# generated using pymatgen
data_Nd5IrRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.92309506
_cell_length_b   8.92309503
_cell_length_c   7.32764169
_cell_angle_alpha   84.05032702
_cell_angle_beta   84.05032542
_cell_angle_gamma   43.83791492
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd5IrRu
_chemical_formula_sum   'Nd10 Ir2 Ru2'
_cell_volume   401.57139629
_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  0.01521246  0.79962345  0.91458551  1.0
  Nd  Nd1  1  0.20037655  0.98478754  0.58541449  1.0
  Nd  Nd2  1  0.98034292  0.20509692  0.08784507  1.0
  Nd  Nd3  1  0.79490308  0.01965708  0.41215493  1.0
  Nd  Nd4  1  0.35699769  0.21218036  0.81743990  1.0
  Nd  Nd5  1  0.78781964  0.64300231  0.68256010  1.0
  Nd  Nd6  1  0.64724310  0.78684395  0.18422680  1.0
  Nd  Nd7  1  0.21315605  0.35275690  0.31577320  1.0
  Nd  Nd8  1  0.57008705  0.42991295  0.75000000  1.0
  Nd  Nd9  1  0.42976242  0.57023758  0.25000000  1.0
  Ir  Ir10  1  0.17549652  0.60077741  0.57483692  1.0
  Ir  Ir11  1  0.39922259  0.82450348  0.92516308  1.0
  Ru  Ru12  1  0.82641093  0.39703200  0.42676890  1.0
  Ru  Ru13  1  0.60296800  0.17358907  0.07323110  1.0