# generated using pymatgen
data_Nb2Si2IrRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.82110072
_cell_length_b   6.42658066
_cell_length_c   7.26237324
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2Si2IrRu
_chemical_formula_sum   'Nb4 Si4 Ir2 Ru2'
_cell_volume   178.33928187
_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
  Nb  Nb0  1  0.75000000  0.52034397  0.82357700  1.0
  Nb  Nb1  1  0.25000000  0.97769802  0.32413574  1.0
  Nb  Nb2  1  0.75000000  0.02034397  0.67642300  1.0
  Nb  Nb3  1  0.25000000  0.47769802  0.17586426  1.0
  Si  Si4  1  0.25000000  0.22523697  0.87411084  1.0
  Si  Si5  1  0.25000000  0.72523697  0.62588916  1.0
  Si  Si6  1  0.75000000  0.77297092  0.11955224  1.0
  Si  Si7  1  0.75000000  0.27297092  0.38044776  1.0
  Ir  Ir8  1  0.75000000  0.64948113  0.43550172  1.0
  Ir  Ir9  1  0.75000000  0.14948113  0.06449828  1.0
  Ru  Ru10  1  0.25000000  0.85426899  0.93808727  1.0
  Ru  Ru11  1  0.25000000  0.35426899  0.56191273  1.0