# generated using pymatgen
data_Nd2AlIr3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.19642285
_cell_length_b   5.66910366
_cell_length_c   5.66910404
_cell_angle_alpha   59.99999780
_cell_angle_beta   56.94243293
_cell_angle_gamma   56.94243795
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd2AlIr3
_chemical_formula_sum   'Nd2 Al1 Ir3'
_cell_volume   112.33591770
_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
  Nd  Nd0  1  0.00409720  0.99863393  0.99863393  1.0
  Nd  Nd1  1  0.24590280  0.25136607  0.25136607  1.0
  Al  Al2  1  0.12500000  0.62500000  0.62500000  1.0
  Ir  Ir3  1  0.62500000  0.62500000  0.62500000  1.0
  Ir  Ir4  1  0.62500000  0.12500000  0.62500000  1.0
  Ir  Ir5  1  0.62500000  0.62500000  0.12500000  1.0