data_ReTc2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.87
_cell_length_b   3.87
_cell_length_c   3.87
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ReTc2Rh
_chemical_formula_sum   'Re1 Tc2 Rh1'
_cell_volume   58.13
_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
  Re  Re0  1  0.94  0.94  0.0  1.0
  Tc  Tc2  1  0.0  0.94  0.94  1.0
  Tc  Tc3  1  0.94  0.0  0.94  1.0
  Rh  Rh1  1  0.0  0.0  0.0  1.0

data_ReTc2Rh
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.48
_cell_length_b   5.48
_cell_length_c   3.87
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   ReTc2Rh
_chemical_formula_sum   'Re2 Tc4 Rh2'
_cell_volume   116.27
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  4  0.47  0.47  0.94  1.0
  Re  Re1  2  0.44  0.5  -0.0  1.0
  Rh  Rh2  2  0.0  0.0  0.0  1.0

Re Tc Tc Rh
Re Tc Tc Rh 0 1 + o - 0 2 o + - 0 3 + + o 1 2 - + o 1 3 o + + 2 3 + o + 