data_Tc2WAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.87
_cell_length_b   4.87
_cell_length_c   4.87
_cell_angle_alpha   132.35
_cell_angle_beta   132.01
_cell_angle_gamma   69.94
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tc2WAu
_chemical_formula_sum   'Tc2 W1 Au1'
_cell_volume   62.11
_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  Tc1  1  0.0  0.0  0.96  1.0
  Tc  Tc2  1  0.97  0.0  0.05  1.0
  W  W3  1  0.0  0.0  0.96  1.0
  Au  Au0  1  0.0  0.98  0.98  1.0

data_Tc2WAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.93
_cell_length_b   3.96
_cell_length_c   4.87
_cell_angle_alpha   113.99
_cell_angle_beta   113.83
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tc2WAu
_chemical_formula_sum   'Tc2 W1 Au1'
_cell_volume   62.11
_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  0.04  0.04  0.04  1.0
  Tc  Tc1  1  0.91  0.95  0.91  1.0
  W  W2  1  0.04  0.04  0.04  1.0
  Au  Au3  1  0.02  1.0  1.0  1.0

Tc Tc W Au 0 2 o o o 0 3 o - o 1 3 + - - 2 3 o - o 