# generated using pymatgen
data_NbZn16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.81020880
_cell_length_b   6.81020934
_cell_length_c   11.50979195
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   111.97580925
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbZn16
_chemical_formula_sum   'Nb2 Zn32'
_cell_volume   495.02628681
_cell_formula_units_Z   2
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
  Nb  Nb0  1  0.04767998  0.95232002  0.75000000  1.0
  Nb  Nb1  1  0.95232002  0.04767998  0.25000000  1.0
  Zn  Zn2  1  0.75371505  0.64984038  0.36594128  1.0
  Zn  Zn3  1  0.35515768  0.98169493  0.93124432  1.0
  Zn  Zn4  1  0.62002540  0.37997460  0.96742855  1.0
  Zn  Zn5  1  0.01830507  0.64484232  0.56875568  1.0
  Zn  Zn6  1  0.19135996  0.48204506  0.25000000  1.0
  Zn  Zn7  1  0.64984038  0.75371505  0.86594128  1.0
  Zn  Zn8  1  0.37997460  0.62002540  0.46742855  1.0
  Zn  Zn9  1  0.35015962  0.24628495  0.13405872  1.0
  Zn  Zn10  1  0.17552327  0.82447673  0.36012119  1.0
  Zn  Zn11  1  0.98169493  0.35515768  0.06875568  1.0
  Zn  Zn12  1  0.24628495  0.35015962  0.86594128  1.0
  Zn  Zn13  1  0.64484232  0.01830507  0.43124432  1.0
  Zn  Zn14  1  0.80864004  0.51795494  0.75000000  1.0
  Zn  Zn15  1  0.24628495  0.35015962  0.63405872  1.0
  Zn  Zn16  1  0.37997460  0.62002540  0.03257145  1.0
  Zn  Zn17  1  0.35015962  0.24628495  0.36594128  1.0
  Zn  Zn18  1  0.75371505  0.64984038  0.13405872  1.0
  Zn  Zn19  1  0.51795494  0.80864004  0.25000000  1.0
  Zn  Zn20  1  0.00000000  -0.00000000  -0.00000000  1.0
  Zn  Zn21  1  0.62002540  0.37997460  0.53257145  1.0
  Zn  Zn22  1  0.29096789  0.70903211  0.75000000  1.0
  Zn  Zn23  1  0.48204506  0.19135996  0.75000000  1.0
  Zn  Zn24  1  0.64484232  0.01830507  0.06875568  1.0
  Zn  Zn25  1  0.64984038  0.75371505  0.63405872  1.0
  Zn  Zn26  1  0.17552327  0.82447673  0.13987881  1.0
  Zn  Zn27  1  0.01830507  0.64484232  0.93124432  1.0
  Zn  Zn28  1  0.00000000  -0.00000000  0.50000000  1.0
  Zn  Zn29  1  0.98169493  0.35515768  0.43124432  1.0
  Zn  Zn30  1  0.35515768  0.98169493  0.56875568  1.0
  Zn  Zn31  1  0.70903211  0.29096789  0.25000000  1.0
  Zn  Zn32  1  0.82447673  0.17552327  0.86012119  1.0
  Zn  Zn33  1  0.82447673  0.17552327  0.63987881  1.0