data_CdTc2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.0
_cell_length_b   5.0
_cell_length_c   5.0
_cell_angle_alpha   129.36
_cell_angle_beta   129.36
_cell_angle_gamma   74.43
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdTc2Pb
_chemical_formula_sum   'Cd1 Tc2 Pb1'
_cell_volume   72.73
_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  0.0  0.98  1.0
  Tc  Tc2  1  0.0  0.0  0.0  1.0
  Tc  Tc3  1  0.14  0.0  0.99  1.0
  Pb  Pb1  1  0.0  0.14  0.99  1.0

data_CdTc2Pb
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.27
_cell_length_b   4.27
_cell_length_c   5.0
_cell_angle_alpha   115.32
_cell_angle_beta   115.32
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdTc2Pb
_chemical_formula_sum   'Cd1 Tc2 Pb1'
_cell_volume   72.73
_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  0.98  0.98  0.98  1.0
  Tc  Tc1  1  0.0  0.0  0.0  1.0
  Tc  Tc2  1  0.99  0.85  0.85  1.0
  Pb  Pb3  1  0.85  0.99  0.85  1.0

Cd Tc Tc Pb