data_TlSb2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.55
_cell_length_b   10.55
_cell_length_c   10.55
_cell_angle_alpha   18.73
_cell_angle_beta   18.73
_cell_angle_gamma   18.73
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlSb2Cl
_chemical_formula_sum   'Tl1 Sb2 Cl1'
_cell_volume   105.71
_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  Tl3  1  0.0  0.0  0.54  1.0
  Sb  Sb1  1  0.0  0.0  0.94  1.0
  Sb  Sb2  1  0.0  0.0  0.14  1.0
  Cl  Cl0  1  0.0  0.0  0.0  1.0

data_TlSb2Cl
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.95
_cell_length_b   3.43
_cell_length_c   10.55
_cell_angle_alpha   90.0
_cell_angle_beta   100.83
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   TlSb2Cl
_chemical_formula_sum   'Tl2 Sb4 Cl2'
_cell_volume   211.41
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.46  1.0
  Sb  Sb1  2  0.0  0.0  0.06  1.0
  Sb  Sb2  2  0.0  0.0  0.86  1.0
  Cl  Cl3  2  0.0  0.0  0.0  1.0

Tl Sb Sb Cl