data_CdGaTc2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.68
_cell_length_b   4.68
_cell_length_c   4.68
_cell_angle_alpha   127.06
_cell_angle_beta   127.06
_cell_angle_gamma   78.15
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdGaTc2
_chemical_formula_sum   'Cd1 Ga1 Tc2'
_cell_volume   63.24
_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  0.09  0.82  1.0
  Ga  Ga1  1  0.0  0.0  0.0  1.0
  Tc  Tc2  1  0.09  0.0  0.82  1.0
  Tc  Tc3  1  0.0  0.0  0.63  1.0

data_CdGaTc2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.17
_cell_length_b   4.17
_cell_length_c   4.68
_cell_angle_alpha   116.47
_cell_angle_beta   116.47
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdGaTc2
_chemical_formula_sum   'Cd1 Ga1 Tc2'
_cell_volume   63.24
_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  0.73  0.82  0.73  1.0
  Ga  Ga1  1  0.0  0.0  0.0  1.0
  Tc  Tc2  1  0.63  0.63  0.63  1.0
  Tc  Tc3  1  0.82  0.73  0.73  1.0

Cd Ga Tc Tc