0
  Ir  Ir16  1  0.00013381  0.65637290  0.65650671  1.0
  Ru  Ru17  1  0.34347669  0.34345215  0.00002355  1.0
  Ru  Ru18  1  0.65657140  0.65654785  0.00002355  1.0
  Ru  Ru19  1  0.65410348  0.00000000  0.65410348  1.0