# generated using pymatgen
data_NbZn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.02844772
_cell_length_b   5.02844737
_cell_length_c   16.26019476
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001570
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbZn2
_chemical_formula_sum   'Nb8 Zn16'
_cell_volume   356.06079263
_cell_formula_units_Z   8
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  0.33333300  0.66666700  0.65684751  1.0
  Nb  Nb1  1  0.66666700  0.33333300  0.15684751  1.0
  Nb  Nb2  1  0.66666700  0.33333300  0.34315249  1.0
  Nb  Nb3  1  0.33333300  0.66666700  0.84315249  1.0
  Nb  Nb4  1  0.00000000  -0.00000000  0.40913970  1.0
  Nb  Nb5  1  0.00000000  -0.00000000  0.90913970  1.0
  Nb  Nb6  1  0.00000000  -0.00000000  0.59086030  1.0
  Nb  Nb7  1  0.00000000  -0.00000000  0.09086030  1.0
  Zn  Zn8  1  0.83922044  0.67844088  0.75000000  1.0
  Zn  Zn9  1  0.16077956  0.83922044  0.25000000  1.0
  Zn  Zn10  1  0.67844088  0.83922044  0.25000000  1.0
  Zn  Zn11  1  0.32155912  0.16077956  0.75000000  1.0
  Zn  Zn12  1  0.83922044  0.16077956  0.75000000  1.0
  Zn  Zn13  1  0.16077956  0.32155912  0.25000000  1.0
  Zn  Zn14  1  0.50000000  -0.00000000  0.50000000  1.0
  Zn  Zn15  1  0.50000000  0.50000000  -0.00000000  1.0
  Zn  Zn16  1  0.33333300  0.66666700  0.12685254  1.0
  Zn  Zn17  1  0.66666700  0.33333300  0.62685254  1.0
  Zn  Zn18  1  0.66666700  0.33333300  0.87314746  1.0
  Zn  Zn19  1  0.33333300  0.66666700  0.37314746  1.0
  Zn  Zn20  1  0.50000000  -0.00000000  -0.00000000  1.0
  Zn  Zn21  1  0.50000000  0.50000000  0.50000000  1.0
  Zn  Zn22  1  0.00000000  0.50000000  0.50000000  1.0
  Zn  Zn23  1  0.00000000  0.50000000  -0.00000000  1.0