# generated using pymatgen
data_In3Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.34121561
_cell_length_b   7.52428899
_cell_length_c   8.35523248
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In3Ir
_chemical_formula_sum   'In12 Ir4'
_cell_volume   335.78718325
_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
  In  In0  1  0.63482750  0.33087050  0.55431079  1.0
  In  In1  1  0.08183104  0.48942782  0.75000000  1.0
  In  In2  1  0.86517250  0.83087050  0.94568921  1.0
  In  In3  1  0.91816896  0.51057218  0.25000000  1.0
  In  In4  1  0.13482750  0.16912950  0.05431079  1.0
  In  In5  1  0.41816896  0.98942782  0.75000000  1.0
  In  In6  1  0.36517250  0.66912950  0.44568921  1.0
  In  In7  1  0.58183104  0.01057218  0.25000000  1.0
  In  In8  1  0.86517250  0.83087050  0.55431079  1.0
  In  In9  1  0.63482750  0.33087050  0.94568921  1.0
  In  In10  1  0.13482750  0.16912950  0.44568921  1.0
  In  In11  1  0.36517250  0.66912950  0.05431079  1.0
  Ir  Ir12  1  0.43806030  0.37291040  0.25000000  1.0
  Ir  Ir13  1  0.56193970  0.62708960  0.75000000  1.0
  Ir  Ir14  1  0.93806030  0.12708960  0.75000000  1.0
  Ir  Ir15  1  0.06193970  0.87291040  0.25000000  1.0