data_FePbCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.34
_cell_length_b   6.34
_cell_length_c   5.62
_cell_angle_alpha   109.5
_cell_angle_beta   109.5
_cell_angle_gamma   30.68
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FePbCl2
_chemical_formula_sum   'Fe1 Pb1 Cl2'
_cell_volume   108.2
_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
  Fe  Fe2  1  0.0  0.0  0.0  1.0
  Pb  Pb3  1  0.14  0.0  0.64  1.0
  Cl  Cl0  1  0.72  0.0  0.29  1.0
  Cl  Cl1  1  0.57  0.0  0.99  1.0

data_FePbCl2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.36
_cell_length_b   5.62
_cell_length_c   6.34
_cell_angle_alpha   109.5
_cell_angle_beta   105.34
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FePbCl2
_chemical_formula_sum   'Fe1 Pb1 Cl2'
_cell_volume   108.2
_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
  Fe  Fe0  1  0.0  0.0  0.0  1.0
  Pb  Pb1  1  0.0  0.64  0.14  1.0
  Cl  Cl2  1  0.0  0.29  0.72  1.0
  Cl  Cl3  1  0.0  0.99  0.57  1.0

Fe Pb Cl Cl
Fe Pb Cl Cl 0 2 - o o 0 3 - o - 0 1 o o - 1 2 - o o 1 3 o o o 2 3 o o - 