# generated using pymatgen
data_Sc6CdSn6Ir5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.55780005
_cell_length_b   7.55780045
_cell_length_c   7.09600705
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999396
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc6CdSn6Ir5
_chemical_formula_sum   'Sc6 Cd1 Sn6 Ir5'
_cell_volume   351.02295263
_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  0.38191923  0.98453853  0.23929158  1.0
  Sc  Sc1  1  0.60261929  0.61808077  0.23929158  1.0
  Sc  Sc2  1  0.01546147  0.39738071  0.23929158  1.0
  Sc  Sc3  1  0.37596222  0.97274824  0.76174742  1.0
  Sc  Sc4  1  0.59678602  0.62403778  0.76174742  1.0
  Sc  Sc5  1  0.02725176  0.40321398  0.76174742  1.0
  Cd  Cd6  1  0.66666700  0.33333300  0.52092743  1.0
  Sn  Sn7  1  0.29032667  0.27804829  0.99919529  1.0
  Sn  Sn8  1  0.98772063  0.70967333  0.99919529  1.0
  Sn  Sn9  1  0.00463507  0.74358287  0.49814332  1.0
  Sn  Sn10  1  0.73894680  0.99536493  0.49814332  1.0
  Sn  Sn11  1  0.25641713  0.26105320  0.49814332  1.0
  Sn  Sn12  1  0.72195171  0.01227937  0.99919529  1.0
  Ir  Ir13  1  0.00000000  0.00000000  0.77078217  1.0
  Ir  Ir14  1  0.00000000  0.00000000  0.22652172  1.0
  Ir  Ir15  1  0.66666700  0.33333300  0.98710615  1.0
  Ir  Ir16  1  0.33333300  0.66666700  0.49188950  1.0
  Ir  Ir17  1  0.33333300  0.66666700  0.00764018  1.0