# generated using pymatgen
data_Li(NdIr)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.55713805
_cell_length_b   5.55997097
_cell_length_c   5.56035879
_cell_angle_alpha   134.27282126
_cell_angle_beta   115.66574099
_cell_angle_gamma   82.47428946
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li(NdIr)2
_chemical_formula_sum   'Li1 Nd2 Ir2'
_cell_volume   106.89607289
_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
  Li  Li0  1  0.00000000  0.00000000  0.00000000  1.0
  Nd  Nd1  1  0.29327858  0.79323128  0.50014471  1.0
  Nd  Nd2  1  0.70672142  0.20676872  0.49985529  1.0
  Ir  Ir3  1  0.72612848  0.50012639  0.22620964  1.0
  Ir  Ir4  1  0.27387152  0.49987361  0.77379036  1.0