# generated using pymatgen
data_Nd3In3Cu2Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.64141957
_cell_length_b   7.64141870
_cell_length_c   4.01629112
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999521
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd3In3Cu2Ir
_chemical_formula_sum   'Nd3 In3 Cu2 Ir1'
_cell_volume   203.09717459
_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  0.01398817  0.59391713  0.50000000  1.0
  Nd  Nd1  1  0.40608287  0.42007004  0.50000000  1.0
  Nd  Nd2  1  0.57992996  0.98601183  0.50000000  1.0
  In  In3  1  0.75655077  0.75106955  0.00000000  1.0
  In  In4  1  0.99451878  0.24344923  0.00000000  1.0
  In  In5  1  0.24893045  0.00548122  0.00000000  1.0
  Cu  Cu6  1  0.00000000  0.00000000  0.50000000  1.0
  Cu  Cu7  1  0.66666700  0.33333300  0.00000000  1.0
  Ir  Ir8  1  0.33333300  0.66666700  0.00000000  1.0