data_[Tc4Hg8Br24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tc  1.9000  1.3500  0.7417
  Hg  2.0000  1.5000  1.2450
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [15.2333]
_cell_length_b [15.1358]
_cell_length_c [7.1546]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.1654]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Tc(HgBr3)2]
_chemical_formula_sum '[Tc4 Hg8 Br24]'
_cell_volume [1493.0385]
_cell_formula_units_Z [4]
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
[
  Tc  Tc0  4  0.0000  0.2157  0.7500  1
  Hg  Hg1  8  0.2239  0.4242  0.8899  1
  Br  Br2  8  0.0954  0.1121  0.0657  1
  Br  Br3  8  0.1037  0.3074  0.6096  1
  Br  Br4  8  0.1889  0.4115  0.2224  1
]