# generated using pymatgen
data_Te13Ir2I5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.63346436
_cell_length_b   9.63346626
_cell_length_c   9.80759596
_cell_angle_alpha   109.01548561
_cell_angle_beta   109.01548830
_cell_angle_gamma   108.03930868
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Te13Ir2I5
_chemical_formula_sum   'Te13 Ir2 I5'
_cell_volume   720.15544642
_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
  Te  Te0  1  0.98828056  0.51171944  0.25000000  1.0
  Te  Te1  1  0.93253681  0.18123521  0.18320077  1.0
  Te  Te2  1  0.18637315  0.93814638  0.16281468  1.0
  Te  Te3  1  0.16621855  0.19374738  0.94058982  1.0
  Te  Te4  1  0.70122877  0.66828490  0.44301648  1.0
  Te  Te5  1  0.43609989  0.68794501  0.66744042  1.0
  Te  Te6  1  0.66186895  0.43253996  0.68423085  1.0
  Te  Te7  1  0.06746004  0.83813105  0.81576915  1.0
  Te  Te8  1  0.81205499  0.06390011  0.83255958  1.0
  Te  Te9  1  0.83171510  0.79877123  0.05698352  1.0
  Te  Te10  1  0.30625262  0.33378145  0.55941018  1.0
  Te  Te11  1  0.56185362  0.31362685  0.33718532  1.0
  Te  Te12  1  0.31876479  0.56746319  0.31679923  1.0
  Ir  Ir13  1  0.24653079  0.25346921  0.25000000  1.0
  Ir  Ir14  1  0.75015620  0.74984380  0.75000000  1.0
  I  I15  1  0.24112876  0.97306434  0.50873610  1.0
  I  I16  1  0.52693566  0.25887124  0.99126390  1.0
  I  I17  1  0.77108291  0.02121411  0.48771508  1.0
  I  I18  1  0.47878589  0.72891709  0.01228492  1.0
  I  I19  1  0.01467096  0.48532904  0.75000000  1.0