# generated using pymatgen
data_Y9ScIn3Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.71695512
_cell_length_b   9.71695474
_cell_length_c   9.62635657
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000472
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y9ScIn3Ru
_chemical_formula_sum   'Y18 Sc2 In6 Ru2'
_cell_volume   787.14172121
_cell_formula_units_Z   2
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
  Y  Y0  1  0.20878560  0.79121440  0.43925659  1.0
  Y  Y1  1  0.20878560  0.41757220  0.43925659  1.0
  Y  Y2  1  0.58242780  0.79121440  0.43925659  1.0
  Y  Y3  1  0.79121440  0.20878560  0.56074341  1.0
  Y  Y4  1  0.79121440  0.58242780  0.56074341  1.0
  Y  Y5  1  0.41757220  0.20878560  0.56074341  1.0
  Y  Y6  1  0.79121440  0.20878560  0.93925659  1.0
  Y  Y7  1  0.79121440  0.58242780  0.93925659  1.0
  Y  Y8  1  0.41757220  0.20878560  0.93925659  1.0
  Y  Y9  1  0.20878560  0.79121440  0.06074341  1.0
  Y  Y10  1  0.20878560  0.41757220  0.06074341  1.0
  Y  Y11  1  0.58242780  0.79121440  0.06074341  1.0
  Y  Y12  1  0.53997415  0.46002585  0.25000000  1.0
  Y  Y13  1  0.53997415  0.07994830  0.25000000  1.0
  Y  Y14  1  0.92005170  0.46002585  0.25000000  1.0
  Y  Y15  1  0.46002585  0.53997415  0.75000000  1.0
  Y  Y16  1  0.46002585  0.92005170  0.75000000  1.0
  Y  Y17  1  0.07994830  0.53997415  0.75000000  1.0
  Sc  Sc18  1  0.00000000  0.00000000  0.50000000  1.0
  Sc  Sc19  1  0.00000000  0.00000000  0.00000000  1.0
  In  In20  1  0.88732831  0.11267169  0.25000000  1.0
  In  In21  1  0.88732831  0.77465963  0.25000000  1.0
  In  In22  1  0.22534037  0.11267169  0.25000000  1.0
  In  In23  1  0.11267169  0.88732831  0.75000000  1.0
  In  In24  1  0.11267169  0.22534037  0.75000000  1.0
  In  In25  1  0.77465963  0.88732831  0.75000000  1.0
  Ru  Ru26  1  0.33333300  0.66666700  0.25000000  1.0
  Ru  Ru27  1  0.66666700  0.33333300  0.75000000  1.0