# generated using pymatgen
data_Nb6Al5ZnRu12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.36574541
_cell_length_b   6.16908704
_cell_length_c   13.09343386
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00105686
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb6Al5ZnRu12
_chemical_formula_sum   'Nb6 Al5 Zn1 Ru12'
_cell_volume   352.64104705
_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
  Nb  Nb0  1  0.99998870  0.50000000  0.99739434  1.0
  Nb  Nb1  1  0.49982459  0.00000000  0.16614055  1.0
  Nb  Nb2  1  0.99984945  0.50000000  0.33330395  1.0
  Nb  Nb3  1  0.50000265  0.00000000  0.50057277  1.0
  Nb  Nb4  1  0.00015373  0.50000000  0.66923395  1.0
  Nb  Nb5  1  0.50016981  0.00000000  0.83334723  1.0
  Al  Al6  1  0.99999309  0.00000000  0.00019525  1.0
  Al  Al7  1  0.49986440  0.50000000  0.16653975  1.0
  Al  Al8  1  0.99990606  0.00000000  0.33332708  1.0
  Al  Al9  1  0.49999815  0.50000000  0.50012863  1.0
  Al  Al10  1  0.00010583  0.00000000  0.66648342  1.0
  Zn  Zn11  1  0.50016788  0.50000000  0.83336377  1.0
  Ru  Ru12  1  0.49998665  0.24843294  0.00167389  1.0
  Ru  Ru13  1  0.49998665  0.75156806  0.00167389  1.0
  Ru  Ru14  1  0.99985500  0.25042174  0.16686617  1.0
  Ru  Ru15  1  0.99985500  0.74957926  0.16686617  1.0
  Ru  Ru16  1  0.49986676  0.25047456  0.33333292  1.0
  Ru  Ru17  1  0.49986676  0.74952444  0.33333292  1.0
  Ru  Ru18  1  0.00000216  0.25042528  0.49977355  1.0
  Ru  Ru19  1  0.00000216  0.74957572  0.49977355  1.0
  Ru  Ru20  1  0.50012573  0.24843720  0.66499090  1.0
  Ru  Ru21  1  0.50012573  0.75156180  0.66499090  1.0
  Ru  Ru22  1  0.00014952  0.24626603  0.83334722  1.0
  Ru  Ru23  1  0.00014952  0.75373497  0.83334722  1.0