# generated using pymatgen
data_Zr16Re3Ni4Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.71013732
_cell_length_b   8.71013564
_cell_length_c   8.71247267
_cell_angle_alpha   60.00886725
_cell_angle_beta   60.00886448
_cell_angle_gamma   60.00000062
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr16Re3Ni4Ir
_chemical_formula_sum   'Zr16 Re3 Ni4 Ir1'
_cell_volume   467.44932722
_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
  Zr  Zr0  1  0.19096585  0.60287256  0.60328904  1.0
  Zr  Zr1  1  0.60287256  0.19096585  0.60328904  1.0
  Zr  Zr2  1  0.60287256  0.60287256  0.60328904  1.0
  Zr  Zr3  1  0.60208900  0.60208900  0.19373299  1.0
  Zr  Zr4  1  0.45487297  0.45487297  0.04543297  1.0
  Zr  Zr5  1  0.04498548  0.04498548  0.45566662  1.0
  Zr  Zr6  1  0.45487297  0.04482109  0.04543297  1.0
  Zr  Zr7  1  0.04498548  0.45436142  0.45566662  1.0
  Zr  Zr8  1  0.04482109  0.45487297  0.04543297  1.0
  Zr  Zr9  1  0.45436142  0.04498548  0.45566662  1.0
  Zr  Zr10  1  0.81565449  0.81565449  0.17967483  1.0
  Zr  Zr11  1  0.18535993  0.18535993  0.81367368  1.0
  Zr  Zr12  1  0.81565449  0.18901519  0.17967483  1.0
  Zr  Zr13  1  0.18535993  0.81560546  0.81367368  1.0
  Zr  Zr14  1  0.18901519  0.81565449  0.17967483  1.0
  Zr  Zr15  1  0.81560546  0.18535993  0.81367368  1.0
  Re  Re16  1  0.50275386  0.83123036  0.83478642  1.0
  Re  Re17  1  0.83123036  0.50275386  0.83478642  1.0
  Re  Re18  1  0.83123036  0.83123036  0.83478642  1.0
  Ni  Ni19  1  0.82763419  0.38969563  0.39297454  1.0
  Ni  Ni20  1  0.38969563  0.82763419  0.39297454  1.0
  Ni  Ni21  1  0.38969563  0.38969563  0.39297454  1.0
  Ni  Ni22  1  0.39135389  0.39135389  0.82593934  1.0
  Ir  Ir23  1  0.83205421  0.83205421  0.50383736  1.0