data_[Sm4P1S2Cl1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  P  2.1900  1.0000  0.5500
  S  2.5800  1.0000  0.8800
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [6.9933]
_cell_length_b [4.0590]
_cell_length_c [7.0636]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4979]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Sm4PS2Cl]
_chemical_formula_sum '[Sm4 P1 S2 Cl1]'
_cell_volume [189.0048]
_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
[
  Sm  Sm0  2  0.2559  0.5000  0.2315  1
  Sm  Sm1  2  0.2716  0.0000  0.7778  1
  P  P2  1  0.0000  0.0000  0.0000  1
  S  S3  1  0.5000  0.0000  0.5000  1
  S  S4  1  0.5000  0.5000  0.0000  1
  Cl  Cl5  1  0.0000  0.5000  0.5000  1
]