[CIF]
data_Ti2Hg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.33816746
_cell_length_b   5.33816746
_cell_length_c   5.33816746
_cell_angle_alpha   105.43768407
_cell_angle_beta   105.43768407
_cell_angle_gamma   117.87989592
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2Hg
_chemical_formula_sum   'Ti4 Hg2'
_cell_volume   115.18239499
_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
  Hg  Hg0  1  0.00000000  0.00000000  1.37707690  1
  Hg  Hg1  1  -0.00000000  0.00000000  4.13123070  1
  Ti  Ti2  1  2.30246975  0.93100119  0.00000000  1
  Ti  Ti3  1  2.30246975  -0.93100119  2.75415380  1
  Ti  Ti4  1  0.93100119  4.16447213  0.00000000  1
  Ti  Ti5  1  0.93100119  2.30246975  2.75415380  1
[/CIF]
