# generated using pymatgen
data_NdTiNbIr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.12393735
_cell_length_b   6.12393694
_cell_length_c   6.12393807
_cell_angle_alpha   137.95015048
_cell_angle_beta   137.95013798
_cell_angle_gamma   60.97936590
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdTiNbIr2
_chemical_formula_sum   'Nd1 Ti1 Nb1 Ir2'
_cell_volume   101.89686480
_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  0.00000000  0.00000000  0.00000000  1.0
  Ti  Ti1  1  0.75000000  0.25000000  0.50000000  1.0
  Nb  Nb2  1  0.25000000  0.75000000  0.50000000  1.0
  Ir  Ir3  1  0.62381297  0.62381297  0.00000000  1.0
  Ir  Ir4  1  0.37618703  0.37618703  1.00000000  1.0