data_InRe2Tc
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.01
_cell_length_b   5.01
_cell_length_c   4.79
_cell_angle_alpha   103.14
_cell_angle_beta   103.14
_cell_angle_gamma   33.81
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InRe2Tc
_chemical_formula_sum   'In1 Re2 Tc1'
_cell_volume   65.0
_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
  In  In0  1  0.23  0.0  0.33  1.0
  Re  Re1  1  0.66  0.0  0.62  1.0
  Re  Re2  1  0.8  0.0  0.03  1.0
  Tc  Tc3  1  0.0  0.0  0.0  1.0

data_InRe2Tc
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.91
_cell_length_b   4.79
_cell_length_c   5.01
_cell_angle_alpha   103.14
_cell_angle_beta   106.9
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InRe2Tc
_chemical_formula_sum   'In1 Re2 Tc1'
_cell_volume   65.0
_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
  In  In0  1  0.0  0.33  0.23  1.0
  Tc  Tc1  1  0.0  0.0  0.0  1.0
  Re  Re2  1  0.0  0.03  0.8  1.0
  Re  Re3  1  0.0  0.62  0.66  1.0

In Re Re Tc
In Re Re Tc 0 3 o o o 0 1 o o o 1 3 + o + 1 2 o o + 2 3 + o o 