data_TeAsIr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.95
_cell_length_b   3.95
_cell_length_c   6.11
_cell_angle_alpha   108.53
_cell_angle_beta   108.53
_cell_angle_gamma   58.68
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TeAsIr2
_chemical_formula_sum   'Te1 As1 Ir2'
_cell_volume   75.75
_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  Te3  1  0.33  0.0  0.84  1.0
  As  As0  1  0.0  0.0  0.0  1.0
  Ir  Ir1  1  0.61  0.0  0.97  1.0
  Ir  Ir2  1  0.05  0.0  0.72  1.0

data_TeAsIr2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.87
_cell_length_b   3.95
_cell_length_c   6.11
_cell_angle_alpha   108.53
_cell_angle_beta   90.0
_cell_angle_gamma   119.34
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TeAsIr2
_chemical_formula_sum   'Te1 As1 Ir2'
_cell_volume   75.75
_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  0.0  0.67  0.16  1.0
  As  As1  1  0.0  0.0  0.0  1.0
  Ir  Ir2  1  0.0  0.39  0.03  1.0
  Ir  Ir3  1  0.0  0.95  0.28  1.0

Te As Ir Ir