data_SnSe2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.16
_cell_length_b   4.34
_cell_length_c   6.3
_cell_angle_alpha   90.0
_cell_angle_beta   95.59
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SnSe2Cl
_chemical_formula_sum   'Sn1 Se2 Cl1'
_cell_volume   113.12
_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
  Sn  Sn3  1  0.45  0.17  0.88  1.0
  Se  Se1  1  0.7  0.17  0.38  1.0
  Se  Se2  1  0.68  0.0  0.0  1.0
  Cl  Cl0  1  0.65  0.0  0.14  1.0

data_SnSe2Cl
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.16
_cell_length_b   4.34
_cell_length_c   6.3
_cell_angle_alpha   90.0
_cell_angle_beta   95.59
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SnSe2Cl
_chemical_formula_sum   'Sn1 Se2 Cl1'
_cell_volume   113.12
_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
  Sn  Sn0  1  0.45  0.17  0.88  1.0
  Se  Se1  1  0.68  0.0  0.0  1.0
  Se  Se2  1  0.7  0.17  0.38  1.0
  Cl  Cl3  1  0.65  0.0  0.14  1.0

Sn Se Se Cl