data_[K1Hg2Rh1Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Hg  2.0000  1.5000  1.2450
  Rh  2.2800  1.3500  0.7450
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.5870]
_cell_length_b [7.4117]
_cell_length_c [8.4150]
_cell_angle_alpha [67.3167]
_cell_angle_beta [86.6470]
_cell_angle_gamma [82.3859]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [KHg2RhCl8]
_chemical_formula_sum '[K1 Hg2 Rh1 Cl8]'
_cell_volume [375.6982]
_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
[
  K  K0  1  0.0000  0.5000  0.5000  1.0
  Hg  Hg1  2  0.4860  0.9743  0.7392  1.0
  Rh  Rh2  1  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  2  0.1464  0.9152  0.2736  1.0
  Cl  Cl4  2  0.2297  0.7547  0.9465  1.0
  Cl  Cl5  2  0.2434  0.2230  0.8763  1.0
  Cl  Cl6  2  0.4146  0.2665  0.4267  1.0
]