data_[Rb1Hg2Sb2S6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Hg  2.0000  1.5000  1.2450
  Sb  2.0500  1.4500  0.8300
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.8957]
_cell_length_b [7.2749]
_cell_length_c [8.5054]
_cell_angle_alpha [114.9000]
_cell_angle_beta [93.4104]
_cell_angle_gamma [96.4667]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [RbHg2(SbS3)2]
_chemical_formula_sum '[Rb1 Hg2 Sb2 S6]'
_cell_volume [381.8327]
_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
[
  Rb  Rb0  1  0.5000  0.5000  0.0000  1.0
  Hg  Hg1  2  0.0325  0.7795  0.7260  1.0
  Sb  Sb2  2  0.4720  0.2062  0.4317  1.0
  S  S3  2  0.2414  0.0483  0.1606  1.0
  S  S4  2  0.2745  0.5477  0.6509  1.0
  S  S5  2  0.3059  0.0524  0.6400  1.0
]