# generated using pymatgen
data_Sc6Nb3Al13Ru7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.82442833
_cell_length_b   8.82442797
_cell_length_c   8.82442783
_cell_angle_alpha   59.81451928
_cell_angle_beta   59.81452047
_cell_angle_gamma   59.81451484
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc6Nb3Al13Ru7
_chemical_formula_sum   'Sc6 Nb3 Al13 Ru7'
_cell_volume   483.85180653
_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  0.71279523  0.71279523  0.28030314  1.0
  Sc  Sc1  1  0.29013811  0.71043129  0.29013811  1.0
  Sc  Sc2  1  0.71043129  0.29013811  0.29013811  1.0
  Sc  Sc3  1  0.29013811  0.29013811  0.71043129  1.0
  Sc  Sc4  1  0.71279523  0.28030314  0.71279523  1.0
  Sc  Sc5  1  0.28030314  0.71279523  0.71279523  1.0
  Nb  Nb6  1  0.87783818  0.87783818  0.36133205  1.0
  Nb  Nb7  1  0.87783818  0.36133205  0.87783818  1.0
  Nb  Nb8  1  0.36133205  0.87783818  0.87783818  1.0
  Al  Al9  1  0.88137489  0.88137489  0.88137489  1.0
  Al  Al10  1  0.12071054  0.12071054  0.63685019  1.0
  Al  Al11  1  0.12071054  0.63685019  0.12071054  1.0
  Al  Al12  1  0.63685019  0.12071054  0.12071054  1.0
  Al  Al13  1  0.12161393  0.12161393  0.12161393  1.0
  Al  Al14  1  0.66821123  0.66821123  0.00291045  1.0
  Al  Al15  1  0.66821123  0.00291045  0.66821123  1.0
  Al  Al16  1  0.00291045  0.66821123  0.66821123  1.0
  Al  Al17  1  0.66231697  0.66231697  0.66231697  1.0
  Al  Al18  1  0.33519866  0.33519866  0.99799702  1.0
  Al  Al19  1  0.33519866  0.99799702  0.33519866  1.0
  Al  Al20  1  0.99799702  0.33519866  0.33519866  1.0
  Al  Al21  1  0.33473744  0.33473744  0.33473744  1.0
  Ru  Ru22  1  0.00127888  0.00127888  0.00127888  1.0
  Ru  Ru23  1  0.99949063  0.99949063  0.49780312  1.0
  Ru  Ru24  1  0.50267070  0.99694509  0.50267070  1.0
  Ru  Ru25  1  0.99694509  0.50267070  0.50267070  1.0
  Ru  Ru26  1  0.50267070  0.50267070  0.99694509  1.0
  Ru  Ru27  1  0.99949063  0.49780312  0.99949063  1.0
  Ru  Ru28  1  0.49780312  0.99949063  0.99949063  1.0