# generated using pymatgen
data_Sc6AgSn6Ir5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.51665886
_cell_length_b   7.51665890
_cell_length_c   7.10086250
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999984
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc6AgSn6Ir5
_chemical_formula_sum   'Sc6 Ag1 Sn6 Ir5'
_cell_volume   347.44928255
_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  0.38404673  0.98354604  0.24334764  1.0
  Sc  Sc1  1  0.59949831  0.61595327  0.24334764  1.0
  Sc  Sc2  1  0.01645396  0.40050169  0.24334764  1.0
  Sc  Sc3  1  0.38351757  0.98257252  0.75678146  1.0
  Sc  Sc4  1  0.59905595  0.61648243  0.75678146  1.0
  Sc  Sc5  1  0.01742748  0.40094405  0.75678146  1.0
  Ag  Ag6  1  0.66666700  0.33333300  0.50193229  1.0
  Sn  Sn7  1  0.28678882  0.27769885  0.99992875  1.0
  Sn  Sn8  1  0.99091003  0.71321118  0.99992875  1.0
  Sn  Sn9  1  0.99980282  0.73739477  0.49990950  1.0
  Sn  Sn10  1  0.73759095  0.00019718  0.49990950  1.0
  Sn  Sn11  1  0.26260523  0.26240905  0.49990950  1.0
  Sn  Sn12  1  0.72230115  0.00908997  0.99992875  1.0
  Ir  Ir13  1  0.00000000  0.00000000  0.76933363  1.0
  Ir  Ir14  1  0.00000000  0.00000000  0.23051028  1.0
  Ir  Ir15  1  0.66666700  0.33333300  0.99839437  1.0
  Ir  Ir16  1  0.33333300  0.66666700  0.49898033  1.0
  Ir  Ir17  1  0.33333300  0.66666700  0.00094703  1.0