data_CdFe2Tc
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.81
_cell_length_b   4.81
_cell_length_c   4.66
_cell_angle_alpha   105.11
_cell_angle_beta   105.11
_cell_angle_gamma   33.71
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdFe2Tc
_chemical_formula_sum   'Cd1 Fe2 Tc1'
_cell_volume   57.55
_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
  Cd  Cd0  1  0.55  0.0  0.03  1.0
  Fe  Fe1  1  0.77  0.0  0.41  1.0
  Fe  Fe2  1  0.45  0.0  0.32  1.0
  Tc  Tc3  1  0.06  0.0  0.45  1.0

data_CdFe2Tc
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.79
_cell_length_b   4.66
_cell_length_c   4.81
_cell_angle_alpha   105.11
_cell_angle_beta   106.85
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdFe2Tc
_chemical_formula_sum   'Cd1 Fe2 Tc1'
_cell_volume   57.55
_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
  Cd  Cd0  1  0.0  0.03  0.55  1.0
  Fe  Fe1  1  0.0  0.32  0.45  1.0
  Fe  Fe2  1  0.0  0.41  0.77  1.0
  Tc  Tc3  1  0.0  0.45  0.06  1.0

Cd Fe Fe Tc