data_Tl2CdP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.65
_cell_length_b   7.65
_cell_length_c   7.65
_cell_angle_alpha   151.36
_cell_angle_beta   149.44
_cell_angle_gamma   42.37
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl2CdP
_chemical_formula_sum   'Tl2 Cd1 P1'
_cell_volume   108.91
_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
  Tl  Tl2  1  0.0  0.02  0.63  1.0
  Tl  Tl3  1  0.89  0.0  0.51  1.0
  Cd  Cd0  1  0.0  0.0  0.14  1.0
  P  P1  1  0.0  0.0  0.0  1.0

data_Tl2CdP
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.78
_cell_length_b   4.03
_cell_length_c   7.65
_cell_angle_alpha   105.28
_cell_angle_beta   104.32
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl2CdP
_chemical_formula_sum   'Tl2 Cd1 P1'
_cell_volume   108.91
_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
  Tl  Tl0  1  0.0  0.51  0.62  1.0
  Tl  Tl1  1  0.98  0.61  0.61  1.0
  Cd  Cd2  1  0.0  0.14  0.14  1.0
  P  P3  1  0.0  0.0  0.0  1.0

Tl Tl Cd P