# generated using pymatgen
data_Sc6Sn6Ru11Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.52661083
_cell_length_b   6.44386592
_cell_length_c   13.57035936
_cell_angle_alpha   90.00009974
_cell_angle_beta   90.00012947
_cell_angle_gamma   89.99947559
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc6Sn6Ru11Au
_chemical_formula_sum   'Sc6 Sn6 Ru11 Au1'
_cell_volume   395.83209180
_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
  Sc  Sc0  1  0.00000084  0.51167758  0.99998920  1.0
  Sc  Sc1  1  0.49997395  0.99492392  0.17188880  1.0
  Sc  Sc2  1  0.99997499  0.49893944  0.33489804  1.0
  Sc  Sc3  1  0.49999973  0.00236112  0.50001069  1.0
  Sc  Sc4  1  0.00002518  0.49894201  0.66511133  1.0
  Sc  Sc5  1  0.50002215  0.99492531  0.82810067  1.0
  Sn  Sn6  1  0.99999995  0.98403548  0.99999127  1.0
  Sn  Sn7  1  0.49997287  0.50770984  0.17365160  1.0
  Sn  Sn8  1  0.99997993  0.00022916  0.33405581  1.0
  Sn  Sn9  1  0.50000082  0.50002483  0.50000926  1.0
  Sn  Sn10  1  0.00002027  0.00022921  0.66595224  1.0
  Sn  Sn11  1  0.50002840  0.50770891  0.82634085  1.0
  Ru  Ru12  1  0.50000012  0.74246445  0.99998929  1.0
  Ru  Ru13  1  0.99997658  0.24933592  0.16329652  1.0
  Ru  Ru14  1  0.99997450  0.74989103  0.16615014  1.0
  Ru  Ru15  1  0.49997729  0.24958678  0.33247506  1.0
  Ru  Ru16  1  0.49998255  0.75319256  0.33506663  1.0
  Ru  Ru17  1  0.99999890  0.25059729  0.50001199  1.0
  Ru  Ru18  1  0.00000187  0.75004407  0.50001238  1.0
  Ru  Ru19  1  0.50002156  0.24958694  0.66753558  1.0
  Ru  Ru20  1  0.50001967  0.75319340  0.66494404  1.0
  Ru  Ru21  1  0.00002847  0.24933569  0.83669063  1.0
  Ru  Ru22  1  0.00002294  0.74989259  0.83383597  1.0
  Au  Au23  1  0.49999947  0.25117847  0.99999201  1.0