data_[Sb4H48C12N6Cl18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sb  2.0500  1.4500  0.8300
  H  2.2000  0.2500  0.0000
  C  2.5500  0.7000  0.3000
  N  3.0400  0.6500  0.6300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Pc]
_cell_length_a [9.3597]
_cell_length_b [9.0052]
_cell_length_c [14.1472]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.6776]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [7]
_chemical_formula_structural [Sb2H24C6(NCl3)3]
_chemical_formula_sum '[Sb4 H48 C12 N6 Cl18]'
_cell_volume [1186.5589]
_cell_formula_units_Z [2]
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  2  0.0001  0.2936  0.4999  1
  Sb  Sb1  2  0.6765  0.2022  0.8353  1
  H  H2  2  0.0189  0.1588  0.1062  1
  H  H3  2  0.0459  0.2175  0.8981  1
  H  H4  2  0.1009  0.0147  0.3212  1
  H  H5  2  0.1077  0.2192  0.7381  1
  H  H6  2  0.1385  0.3843  0.8699  1
  H  H7  2  0.2282  0.0156  0.2333  1
  H  H8  2  0.2324  0.2398  0.9387  1
  H  H9  2  0.2832  0.2412  0.7746  1
  H  H10  2  0.2883  0.0060  0.8571  1
  H  H11  2  0.3481  0.3841  0.4379  1
  H  H12  2  0.4525  0.2793  0.5867  1
  H  H13  2  0.4558  0.1426  0.4360  1
  H  H14  2  0.4608  0.4778  0.5856  1
  H  H15  2  0.4706  0.2451  0.3283  1
  H  H16  2  0.5007  0.4664  0.4187  1
  H  H17  2  0.6182  0.3705  0.5677  1
  H  H18  2  0.6220  0.2290  0.4163  1
  H  H19  2  0.6575  0.2952  0.1540  1
  H  H20  2  0.7310  0.4499  0.2236  1
  H  H21  2  0.7529  0.2633  0.2685  1
  H  H22  2  0.8306  0.1252  0.0789  1
  H  H23  2  0.8758  0.3837  0.0985  1
  H  H24  2  0.9126  0.0927  0.1969  1
  H  H25  2  0.9664  0.3580  0.2068  1
  C  C26  2  0.1485  0.2644  0.8814  1
  C  C27  2  0.2024  0.0300  0.8011  1
  C  C28  2  0.5010  0.3760  0.5556  1
  C  C29  2  0.5049  0.2383  0.4043  1
  C  C30  2  0.7457  0.3334  0.2049  1
  C  C31  2  0.9136  0.1627  0.1337  1
  N  N32  2  0.1878  0.1939  0.7925  1
  N  N33  2  0.4590  0.3748  0.4516  1
  N  N34  2  0.8821  0.3184  0.1601  1
  Cl  Cl35  2  0.1260  0.3381  0.3432  1
  Cl  Cl36  2  0.1538  0.4904  0.5762  1
  Cl  Cl37  2  0.1896  0.1073  0.5516  1
  Cl  Cl38  2  0.4761  0.3986  0.7830  1
  Cl  Cl39  2  0.5403  0.1535  0.9706  1
  Cl  Cl40  2  0.5453  0.0317  0.7243  1
  Cl  Cl41  2  0.8021  0.4652  0.9549  1
  Cl  Cl42  2  0.8468  0.0236  0.3949  1
  Cl  Cl43  2  0.8878  0.2668  0.6685  1
]