# CIF generated by HEAS from Alexandria entry agm005075111
data_agm005075111
_cell_length_a     5.31515
_cell_length_b     5.31514
_cell_length_c     5.00765
_cell_angle_alpha  89.99822
_cell_angle_beta   90.00207
_cell_angle_gamma  59.99829
_cell_volume       122.51446
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
  'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
  Ti1 Ti 0.66664 0.66667 0.49999 1.00000
  Hg1 Hg 0.99997 0.00000 0.99999 1.00000
  I1 I 0.33331 0.33334 0.49999 1.00000
  O1 O 0.99860 0.37715 0.28136 1.00000
  O2 O 0.37712 0.99863 0.71862 1.00000
  O3 O 0.62422 0.37713 0.71862 1.00000
  O4 O 0.99861 0.62422 0.71862 1.00000
  O5 O 0.37710 0.62426 0.28136 1.00000
  O6 O 0.62419 0.99864 0.28136 1.00000