data_[Pr2Tm6Hg12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Tm  1.2500  1.7500  1.0950
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [9.1522]
_cell_length_b [5.1640]
_cell_length_c [11.1817]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.0432]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Pr(TmHg2)3]
_chemical_formula_sum '[Pr2 Tm6 Hg12]'
_cell_volume [505.2652]
_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
[
  Pr  Pr0  2  0.0674  0.2500  0.3845  1
  Tm  Tm1  2  0.2325  0.2500  0.0021  1
  Tm  Tm2  2  0.3523  0.7500  0.8087  1
  Tm  Tm3  2  0.4871  0.2500  0.6116  1
  Hg  Hg4  2  0.0631  0.7500  0.9123  1
  Hg  Hg5  2  0.1434  0.7500  0.2091  1
  Hg  Hg6  2  0.1789  0.2500  0.6944  1
  Hg  Hg7  2  0.2606  0.7500  0.5256  1
  Hg  Hg8  2  0.3625  0.2500  0.2882  1
  Hg  Hg9  2  0.4629  0.7500  0.0951  1
]