# generated using pymatgen
data_Sn4Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.30565029
_cell_length_b   6.30565046
_cell_length_c   12.50036787
_cell_angle_alpha   104.60883776
_cell_angle_beta   104.60884099
_cell_angle_gamma   90.00000313
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sn4Ir
_chemical_formula_sum   'Sn16 Ir4'
_cell_volume   464.33652332
_cell_formula_units_Z   4
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
  Sn  Sn0  1  0.86493303  0.11708082  0.87808490  1.0
  Sn  Sn1  1  0.23899592  0.48684713  0.62191510  1.0
  Sn  Sn2  1  0.88291918  0.13506697  0.62191510  1.0
  Sn  Sn3  1  0.98684713  0.38291918  0.12191510  1.0
  Sn  Sn4  1  0.48684713  0.23899592  0.12191510  1.0
  Sn  Sn5  1  0.38291918  0.98684713  0.62191510  1.0
  Sn  Sn6  1  0.73899592  0.63506697  0.62191510  1.0
  Sn  Sn7  1  0.36493303  0.26100408  0.87808490  1.0
  Sn  Sn8  1  0.01315287  0.61708082  0.87808490  1.0
  Sn  Sn9  1  0.11708082  0.86493303  0.37808490  1.0
  Sn  Sn10  1  0.76100408  0.51315287  0.37808490  1.0
  Sn  Sn11  1  0.13506697  0.88291918  0.12191510  1.0
  Sn  Sn12  1  0.51315287  0.76100408  0.87808490  1.0
  Sn  Sn13  1  0.61708082  0.01315287  0.37808490  1.0
  Sn  Sn14  1  0.26100408  0.36493303  0.37808490  1.0
  Sn  Sn15  1  0.63506697  0.73899592  0.12191510  1.0
  Ir  Ir16  1  0.37500000  0.62500000  0.25000000  1.0
  Ir  Ir17  1  0.12500000  0.87500000  0.75000000  1.0
  Ir  Ir18  1  0.62500000  0.37500000  0.75000000  1.0
  Ir  Ir19  1  0.87500000  0.12500000  0.25000000  1.0