data_ReTc3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.52
_cell_length_b   5.52
_cell_length_c   8.88
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ReTc3
_chemical_formula_sum   'Re4 Tc12'
_cell_volume   234.56
_cell_formula_units_Z   4
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
  Re  Re0  1  0.0  0.0  0.0  1.0
  Re  Re1  1  0.0  0.0  0.44  1.0
  Re  Re2  1  0.0  0.19  0.22  1.0
  Re  Re3  1  0.76  0.59  0.66  1.0
  Tc  Tc4  1  0.62  0.39  0.0  1.0
  Tc  Tc5  1  0.62  0.39  0.44  1.0
  Tc  Tc6  1  0.0  0.59  0.66  1.0
  Tc  Tc7  1  0.62  0.99  0.66  1.0
  Tc  Tc8  1  0.38  0.8  0.22  1.0
  Tc  Tc9  1  0.76  0.0  0.0  1.0
  Tc  Tc10  1  0.76  0.0  0.44  1.0
  Tc  Tc11  1  0.38  0.39  0.0  1.0
  Tc  Tc12  1  0.38  0.39  0.44  1.0
  Tc  Tc13  1  0.38  0.99  0.66  1.0
  Tc  Tc14  1  0.15  0.8  0.22  1.0
  Tc  Tc15  1  0.76  0.19  0.22  1.0

data_ReTc3
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.52
_cell_length_b   5.52
_cell_length_c   8.88
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ReTc3
_chemical_formula_sum   'Re4 Tc12'
_cell_volume   234.56
_cell_formula_units_Z   4
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
  Re  Re0  1  -0.0  0.19  0.22  1.0
  Tc  Tc1  1  -0.0  0.59  0.66  1.0
  Re  Re2  1  0.0  0.0  0.0  1.0
  Re  Re3  1  0.0  0.0  0.44  1.0
  Tc  Tc4  1  0.15  0.8  0.22  1.0
  Tc  Tc5  1  0.38  0.8  0.22  1.0
  Tc  Tc6  1  0.38  0.39  -0.0  1.0
  Tc  Tc7  1  0.38  0.39  0.44  1.0
  Tc  Tc8  1  0.38  0.99  0.66  1.0
  Tc  Tc9  1  0.62  0.99  0.66  1.0
  Tc  Tc10  1  0.62  0.39  -0.0  1.0
  Tc  Tc11  1  0.62  0.39  0.44  1.0
  Tc  Tc12  1  0.76  0.0  0.0  1.0
  Tc  Tc13  1  0.76  0.0  0.44  1.0
  Tc  Tc14  1  0.76  0.19  0.22  1.0
  Re  Re15  1  0.76  0.59  0.66  1.0

Re Re Re Re Tc Tc Tc Tc Tc Tc Tc Tc Tc Tc Tc Tc