data_TaTlCd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.05
_cell_length_b   3.05
_cell_length_c   10.2
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   112.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaTlCd2
_chemical_formula_sum   'Ta1 Tl1 Cd2'
_cell_volume   88.07
_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
  Ta  Ta2  1  0.0  0.0  0.16  1.0
  Tl  Tl3  1  0.7  0.0  0.66  1.0
  Cd  Cd0  1  0.0  0.0  0.12  1.0
  Cd  Cd1  1  0.7  0.0  0.56  1.0

data_TaTlCd2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.05
_cell_length_b   3.05
_cell_length_c   10.2
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   112.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaTlCd2
_chemical_formula_sum   'Ta1 Tl1 Cd2'
_cell_volume   88.07
_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
  Ta  Ta0  1  0.0  0.0  0.16  1.0
  Tl  Tl1  1  0.7  0.0  0.66  1.0
  Cd  Cd2  1  0.0  0.0  0.12  1.0
  Cd  Cd3  1  0.7  0.0  0.56  1.0

Ta Tl Cd Cd