# generated using pymatgen
data_Nb2ZnRu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.60872393
_cell_length_b   7.60872500
_cell_length_c   5.42640938
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000388
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2ZnRu3
_chemical_formula_sum   'Nb6 Zn3 Ru9'
_cell_volume   272.06137227
_cell_formula_units_Z   3
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  0.66666600  0.33333300  0.53963998  1.0
  Nb  Nb1  1  0.33333400  0.66666700  0.53963998  1.0
  Nb  Nb2  1  0.00000000  0.00000000  0.53961661  1.0
  Nb  Nb3  1  0.33325745  0.00000000  0.91134005  1.0
  Nb  Nb4  1  1.00000000  0.33325645  0.91134005  1.0
  Nb  Nb5  1  0.66674355  0.66674355  0.91134005  1.0
  Zn  Zn6  1  0.66652696  0.00000000  0.22533204  1.0
  Zn  Zn7  1  0.33347304  0.33347204  0.22533204  1.0
  Zn  Zn8  1  1.00000000  0.66652796  0.22533204  1.0
  Ru  Ru9  1  0.66666600  0.33333300  0.04850187  1.0
  Ru  Ru10  1  0.33333400  0.66666700  0.04850187  1.0
  Ru  Ru11  1  0.00000000  0.00000000  0.04878370  1.0
  Ru  Ru12  1  0.33329634  0.00000000  0.40228256  1.0
  Ru  Ru13  1  1.00000000  0.33329534  0.40228256  1.0
  Ru  Ru14  1  0.66670466  0.66670466  0.40228256  1.0
  Ru  Ru15  1  0.66664737  0.00000000  0.72543201  1.0
  Ru  Ru16  1  0.33335263  0.33335263  0.72543201  1.0
  Ru  Ru17  1  0.00000000  0.66664737  0.72543201  1.0