data_Tc2SbAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.99
_cell_length_b   4.99
_cell_length_c   4.99
_cell_angle_alpha   131.87
_cell_angle_beta   131.87
_cell_angle_gamma   70.43
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tc2SbAu
_chemical_formula_sum   'Tc2 Sb1 Au1'
_cell_volume   67.43
_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  0.0  0.03  0.04  1.0
  Tc  Tc3  1  0.0  0.0  0.0  1.0
  Sb  Sb1  1  0.0  0.0  0.07  1.0
  Au  Au0  1  0.03  0.0  0.04  1.0

data_Tc2SbAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.07
_cell_length_b   4.07
_cell_length_c   4.99
_cell_angle_alpha   114.06
_cell_angle_beta   114.06
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tc2SbAu
_chemical_formula_sum   'Tc2 Sb1 Au1'
_cell_volume   67.43
_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  0.0  0.0  1.0
  Tc  Tc1  1  0.0  0.04  0.0  1.0
  Sb  Sb2  1  0.07  0.07  0.07  1.0
  Au  Au3  1  0.04  0.0  0.0  1.0

Tc Tc Sb Au
Tc Tc Sb Au 0 1 o o o 0 2 o o o 1 3 o o o 1 2 o o o 2 3 o o o 