data_[Sb4N12Cl16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sb  2.0500  1.4500  0.8300
  N  3.0400  0.6500  0.6300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [8.4808]
_cell_length_b [9.8085]
_cell_length_c [13.1713]
_cell_angle_alpha [90.0000]
_cell_angle_beta [126.4288]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [SbN3Cl4]
_chemical_formula_sum '[Sb4 N12 Cl16]'
_cell_volume [881.5406]
_cell_formula_units_Z [4]
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
[
  Sb  Sb0  4  0.0427  0.6826  0.4867  1
  N  N1  4  0.0909  0.5149  0.6204  1
  N  N2  4  0.2381  0.5136  0.7317  1
  N  N3  4  0.3707  0.5130  0.8355  1
  Cl  Cl4  4  0.0622  0.1977  0.6987  1
  Cl  Cl5  4  0.2089  0.6531  0.1475  1
  Cl  Cl6  4  0.2562  0.2300  0.0440  1
  Cl  Cl7  4  0.3375  0.6165  0.5185  1
]