# generated using pymatgen
data_Te2Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.02740481
_cell_length_b   5.40559745
_cell_length_c   10.22520150
_cell_angle_alpha   90.36961338
_cell_angle_beta   101.35779704
_cell_angle_gamma   90.00000709
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Te2Ir
_chemical_formula_sum   'Te6 Ir3'
_cell_volume   218.24387802
_cell_formula_units_Z   3
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  0.87896449  0.28660008  0.75792898  1.0
  Te  Te1  1  0.12103551  0.71339992  0.24207102  1.0
  Te  Te2  1  0.78075042  0.76173856  0.56150184  1.0
  Te  Te3  1  0.54423134  0.22191677  0.08846368  1.0
  Te  Te4  1  0.45576866  0.77808323  0.91153632  1.0
  Te  Te5  1  0.21924958  0.23826144  0.43849816  1.0
  Ir  Ir6  1  0.00000000  0.50000000  0.00000000  1.0
  Ir  Ir7  1  0.34070863  0.00198378  0.68141626  1.0
  Ir  Ir8  1  0.65929137  0.99801622  0.31858374  1.0