data_[U1Hg3Te2Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  U  1.3800  1.7500  0.9913
  Hg  2.0000  1.5000  1.2450
  Te  2.1000  1.4000  1.2933
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [8.1358]
_cell_length_b [8.1358]
_cell_length_c [7.1858]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [UHg3(TeCl3)2]
_chemical_formula_sum '[U1 Hg3 Te2 Cl6]'
_cell_volume [411.9165]
_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
[
  U  U0  1  0.0000  0.0000  0.0000  1
  Hg  Hg1  3  0.0000  0.5000  0.5000  1
  Te  Te2  2  0.3333  0.6667  0.6939  1
  Cl  Cl3  6  0.1530  0.3060  0.2099  1
]