data_TlPCl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.03
_cell_length_b   5.03
_cell_length_c   10.07
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlPCl3
_chemical_formula_sum   'Tl2 P2 Cl6'
_cell_volume   255.19
_cell_formula_units_Z   2
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  Tl8  1  0.56  0.95  0.56  1.0
  Tl  Tl9  1  0.56  0.05  0.52  1.0
  P  P6  1  0.0  0.0  0.0  1.0
  P  P7  1  0.0  0.0  0.04  1.0
  Cl  Cl0  1  0.56  0.45  0.56  1.0
  Cl  Cl1  1  0.56  0.55  0.52  1.0
  Cl  Cl2  1  0.78  0.22  0.0  1.0
  Cl  Cl3  1  0.78  0.78  0.0  1.0
  Cl  Cl4  1  0.78  0.22  0.04  1.0
  Cl  Cl5  1  0.78  0.78  0.04  1.0

data_TlPCl3
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.03
_cell_length_b   5.03
_cell_length_c   10.07
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlPCl3
_chemical_formula_sum   'Tl2 P2 Cl6'
_cell_volume   255.19
_cell_formula_units_Z   2
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  0.56  0.05  0.52  1.0
  Tl  Tl1  1  0.56  0.95  0.56  1.0
  P  P2  1  0.0  0.0  0.0  1.0
  P  P3  1  0.0  0.0  0.04  1.0
  Cl  Cl4  1  0.56  0.55  0.52  1.0
  Cl  Cl5  1  0.56  0.45  0.56  1.0
  Cl  Cl6  1  0.78  0.22  0.0  1.0
  Cl  Cl7  1  0.78  0.22  0.04  1.0
  Cl  Cl8  1  0.78  0.78  0.0  1.0
  Cl  Cl9  1  0.78  0.78  0.04  1.0

Tl Tl P P Cl Cl Cl Cl Cl Cl