data_CdTcSn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.31
_cell_length_b   3.38
_cell_length_c   7.68
_cell_angle_alpha   90.0
_cell_angle_beta   98.08
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdTcSn2
_chemical_formula_sum   'Cd1 Tc1 Sn2'
_cell_volume   85.13
_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
  Cd  Cd0  1  0.46  0.0  0.8  1.0
  Tc  Tc3  1  0.0  0.0  0.0  1.0
  Sn  Sn1  1  0.65  0.69  0.07  1.0
  Sn  Sn2  1  0.58  0.69  0.54  1.0

data_CdTcSn2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.31
_cell_length_b   3.38
_cell_length_c   7.68
_cell_angle_alpha   90.0
_cell_angle_beta   98.08
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdTcSn2
_chemical_formula_sum   'Cd1 Tc1 Sn2'
_cell_volume   85.13
_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
  Cd  Cd0  1  0.46  0.0  0.8  1.0
  Tc  Tc1  1  0.0  0.0  0.0  1.0
  Sn  Sn2  1  0.58  0.69  0.54  1.0
  Sn  Sn3  1  0.65  0.69  0.07  1.0

Cd Tc Sn Sn
Cd Tc Sn Sn 0 1 o o + 0 1 + o + 0 3 o - o 0 2 o - + 1 2 - - o 