# generated using pymatgen
data_Sc5Si7Ni16Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.98081484
_cell_length_b   7.98081489
_cell_length_c   7.93705133
_cell_angle_alpha   60.18123070
_cell_angle_beta   60.18123049
_cell_angle_gamma   59.63753013
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc5Si7Ni16Ru
_chemical_formula_sum   'Sc5 Si7 Ni16 Ru1'
_cell_volume   357.44782446
_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  0.30093354  0.70751061  0.29248939  1.0
  Sc  Sc1  1  0.70751061  0.30093354  0.29248939  1.0
  Sc  Sc2  1  0.28370616  0.28370616  0.71629384  1.0
  Sc  Sc3  1  0.70751061  0.30093354  0.69906646  1.0
  Sc  Sc4  1  0.30093354  0.70751061  0.69906646  1.0
  Si  Si5  1  0.00448145  0.00448145  0.99551855  1.0
  Si  Si6  1  0.99742887  0.99742887  0.50257113  1.0
  Si  Si7  1  0.51040973  0.99141914  0.48959027  1.0
  Si  Si8  1  0.99141914  0.51040973  0.48959027  1.0
  Si  Si9  1  0.49742887  0.49742887  0.00257113  1.0
  Si  Si10  1  0.99141914  0.51040973  0.00858086  1.0
  Si  Si11  1  0.51040973  0.99141914  0.00858086  1.0
  Ni  Ni12  1  0.88075943  0.88075943  0.35194797  1.0
  Ni  Ni13  1  0.88009582  0.35759980  0.88115119  1.0
  Ni  Ni14  1  0.35759980  0.88009582  0.88115119  1.0
  Ni  Ni15  1  0.88075943  0.88075943  0.88653117  1.0
  Ni  Ni16  1  0.11884881  0.11884881  0.64240020  1.0
  Ni  Ni17  1  0.11346883  0.64805203  0.11924057  1.0
  Ni  Ni18  1  0.64805203  0.11346883  0.11924057  1.0
  Ni  Ni19  1  0.11884881  0.11884881  0.11990418  1.0
  Ni  Ni20  1  0.66855376  0.66855376  0.98923033  1.0
  Ni  Ni21  1  0.66679694  0.99485482  0.66917312  1.0
  Ni  Ni22  1  0.99485482  0.66679694  0.66917312  1.0
  Ni  Ni23  1  0.66855376  0.66855376  0.67366315  1.0
  Ni  Ni24  1  0.33082688  0.33082688  0.00514518  1.0
  Ni  Ni25  1  0.32633685  0.01076967  0.33144624  1.0
  Ni  Ni26  1  0.01076967  0.32633685  0.33144624  1.0
  Ni  Ni27  1  0.33082688  0.33082688  0.33320306  1.0
  Ru  Ru28  1  0.70045710  0.70045710  0.29954290  1.0