# generated using pymatgen
data_Nd2Si5Ir2Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.21105105
_cell_length_b   8.21105138
_cell_length_c   5.91380649
_cell_angle_alpha   68.98928243
_cell_angle_beta   68.98928586
_cell_angle_gamma   91.00647088
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd2Si5Ir2Ru
_chemical_formula_sum   'Nd4 Si10 Ir4 Ru2'
_cell_volume   342.54162115
_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
  Nd  Nd0  1  0.86174000  0.60157380  0.76832074  1.0
  Nd  Nd1  1  0.39842620  0.13826000  0.73167926  1.0
  Nd  Nd2  1  0.13826000  0.39842620  0.23167926  1.0
  Nd  Nd3  1  0.60157380  0.86174000  0.26832074  1.0
  Si  Si4  1  0.04736874  0.25305719  0.84984089  1.0
  Si  Si5  1  0.74694281  0.95263126  0.65015911  1.0
  Si  Si6  1  0.95263126  0.74694281  0.15015911  1.0
  Si  Si7  1  0.25305719  0.04736874  0.34984089  1.0
  Si  Si8  1  0.22390280  0.77609720  0.75000000  1.0
  Si  Si9  1  0.77609720  0.22390280  0.25000000  1.0
  Si  Si10  1  0.50041289  0.49958711  0.75000000  1.0
  Si  Si11  1  0.49958711  0.50041289  0.25000000  1.0
  Si  Si12  1  0.77532146  0.22467854  0.75000000  1.0
  Si  Si13  1  0.22467854  0.77532146  0.25000000  1.0
  Ir  Ir14  1  0.24750424  0.52816329  0.61295711  1.0
  Ir  Ir15  1  0.47183671  0.75249576  0.88704289  1.0
  Ir  Ir16  1  0.75249576  0.47183671  0.38704289  1.0
  Ir  Ir17  1  0.52816329  0.24750424  0.11295711  1.0
  Ru  Ru18  1  0.00010709  0.99989291  0.75000000  1.0
  Ru  Ru19  1  0.99989291  0.00010709  0.25000000  1.0