data_[Sb2H2S4Br2]
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
  S  2.5800  1.0000  0.8800
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.6571]
_cell_length_b [4.3827]
_cell_length_c [9.2797]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.9916]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [SbHS2Br]
_chemical_formula_sum '[Sb2 H2 S4 Br2]'
_cell_volume [294.4669]
_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  0.0261  0.2500  0.6736  1.0
  H  H1  2  0.3696  0.2500  0.0704  1.0
  S  S2  2  0.1934  0.7500  0.5895  1.0
  S  S3  2  0.4638  0.2500  0.9696  1.0
  Br  Br4  2  0.1964  0.2500  0.2553  1.0
]