# generated using pymatgen
data_Sc6Al8IrOs3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.15115078
_cell_length_b   9.06830882
_cell_length_c   8.43477800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.77126161
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc6Al8IrOs3
_chemical_formula_sum   'Sc12 Al16 Ir2 Os6'
_cell_volume   607.57893370
_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
  Sc  Sc0  1  0.34178229  0.01733292  0.06154862  1.0
  Sc  Sc1  1  0.65821771  0.98266708  0.93845138  1.0
  Sc  Sc2  1  0.99951497  0.33438318  0.05720324  1.0
  Sc  Sc3  1  0.65821771  0.98266708  0.56154862  1.0
  Sc  Sc4  1  0.99951497  0.33438318  0.44279676  1.0
  Sc  Sc5  1  0.00048503  0.66561682  0.94279676  1.0
  Sc  Sc6  1  0.34178229  0.01733292  0.43845138  1.0
  Sc  Sc7  1  0.00048503  0.66561682  0.55720324  1.0
  Sc  Sc8  1  0.66496261  0.66656775  0.06273760  1.0
  Sc  Sc9  1  0.33503739  0.33343225  0.93726240  1.0
  Sc  Sc10  1  0.33503739  0.33343225  0.56273760  1.0
  Sc  Sc11  1  0.66496261  0.66656775  0.43726240  1.0
  Al  Al12  1  0.34189136  0.84183874  0.75000000  1.0
  Al  Al13  1  0.65416508  0.50182215  0.75000000  1.0
  Al  Al14  1  0.65810864  0.15816126  0.25000000  1.0
  Al  Al15  1  0.34583492  0.49817785  0.25000000  1.0
  Al  Al16  1  0.83095604  0.33271759  0.75000000  1.0
  Al  Al17  1  0.16904396  0.66728241  0.25000000  1.0
  Al  Al18  1  0.33759125  0.66255416  0.50458985  1.0
  Al  Al19  1  0.66240875  0.33744584  0.49541015  1.0
  Al  Al20  1  0.66240875  0.33744584  0.00458985  1.0
  Al  Al21  1  0.33759125  0.66255416  0.99541015  1.0
  Al  Al22  1  0.17794476  0.01208817  0.75000000  1.0
  Al  Al23  1  0.82205524  0.98791183  0.25000000  1.0
  Al  Al24  1  0.01133869  0.17734104  0.75000000  1.0
  Al  Al25  1  0.98866131  0.82265896  0.25000000  1.0
  Al  Al26  1  0.82828252  0.83409804  0.75000000  1.0
  Al  Al27  1  0.17171748  0.16590196  0.25000000  1.0
  Ir  Ir28  1  0.00000000  0.00000000  0.50000000  1.0
  Ir  Ir29  1  0.00000000  0.00000000  0.00000000  1.0
  Os  Os30  1  0.14953336  0.49964327  0.75000000  1.0
  Os  Os31  1  0.85046664  0.50035673  0.25000000  1.0
  Os  Os32  1  0.50399890  0.67035859  0.75000000  1.0
  Os  Os33  1  0.50157426  0.16586435  0.75000000  1.0
  Os  Os34  1  0.49600110  0.32964141  0.25000000  1.0
  Os  Os35  1  0.49842574  0.83413565  0.25000000  1.0