data_Tc2IrAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.85
_cell_length_b   4.85
_cell_length_c   4.79
_cell_angle_alpha   99.6
_cell_angle_beta   99.6
_cell_angle_gamma   33.43
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tc2IrAu
_chemical_formula_sum   'Tc2 Ir1 Au1'
_cell_volume   61.07
_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
  Tc  Tc2  1  0.74  0.0  0.62  1.0
  Tc  Tc3  1  0.72  0.0  0.09  1.0
  Ir  Ir1  1  0.0  0.0  0.0  1.0
  Au  Au0  1  0.23  0.0  0.36  1.0

data_Tc2IrAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.79
_cell_length_b   4.79
_cell_length_c   4.85
_cell_angle_alpha   99.6
_cell_angle_beta   106.72
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tc2IrAu
_chemical_formula_sum   'Tc2 Ir1 Au1'
_cell_volume   61.07
_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
  Tc  Tc0  1  0.0  0.09  0.72  1.0
  Tc  Tc1  1  0.0  0.62  0.74  1.0
  Ir  Ir2  1  0.0  0.0  0.0  1.0
  Au  Au3  1  0.0  0.36  0.23  1.0

Tc Tc Ir Au